#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yee s VAL 2 N 0.00 2.98 -0.01 3.84 1.01 -1.26 -4.01 120.40 122.95 1yee s VAL 2 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1yee s VAL 2 Cb 0.00 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 33.07 1yee s VAL 2 CO 0.00 0.01 0.02 -0.54 0.00 0.00 0.00 175.10 174.58 1yee s LYS 3 N 2.31 -0.01 -0.33 2.72 1.02 -0.86 -5.00 119.74 119.58 1yee s LYS 3 Ca 0.73 0.11 0.03 0.00 0.02 0.00 0.00 55.97 56.86 1yee s LYS 3 Cb -0.40 -0.16 0.10 0.00 -0.52 0.00 0.00 37.83 36.84 1yee s LYS 3 CO 0.32 -0.10 0.04 -0.51 -0.92 0.00 0.00 175.35 174.17 1yee s LEU 4 N 0.66 4.41 -0.37 3.17 1.02 -1.26 -1.19 118.68 125.13 1yee s LEU 4 Ca -0.06 -2.03 -0.16 0.00 0.02 0.00 0.00 54.13 51.90 1yee s LEU 4 Cb -0.08 -1.56 0.00 0.00 0.02 0.00 0.00 46.19 44.57 1yee s LEU 4 CO -0.02 -0.36 0.41 -1.10 0.02 0.00 0.00 176.35 175.30 1yee s GLN 5 N 0.98 3.41 0.21 1.70 -0.21 0.18 -4.03 119.66 121.91 1yee s GLN 5 Ca 0.09 -0.49 -0.07 0.00 0.02 0.00 0.00 55.36 54.91 1yee s GLN 5 Cb -0.19 -3.86 -0.06 0.00 1.00 0.00 0.00 33.01 29.90 1yee s GLN 5 CO -0.09 -0.66 0.49 -1.21 -2.12 0.00 0.00 175.29 171.70 1yee s GLU 6 N 2.12 3.69 1.09 2.91 2.02 -1.26 -0.76 118.70 128.51 1yee s GLU 6 Ca 0.13 0.07 -0.12 0.00 0.02 0.00 0.00 54.97 55.07 1yee s GLU 6 Cb -0.17 -2.72 0.24 0.00 0.10 0.00 0.00 34.13 31.58 1yee s GLU 6 CO 0.13 0.35 1.06 -1.54 0.02 0.00 0.00 175.26 175.27 1yee s SER 7 N -2.59 1.61 0.84 -0.19 1.04 -0.86 -4.96 113.70 108.58 1yee s SER 7 Ca 0.44 1.62 -0.11 0.00 0.48 0.00 0.00 55.95 58.38 1yee s SER 7 Cb -0.11 -2.32 0.09 0.00 0.10 0.00 0.00 66.02 63.78 1yee s SER 7 CO 0.25 -3.83 1.09 -0.83 0.98 0.00 0.00 173.24 170.90 1yee s GLY 8 N -2.67 1.64 0.49 7.32 0.00 -1.26 -4.63 107.32 108.20 1yee s GLY 8 Ca 0.68 0.05 -0.23 0.00 0.00 0.00 0.00 44.72 45.22 1yee s GLY 8 CO 0.62 0.48 1.18 0.00 0.00 0.00 0.00 173.10 175.38 1yee n ALA 9 N -3.70 0.92 -2.41 3.20 0.00 -1.26 -4.78 120.51 112.49 1yee n ALA 9 Ca 0.08 0.17 -0.28 0.00 0.00 0.00 0.00 53.44 53.41 1yee n ALA 9 Cb 0.54 -2.22 -0.15 0.00 0.00 0.00 0.00 19.45 17.63 1yee n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1yee s GLU 10 N -2.43 1.65 -0.22 0.00 0.41 -0.21 -4.98 118.70 112.93 1yee s GLU 10 Ca 0.67 -0.98 -0.04 0.00 -0.41 0.00 0.00 54.97 54.21 1yee s GLU 10 Cb -0.48 -1.75 -0.01 0.00 -1.78 0.00 0.00 34.13 30.11 1yee s GLU 10 CO 0.54 0.46 -0.05 -1.17 -0.49 0.00 0.00 175.26 174.54 1yee s LEU 11 N -1.06 2.86 0.05 1.80 0.20 -1.26 -0.51 118.68 120.76 1yee s LEU 11 Ca 0.09 -0.40 0.05 0.00 0.69 0.00 0.00 54.13 54.56 1yee s LEU 11 Cb -0.09 -1.73 -0.02 0.00 -0.43 0.00 0.00 46.19 43.92 1yee s LEU 11 CO 0.01 -0.01 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.23 1yee s VAL 12 N 1.43 1.07 0.23 1.68 1.01 0.11 -4.97 120.40 120.97 1yee s VAL 12 Ca 0.05 -1.09 -0.15 0.00 0.00 0.00 0.00 61.98 60.79 1yee s VAL 12 Cb -0.14 -0.99 -0.08 0.00 0.00 0.00 0.00 36.38 35.16 1yee s VAL 12 CO -0.03 -0.09 0.66 -0.13 0.00 0.00 0.00 175.10 175.50 1yee s ARG 13 N -1.34 4.04 0.51 2.72 1.81 -1.26 -0.67 118.95 124.77 1yee s ARG 13 Ca -0.00 0.63 -0.22 0.00 -1.72 0.00 0.00 55.73 54.42 1yee s ARG 13 Cb -0.09 -2.73 -0.07 0.00 -0.45 0.00 0.00 34.95 31.62 1yee s ARG 13 CO 0.02 0.33 1.14 -2.30 -0.68 0.00 0.00 175.30 173.81 1yee n PRO 14 N 0.29 1.41 0.00 3.54 -0.02 -1.26 -1.97 135.00 136.99 1yee n PRO 14 Ca -0.01 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1yee n PRO 14 Cb 0.52 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1yee n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yee n GLY 15 N 1.03 3.00 3.05 -1.23 0.00 0.20 -4.88 105.19 106.36 1yee n GLY 15 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 1yee n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yee n ALA 16 N -0.28 -2.09 -2.50 4.61 0.00 -0.83 -3.83 120.51 115.58 1yee n ALA 16 Ca 0.00 -1.40 -0.23 0.00 0.00 0.00 0.00 53.44 51.81 1yee n ALA 16 Cb 0.00 -0.08 -0.12 0.00 0.00 0.00 0.00 19.45 19.25 1yee n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1yee s SER 17 N -4.49 2.62 0.04 0.00 0.15 -1.26 -2.56 113.70 108.21 1yee s SER 17 Ca 0.61 -0.75 0.03 0.00 0.70 0.00 0.00 55.95 56.54 1yee s SER 17 Cb -0.04 -0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.10 1yee s SER 17 CO 0.45 0.03 -0.10 0.68 1.20 0.00 0.00 173.24 175.49 1yee s VAL 18 N -1.49 0.77 -0.26 4.45 -7.23 0.24 -4.97 120.40 111.90 1yee s VAL 18 Ca 0.10 -0.93 0.02 0.00 -1.81 0.00 0.00 61.98 59.37 1yee s VAL 18 Cb -0.08 -0.75 0.06 0.00 0.56 0.00 0.00 36.38 36.17 1yee s VAL 18 CO 0.05 -0.15 -0.10 -0.75 -0.31 0.00 0.00 175.10 173.84 1yee s LYS 19 N -1.20 2.30 -0.05 4.82 2.20 -1.26 -0.61 119.74 125.94 1yee s LYS 19 Ca -0.03 -1.31 -0.14 0.00 -0.36 0.00 0.00 55.97 54.12 1yee s LYS 19 Cb -0.08 -2.91 -0.05 0.00 -1.51 0.00 0.00 37.83 33.28 1yee s LYS 19 CO 0.01 -0.56 0.37 -0.51 -0.36 0.00 0.00 175.35 174.30 1yee s LEU 20 N 1.13 4.41 0.15 5.43 1.43 0.66 -4.93 118.68 126.96 1yee s LEU 20 Ca -0.08 0.82 0.08 0.00 -1.03 0.00 0.00 54.13 53.92 1yee s LEU 20 Cb -0.20 -2.51 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 1yee s LEU 20 CO -0.05 0.26 -0.11 -0.94 0.23 0.00 0.00 176.35 175.74 1yee s SER 21 N -0.62 4.21 -0.36 2.29 1.04 -1.26 -1.31 113.70 117.69 1yee s SER 21 Ca 0.22 -0.53 -0.00 0.00 0.48 0.00 0.00 55.95 56.11 1yee s SER 21 Cb -0.15 -0.71 0.12 0.00 0.10 0.00 0.00 66.02 65.38 1yee s SER 21 CO 0.10 0.13 0.18 0.00 0.98 0.00 0.00 173.24 174.64 1yee s LYS 23 N 1.16 4.43 0.23 0.00 2.36 0.06 -1.14 119.74 126.83 1yee s LYS 23 Ca 0.15 1.17 0.08 0.00 -2.55 0.00 0.00 55.97 54.82 1yee s LYS 23 Cb -0.21 -3.51 -0.04 0.00 -1.05 0.00 0.00 37.83 33.02 1yee s LYS 23 CO -0.10 -0.16 0.08 0.95 1.55 0.00 0.00 175.35 177.66 1yee s THR 24 N 1.50 3.95 0.06 3.43 -4.23 -0.41 0.47 115.64 120.41 1yee s THR 24 Ca 0.44 -1.55 -0.23 0.00 -1.18 0.00 0.00 61.69 59.16 1yee s THR 24 Cb -0.18 -3.08 0.06 0.00 1.34 0.00 0.00 72.50 70.63 1yee s THR 24 CO 0.19 -0.28 0.55 -0.94 -0.54 0.00 0.00 174.62 173.60 1yee s SER 25 N -3.51 -0.48 0.00 3.99 1.04 -0.34 -4.87 113.70 109.53 1yee s SER 25 Ca 0.31 0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.92 1yee s SER 25 Cb -0.08 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1yee s SER 25 CO 0.22 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1yee n GLY 26 N 0.28 0.71 3.64 7.32 0.00 -1.26 -2.03 105.19 113.86 1yee n GLY 26 Ca -0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 1yee n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yee s TYR 27 N -2.07 -0.35 -0.49 1.61 1.13 -1.26 -4.12 117.35 111.79 1yee s TYR 27 Ca 0.00 0.03 -0.28 0.00 -1.41 0.00 0.00 57.07 55.41 1yee s TYR 27 Cb 0.00 0.63 0.01 0.00 -1.10 0.00 0.00 41.96 41.50 1yee s TYR 27 CO 0.00 -1.01 1.45 0.42 -2.51 0.00 0.00 175.55 173.90 1yee s ILE 28 N -3.77 3.81 0.22 -3.49 1.01 -1.26 -4.91 121.20 112.81 1yee s ILE 28 Ca 0.06 0.75 -0.10 0.00 0.00 0.00 0.00 60.65 61.36 1yee s ILE 28 Cb -0.03 -4.28 0.21 0.00 0.01 0.00 0.00 42.46 38.36 1yee s ILE 28 CO -0.03 -0.95 1.66 0.15 0.00 0.00 0.00 174.94 175.77 1yee h PHE 29 N 11.16 -0.03 0.00 3.97 3.57 -1.97 -2.18 116.94 131.47 1yee h PHE 29 Ca -0.27 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1yee h PHE 29 Cb 1.10 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.95 1yee h PHE 29 CO 1.00 -0.17 0.00 0.25 -2.23 0.00 0.00 178.31 177.17 1yee n THR 30 N -5.28 0.86 0.48 4.41 -2.24 -1.26 -3.39 114.28 107.87 1yee n THR 30 Ca 0.10 0.22 0.12 0.00 -2.27 0.00 0.00 64.05 62.21 1yee n THR 30 Cb 0.37 -0.97 0.13 0.00 -2.10 0.00 0.00 70.33 67.76 1yee n THR 30 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1yee h SER 31 N 0.00 0.00 -4.38 3.42 0.02 -1.79 -3.06 113.55 107.76 1yee h SER 31 Ca 0.00 -0.18 -0.44 0.00 -0.84 0.00 0.00 61.79 60.33 1yee h SER 31 Cb 0.22 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.55 1yee h SER 31 CO 0.00 0.09 -0.79 -0.31 -1.14 0.00 0.00 176.83 174.69 1yee s TYR 32 N -3.20 1.34 0.29 3.45 2.02 -1.22 -5.08 117.35 114.95 1yee s TYR 32 Ca 0.05 -0.46 -0.29 0.00 -0.37 0.00 0.00 57.07 56.00 1yee s TYR 32 Cb 0.13 -0.75 -0.09 0.00 -0.40 0.00 0.00 41.96 40.85 1yee s TYR 32 CO 0.74 0.09 1.04 -1.58 -1.57 0.00 0.00 175.55 174.27 1yee s TRP 33 N -1.33 3.66 -0.13 2.71 0.52 -1.26 -4.34 118.94 118.76 1yee s TRP 33 Ca 0.01 1.76 -0.01 0.00 0.02 0.00 0.00 56.10 57.87 1yee s TRP 33 Cb -0.10 -3.16 -0.02 0.00 -1.15 0.00 0.00 33.47 29.05 1yee s TRP 33 CO 0.03 -0.23 -0.09 0.42 0.02 0.00 0.00 176.95 177.09 1yee s ILE 34 N -1.26 3.40 0.17 2.03 -1.09 -0.64 -4.20 121.20 119.62 1yee s ILE 34 Ca 0.46 -0.54 0.08 0.00 -2.23 0.00 0.00 60.65 58.41 1yee s ILE 34 Cb -0.28 -2.44 -0.04 0.00 -1.58 0.00 0.00 42.46 38.11 1yee s ILE 34 CO 0.36 0.52 -0.06 -1.00 -1.23 0.00 0.00 174.94 173.53 1yee s HIS 35 N 0.20 2.72 -0.11 3.97 3.76 -0.19 -0.91 115.29 124.73 1yee s HIS 35 Ca -0.05 -0.19 0.03 0.00 -0.15 0.00 0.00 55.06 54.70 1yee s HIS 35 Cb -0.15 -1.33 -0.00 0.00 1.11 0.00 0.00 32.58 32.21 1yee s HIS 35 CO 0.04 0.51 -0.22 -1.58 -0.85 0.00 0.00 174.74 172.64 1yee s TRP 36 N -1.67 2.61 -0.01 1.40 0.52 0.55 -0.61 118.94 121.74 1yee s TRP 36 Ca 0.25 -1.02 0.07 0.00 0.02 0.00 0.00 56.10 55.42 1yee s TRP 36 Cb -0.09 -1.74 -0.02 0.00 -1.15 0.00 0.00 33.47 30.47 1yee s TRP 36 CO 0.16 -0.41 -0.21 0.08 0.02 0.00 0.00 176.95 176.59 1yee s VAL 37 N 0.40 1.66 -0.09 4.03 1.01 0.26 -1.59 120.40 126.08 1yee s VAL 37 Ca -0.16 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 60.86 1yee s VAL 37 Cb -0.17 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1yee s VAL 37 CO 0.07 0.43 -0.04 -0.75 0.00 0.00 0.00 175.10 174.81 1yee s LYS 38 N -0.60 3.04 -0.18 2.72 2.20 0.44 0.15 119.74 127.51 1yee s LYS 38 Ca 0.08 -0.49 -0.01 0.00 -0.36 0.00 0.00 55.97 55.19 1yee s LYS 38 Cb -0.08 -2.73 0.05 0.00 -1.51 0.00 0.00 37.83 33.55 1yee s LYS 38 CO -0.00 0.58 -0.02 -1.14 -0.36 0.00 0.00 175.35 174.41 1yee s GLN 39 N -0.56 1.12 -0.15 4.03 0.74 0.74 -1.09 119.66 124.50 1yee s GLN 39 Ca 0.09 -0.52 -0.07 0.00 0.05 0.00 0.00 55.36 54.91 1yee s GLN 39 Cb -0.12 -2.06 -0.04 0.00 1.10 0.00 0.00 33.01 31.89 1yee s GLN 39 CO 0.02 -0.52 0.11 0.50 -0.55 0.00 0.00 175.29 174.85 1yee s ARG 40 N 1.70 3.69 -0.70 1.67 3.52 -1.21 -1.47 118.95 126.16 1yee s ARG 40 Ca -0.01 -0.21 -0.15 0.00 -0.13 0.00 0.00 55.73 55.24 1yee s ARG 40 Cb -0.16 -3.23 -0.18 0.00 -1.56 0.00 0.00 34.95 29.83 1yee s ARG 40 CO -0.07 0.56 1.88 0.00 -0.81 0.00 0.00 175.30 176.86 1yee n ALA 41 N 2.66 0.54 -2.02 6.12 0.00 -1.26 -3.52 120.51 123.02 1yee n ALA 41 Ca -0.18 -1.35 -0.00 0.00 0.00 0.00 0.00 53.44 51.90 1yee n ALA 41 Cb 0.54 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1yee n ALA 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yee n ALA 42 N 11.86 -1.26 -2.62 0.00 0.00 -1.26 -4.97 120.51 122.26 1yee n ALA 42 Ca 0.38 -0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.71 1yee n ALA 42 Cb 0.39 -0.39 -0.00 0.00 0.00 0.00 0.00 19.45 19.44 1yee n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yee n ALA 43 N -0.07 -1.01 -2.70 0.00 0.00 -1.23 -4.86 120.51 110.63 1yee n ALA 43 Ca -0.02 -0.01 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 1yee n ALA 43 Cb 0.41 -0.64 -0.12 0.00 0.00 0.00 0.00 19.45 19.10 1yee n ALA 43 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1yee s GLY 44 N -2.07 1.64 -0.07 0.00 0.00 -1.24 -5.07 107.32 100.51 1yee s GLY 44 Ca 0.05 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 43.90 1yee s GLY 44 CO 0.06 -0.51 -0.15 1.08 0.00 0.00 0.00 173.10 173.58 1yee s LEU 45 N -0.41 2.66 -0.02 0.66 1.43 -1.26 -3.29 118.68 118.45 1yee s LEU 45 Ca 0.06 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1yee s LEU 45 Cb -0.12 -1.54 0.02 0.00 0.03 0.00 0.00 46.19 44.57 1yee s LEU 45 CO 0.02 0.30 -0.03 -0.70 0.23 0.00 0.00 176.35 176.17 1yee s GLU 46 N -0.45 0.46 -0.19 1.70 2.12 -0.25 -4.98 118.70 117.12 1yee s GLU 46 Ca 0.05 -0.05 -0.23 0.00 0.36 0.00 0.00 54.97 55.11 1yee s GLU 46 Cb -0.12 -0.53 -0.02 0.00 0.26 0.00 0.00 34.13 33.72 1yee s GLU 46 CO 0.02 -0.04 0.71 -0.46 -0.54 0.00 0.00 175.26 174.95 1yee s TRP 47 N 0.62 3.38 -0.16 5.30 -0.00 -1.26 -0.42 118.94 126.39 1yee s TRP 47 Ca -0.07 1.05 -0.13 0.00 -0.00 0.00 0.00 56.10 56.95 1yee s TRP 47 Cb -0.10 -2.89 -0.05 0.00 -0.00 0.00 0.00 33.47 30.42 1yee s TRP 47 CO -0.01 -0.22 -0.24 -0.89 -0.00 0.00 0.00 176.95 175.60 1yee n ILE 48 N 4.77 1.46 -3.66 5.86 5.41 -0.62 -4.71 119.36 127.88 1yee n ILE 48 Ca 0.01 0.15 -0.00 0.00 1.00 0.00 0.00 62.75 63.91 1yee n ILE 48 Cb 0.49 -2.34 -0.01 0.00 -0.71 0.00 0.00 39.64 37.07 1yee n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1yee s ALA 49 N -2.78 -2.05 0.06 -1.39 0.00 -1.22 -0.61 121.76 113.77 1yee s ALA 49 Ca -0.22 0.57 0.02 0.00 0.00 0.00 0.00 51.96 52.32 1yee s ALA 49 Cb 0.03 0.42 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 1yee s ALA 49 CO 0.33 -1.03 -0.07 -0.98 0.00 0.00 0.00 175.76 174.02 1yee s ARG 50 N -2.70 0.63 -0.00 0.00 1.70 -0.71 -0.33 118.95 117.54 1yee s ARG 50 Ca 0.13 -0.98 -0.01 0.00 -0.47 0.00 0.00 55.73 54.40 1yee s ARG 50 Cb 0.03 -0.21 -0.00 0.00 -0.57 0.00 0.00 34.95 34.20 1yee s ARG 50 CO -0.02 0.01 0.02 -1.50 -1.08 0.00 0.00 175.30 172.73 1yee s ILE 51 N -2.33 0.02 -0.46 4.99 2.07 -0.08 -0.90 121.20 124.50 1yee s ILE 51 Ca -0.02 -0.16 -0.12 0.00 -1.41 0.00 0.00 60.65 58.95 1yee s ILE 51 Cb -0.04 -0.09 0.10 0.00 0.13 0.00 0.00 42.46 42.56 1yee s ILE 51 CO -0.02 -0.09 0.35 -0.47 -1.91 0.00 0.00 174.94 172.80 1yee s TYR 52 N -0.26 3.33 0.63 3.50 5.04 0.11 -1.61 117.35 128.09 1yee s TYR 52 Ca -0.03 -1.45 0.35 0.00 -2.44 0.00 0.00 57.07 53.50 1yee s TYR 52 Cb -0.02 -3.27 1.95 0.00 0.35 0.00 0.00 41.96 40.97 1yee s TYR 52 CO -0.00 -0.90 2.19 -1.35 -1.34 0.00 0.00 175.55 174.15 1yee h PRO 52 N 8.57 0.00 0.00 4.97 0.11 -1.81 0.37 132.00 144.20 1yee h PRO 52 Ca -0.25 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.79 1yee h PRO 52 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1yee h PRO 52 CO 0.85 0.00 -0.36 0.78 -0.21 0.00 0.00 178.00 179.07 1yee h GLY 53 N 0.00 0.00 0.00 -0.55 0.00 -1.82 -3.33 103.07 97.38 1yee h GLY 53 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1yee h GLY 53 CO -0.00 0.00 -0.28 -1.30 0.00 0.00 0.00 176.54 174.96 1yee n THR 54 N -3.96 0.00 -0.90 4.70 -2.24 -0.61 -5.00 114.28 106.27 1yee n THR 54 Ca -0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1yee n THR 54 Cb 0.41 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1yee n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yee n GLY 55 N 1.15 0.69 3.68 3.38 0.00 0.12 -4.99 105.19 109.21 1yee n GLY 55 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1yee n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yee s SER 56 N -2.34 6.72 0.09 1.61 0.15 -1.21 -4.77 113.70 113.94 1yee s SER 56 Ca 0.00 2.24 0.09 0.00 0.70 0.00 0.00 55.95 58.99 1yee s SER 56 Cb 0.00 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 1yee s SER 56 CO 0.00 -0.85 -0.25 -0.44 1.20 0.00 0.00 173.24 172.91 1yee s SER 57 N 2.59 2.99 -0.07 5.45 0.01 -1.26 -0.71 113.70 122.70 1yee s SER 57 Ca 0.70 -0.65 0.03 0.00 1.31 0.00 0.00 55.95 57.34 1yee s SER 57 Cb -0.34 -0.22 0.01 0.00 0.21 0.00 0.00 66.02 65.67 1yee s SER 57 CO 0.29 0.18 -0.16 -0.31 0.41 0.00 0.00 173.24 173.65 1yee s TYR 58 N -0.96 1.72 0.03 2.43 2.02 -0.08 -5.00 117.35 117.51 1yee s TYR 58 Ca 0.11 -0.62 0.08 0.00 -0.37 0.00 0.00 57.07 56.27 1yee s TYR 58 Cb -0.10 -1.20 -0.03 0.00 -0.40 0.00 0.00 41.96 40.23 1yee s TYR 58 CO 0.04 -0.27 -0.23 0.71 -1.57 0.00 0.00 175.55 174.23 1yee s TYR 59 N 0.43 2.42 0.00 2.71 1.51 -1.26 -1.73 117.35 121.43 1yee s TYR 59 Ca -0.12 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.28 1yee s TYR 59 Cb -0.15 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.21 1yee s TYR 59 CO 0.04 0.14 1.18 1.21 -1.11 0.00 0.00 175.55 177.01 1yee s ASN 60 N -1.15 7.09 0.51 2.29 3.84 0.22 -4.90 114.94 122.85 1yee s ASN 60 Ca 0.12 1.89 0.25 0.00 0.21 0.00 0.00 52.86 55.33 1yee s ASN 60 Cb -0.10 -2.57 1.36 0.00 -0.55 0.00 0.00 41.25 39.39 1yee s ASN 60 CO 0.02 -0.50 1.95 0.58 -2.79 0.00 0.00 177.10 176.36 1yee h VAL 61 N 4.77 0.70 -0.32 -5.21 2.07 -1.95 0.14 116.25 116.45 1yee h VAL 61 Ca -0.38 -0.03 0.09 0.00 0.82 0.00 0.00 66.70 67.21 1yee h VAL 61 Cb 1.19 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1yee h VAL 61 CO 0.84 0.01 0.25 0.11 0.02 0.00 0.00 177.57 178.80 1yee h LYS 62 N 0.07 0.00 -0.24 1.57 1.57 -1.95 -2.44 116.57 115.15 1yee h LYS 62 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1yee h LYS 62 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1yee h LYS 62 CO -0.03 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.04 1yee n PHE 63 N -4.30 0.31 -1.87 -1.35 3.72 0.47 -4.91 117.46 109.53 1yee n PHE 63 Ca 0.05 -0.24 -0.42 0.00 -0.05 0.00 0.00 57.45 56.78 1yee n PHE 63 Cb 0.41 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.92 1yee n PHE 63 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1yee s LYS 64 N -1.14 4.18 0.00 -1.08 2.20 -0.92 -1.58 119.74 121.39 1yee s LYS 64 Ca 0.25 2.39 0.00 0.00 -0.36 0.00 0.00 55.97 58.25 1yee s LYS 64 Cb 0.15 -3.74 0.00 0.00 -1.51 0.00 0.00 37.83 32.72 1yee s LYS 64 CO 0.20 -0.80 0.00 0.41 -0.36 0.00 0.00 175.35 174.80 1yee n GLY 65 N 4.13 3.09 0.11 5.54 0.00 -1.26 -4.81 105.19 111.99 1yee n GLY 65 Ca 0.17 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 45.13 1yee n GLY 65 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1yee h LYS 66 N 0.00 0.24 -6.25 1.61 1.63 -1.70 -3.46 116.57 108.63 1yee h LYS 66 Ca 0.00 -0.22 -0.62 0.00 -0.85 0.00 0.00 60.65 58.95 1yee h LYS 66 Cb 0.00 0.06 -0.10 0.00 -0.60 0.00 0.00 32.23 31.59 1yee h LYS 66 CO 0.00 0.91 -0.62 0.00 -3.45 0.00 0.00 179.45 176.29 1yee s ALA 67 N -3.35 3.45 -0.17 5.00 0.00 -0.62 -4.01 121.76 122.07 1yee s ALA 67 Ca -0.15 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 50.65 1yee s ALA 67 Cb 0.02 -1.31 0.08 0.00 0.00 0.00 0.00 23.12 21.92 1yee s ALA 67 CO 0.75 0.66 0.25 0.99 0.00 0.00 0.00 175.76 178.41 1yee s THR 68 N -1.48 -0.38 0.04 0.00 2.01 -0.08 -4.86 115.64 110.89 1yee s THR 68 Ca 0.28 0.09 -0.15 0.00 0.31 0.00 0.00 61.69 62.22 1yee s THR 68 Cb -0.11 -0.56 -0.06 0.00 0.01 0.00 0.00 72.50 71.78 1yee s THR 68 CO 0.21 -0.04 0.46 -0.76 -0.69 0.00 0.00 174.62 173.80 1yee s LEU 69 N 2.38 4.46 0.08 4.42 1.43 -1.26 -0.89 118.68 129.30 1yee s LEU 69 Ca 0.05 1.02 -0.02 0.00 -1.03 0.00 0.00 54.13 54.15 1yee s LEU 69 Cb -0.14 -2.76 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 1yee s LEU 69 CO -0.10 0.28 0.03 0.42 0.23 0.00 0.00 176.35 177.20 1yee s THR 70 N -1.16 0.18 -0.04 5.49 -4.23 -0.62 -5.00 115.64 110.27 1yee s THR 70 Ca 0.27 -1.73 -0.03 0.00 -1.18 0.00 0.00 61.69 59.02 1yee s THR 70 Cb -0.17 -1.62 0.02 0.00 1.34 0.00 0.00 72.50 72.07 1yee s THR 70 CO 0.16 -0.81 0.10 0.00 -0.54 0.00 0.00 174.62 173.53 1yee s ALA 71 N -3.94 -0.21 -0.47 3.99 0.00 -1.26 0.29 121.76 120.15 1yee s ALA 71 Ca 0.11 0.40 -0.09 0.00 0.00 0.00 0.00 51.96 52.38 1yee s ALA 71 Cb 0.07 -0.26 0.12 0.00 0.00 0.00 0.00 23.12 23.05 1yee s ALA 71 CO -0.07 -0.09 0.34 0.34 0.00 0.00 0.00 175.76 176.28 1yee s ASP 72 N 0.51 5.69 0.42 0.00 2.15 0.10 -4.96 116.67 120.58 1yee s ASP 72 Ca -0.04 -1.93 0.13 0.00 0.43 0.00 0.00 52.55 51.14 1yee s ASP 72 Cb -0.05 -2.01 0.98 0.00 -0.30 0.00 0.00 42.92 41.54 1yee s ASP 72 CO -0.02 -0.69 1.95 0.11 -0.17 0.00 0.00 175.17 176.35 1yee h LYS 73 N 8.43 0.47 -0.22 4.34 1.57 -1.90 0.82 116.57 130.08 1yee h LYS 73 Ca -0.21 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1yee h LYS 73 Cb 1.07 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1yee h LYS 73 CO 0.86 0.31 -0.08 0.66 -0.57 0.00 0.00 179.45 180.63 1yee h SER 74 N 0.48 0.45 0.05 0.86 4.64 -1.96 -3.21 113.55 114.87 1yee h SER 74 Ca 0.32 -0.39 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1yee h SER 74 Cb 0.60 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1yee h SER 74 CO -0.10 0.74 -0.12 -1.54 -0.87 0.00 0.00 176.83 174.94 1yee n SER 75 N -4.56 1.66 -3.63 4.97 3.41 -1.07 -4.96 113.62 109.44 1yee n SER 75 Ca -0.04 -1.41 -0.25 0.00 -0.26 0.00 0.00 58.87 56.90 1yee n SER 75 Cb 0.31 0.08 0.07 0.00 -0.26 0.00 0.00 64.21 64.41 1yee n SER 75 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1yee n SER 76 N 0.11 -6.10 -4.22 4.04 7.64 0.26 -4.73 113.62 110.63 1yee n SER 76 Ca 0.15 -0.57 -0.32 0.00 1.01 0.00 0.00 58.87 59.14 1yee n SER 76 Cb 0.40 -4.81 -0.17 0.00 -1.01 0.00 0.00 64.21 58.62 1yee n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1yee s THR 77 N -3.31 2.10 0.20 0.44 2.01 -1.10 -1.29 115.64 114.69 1yee s THR 77 Ca 0.59 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.61 1yee s THR 77 Cb -0.27 -1.81 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 1yee s THR 77 CO 0.73 0.56 0.35 0.00 -0.69 0.00 0.00 174.62 175.56 1yee s ALA 78 N 0.43 3.91 0.04 7.40 0.00 -0.29 0.03 121.76 133.27 1yee s ALA 78 Ca -0.17 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 50.78 1yee s ALA 78 Cb -0.17 -1.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.08 1yee s ALA 78 CO 0.07 0.40 -0.05 0.71 0.00 0.00 0.00 175.76 176.88 1yee s TYR 79 N -1.87 0.51 -0.07 0.00 2.02 0.14 -1.35 117.35 116.72 1yee s TYR 79 Ca 0.36 -0.62 -0.01 0.00 -0.37 0.00 0.00 57.07 56.43 1yee s TYR 79 Cb -0.10 -0.33 0.03 0.00 -0.40 0.00 0.00 41.96 41.16 1yee s TYR 79 CO 0.29 -0.17 -0.01 1.41 -1.57 0.00 0.00 175.55 175.51 1yee s MET 80 N -2.01 0.71 -0.17 -0.62 -2.45 -0.43 -1.58 119.30 112.75 1yee s MET 80 Ca -0.08 0.06 -0.08 0.00 -1.25 0.00 0.00 55.69 54.34 1yee s MET 80 Cb -0.07 -1.03 -0.04 0.00 1.25 0.00 0.00 34.83 34.94 1yee s MET 80 CO -0.02 -0.29 0.10 -1.14 1.05 0.00 0.00 175.02 174.72 1yee s GLN 81 N 1.91 3.91 0.29 4.11 0.74 -0.06 -0.24 119.66 130.31 1yee s GLN 81 Ca 0.04 -0.25 0.10 0.00 0.05 0.00 0.00 55.36 55.30 1yee s GLN 81 Cb -0.12 -3.27 -0.05 0.00 1.10 0.00 0.00 33.01 30.67 1yee s GLN 81 CO -0.05 0.41 -0.08 -0.51 -0.55 0.00 0.00 175.29 174.51 1yee s LEU 82 N 0.02 2.90 -0.12 3.68 1.43 0.22 -0.90 118.68 125.91 1yee s LEU 82 Ca 0.08 -0.90 -0.01 0.00 -1.03 0.00 0.00 54.13 52.27 1yee s LEU 82 Cb -0.12 -1.36 0.01 0.00 0.03 0.00 0.00 46.19 44.75 1yee s LEU 82 CO 0.00 -0.05 0.02 -1.20 0.23 0.00 0.00 176.35 175.35 1yee n SER 82 N -0.80 -0.04 -4.75 2.29 7.64 -1.14 -0.59 113.62 116.23 1yee n SER 82 Ca -0.05 -0.09 -0.39 0.00 1.01 0.00 0.00 58.87 59.35 1yee n SER 82 Cb 0.60 -0.11 0.04 0.00 -1.01 0.00 0.00 64.21 63.73 1yee n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1yee s LEU 82 N -2.30 3.88 0.13 -3.43 1.43 -1.06 -4.58 118.68 112.76 1yee s LEU 82 Ca 0.03 2.80 -0.02 0.00 -1.03 0.00 0.00 54.13 55.91 1yee s LEU 82 Cb -0.02 -4.23 -0.03 0.00 0.03 0.00 0.00 46.19 41.94 1yee s LEU 82 CO 0.07 -1.55 0.09 -1.59 0.23 0.00 0.00 176.35 173.61 1yee s LYS 83 N -2.86 0.94 0.32 1.70 -2.85 -1.26 0.58 119.74 116.31 1yee s LYS 83 Ca 0.70 -1.37 0.07 0.00 -1.00 0.00 0.00 55.97 54.38 1yee s LYS 83 Cb -0.41 0.26 0.79 0.00 -2.06 0.00 0.00 37.83 36.41 1yee s LYS 83 CO 0.49 -0.28 1.78 0.66 0.10 0.00 0.00 175.35 178.10 1yee h SER 84 N 2.83 0.74 0.10 0.03 4.64 -1.97 -0.06 113.55 119.86 1yee h SER 84 Ca -0.34 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1yee h SER 84 Cb 1.20 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1yee h SER 84 CO 0.58 0.25 0.00 0.47 -0.87 0.00 0.00 176.83 177.25 1yee n ASP 85 N -4.75 0.00 -0.10 4.97 8.00 -1.26 -1.59 116.55 121.82 1yee n ASP 85 Ca 0.23 -0.03 0.12 0.00 0.71 0.00 0.00 54.79 55.83 1yee n ASP 85 Cb 0.61 -0.17 0.26 0.00 -0.02 0.00 0.00 41.12 41.79 1yee n ASP 85 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1yee n ASP 86 N -1.17 0.76 -4.69 -2.24 8.00 -0.04 -4.87 116.55 112.30 1yee n ASP 86 Ca 0.05 -0.55 -0.42 0.00 0.71 0.00 0.00 54.79 54.58 1yee n ASP 86 Cb 0.06 0.27 -0.03 0.00 -0.02 0.00 0.00 41.12 41.40 1yee n ASP 86 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1yee s SER 87 N -2.82 6.56 -0.02 -2.24 0.01 -0.62 -4.89 113.70 109.68 1yee s SER 87 Ca 0.15 2.54 -0.11 0.00 1.31 0.00 0.00 55.95 59.84 1yee s SER 87 Cb 0.18 -2.56 0.03 0.00 0.21 0.00 0.00 66.02 63.88 1yee s SER 87 CO 0.65 -0.93 0.47 0.00 0.41 0.00 0.00 173.24 173.85 1yee n ALA 88 N 5.86 -1.36 -3.28 1.44 0.00 -0.76 -4.85 120.51 117.56 1yee n ALA 88 Ca 0.17 -0.27 -0.34 0.00 0.00 0.00 0.00 53.44 53.00 1yee n ALA 88 Cb 0.40 0.02 -0.14 0.00 0.00 0.00 0.00 19.45 19.73 1yee n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yee s VAL 89 N -2.04 3.38 -0.18 0.00 1.01 -0.54 -0.68 120.40 121.34 1yee s VAL 89 Ca 0.11 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 1yee s VAL 89 Cb -0.00 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 1yee s VAL 89 CO -0.01 0.47 0.02 -0.31 0.00 0.00 0.00 175.10 175.27 1yee s TYR 90 N 0.94 3.13 -0.00 5.22 1.51 -0.40 -0.19 117.35 127.55 1yee s TYR 90 Ca -0.01 -0.18 0.02 0.00 -1.01 0.00 0.00 57.07 55.89 1yee s TYR 90 Cb -0.15 -2.06 -0.04 0.00 -0.11 0.00 0.00 41.96 39.61 1yee s TYR 90 CO 0.00 -0.02 -0.02 -0.06 -1.11 0.00 0.00 175.55 174.35 1yee s PHE 91 N 0.59 3.03 -0.06 2.71 0.08 0.12 -1.75 117.98 122.71 1yee s PHE 91 Ca 0.01 0.05 -0.01 0.00 0.12 0.00 0.00 56.93 57.10 1yee s PHE 91 Cb -0.14 -1.65 -0.03 0.00 -0.57 0.00 0.00 43.02 40.63 1yee s PHE 91 CO 0.02 0.44 0.02 0.00 -0.10 0.00 0.00 175.22 175.60 1yee s VAL 93 N -0.99 0.16 -1.11 0.00 1.01 0.22 -0.85 120.40 118.84 1yee s VAL 93 Ca 0.16 0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 1yee s VAL 93 Cb -0.11 -0.22 0.26 0.00 0.00 0.00 0.00 36.38 36.30 1yee s VAL 93 CO 0.06 0.11 1.15 -0.60 0.00 0.00 0.00 175.10 175.82 1yee s ARG 94 N 0.66 4.15 0.31 2.72 3.52 0.51 -1.02 118.95 129.80 1yee s ARG 94 Ca -0.06 -3.06 0.08 0.00 -0.13 0.00 0.00 55.73 52.56 1yee s ARG 94 Cb -0.09 -4.64 0.84 0.00 -1.56 0.00 0.00 34.95 29.50 1yee s ARG 94 CO -0.01 -1.34 1.73 2.35 -0.81 0.00 0.00 175.30 177.22 1yee h TRP 95 N 6.83 0.99 0.00 5.12 2.91 -1.79 -2.03 115.95 127.99 1yee h TRP 95 Ca 0.20 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.25 1yee h TRP 95 Cb 0.88 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 29.25 1yee h TRP 95 CO 0.83 0.09 0.00 0.41 -1.03 0.00 0.00 178.44 178.74 1yee n GLY 96 N -1.32 0.12 3.69 2.65 0.00 -1.26 -3.84 105.19 105.24 1yee n GLY 96 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 1yee n GLY 96 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1yee s PHE 97 N -2.02 3.26 -0.46 1.61 5.36 -1.26 0.22 117.98 124.68 1yee s PHE 97 Ca 0.00 1.25 -0.10 0.00 -0.96 0.00 0.00 56.93 57.11 1yee s PHE 97 Cb 0.00 -3.41 0.11 0.00 -0.34 0.00 0.00 43.02 39.37 1yee s PHE 97 CO 0.00 -1.28 0.34 0.42 -1.46 0.00 0.00 175.22 173.24 1yee s ILE 98 N 1.88 4.40 0.19 3.12 -1.09 0.69 -4.84 121.20 125.55 1yee s ILE 98 Ca 0.57 -1.59 -0.17 0.00 -2.23 0.00 0.00 60.65 57.23 1yee s ILE 98 Cb -0.26 -3.81 0.17 0.00 -1.58 0.00 0.00 42.46 36.98 1yee s ILE 98 CO 0.24 -0.69 1.61 -0.65 -1.23 0.00 0.00 174.94 174.22 1yee h PRO 99 N 8.51 -0.09 -0.80 2.79 0.11 -1.94 1.19 132.00 141.78 1yee h PRO 99 Ca -0.23 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.95 1yee h PRO 99 Cb 1.08 0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1yee h PRO 99 CO 0.85 -0.06 0.52 -0.39 -0.21 0.00 0.00 178.00 178.71 1yee h VAL 100 N -0.10 1.04 0.00 3.15 -1.51 -1.96 -2.08 116.25 114.79 1yee h VAL 100 Ca 0.26 -0.30 -0.14 0.00 -1.23 0.00 0.00 66.70 65.29 1yee h VAL 100 Cb 0.50 0.10 -0.02 0.00 -2.13 0.00 0.00 31.29 29.73 1yee h VAL 100 CO -0.63 0.16 -1.31 0.03 -1.23 0.00 0.00 177.57 174.59 1yee h ARG 100 N 0.86 0.00 -4.10 5.19 2.47 -1.74 -3.47 114.38 113.58 1yee h ARG 100 Ca 0.34 0.00 -0.41 0.00 -1.26 0.00 0.00 59.98 58.66 1yee h ARG 100 Cb 0.24 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 28.59 1yee h ARG 100 CO -0.12 0.26 -0.58 0.39 0.56 0.00 0.00 179.97 180.48 1yee n GLU 100 N -2.88 -3.93 -4.62 0.04 1.02 0.40 -4.97 120.64 105.70 1yee n GLU 100 Ca -0.08 0.92 -0.29 0.00 -0.02 0.00 0.00 57.16 57.69 1yee n GLU 100 Cb 0.80 -5.72 -0.07 0.00 -0.02 0.00 0.00 31.44 26.42 1yee n GLU 100 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1yee s ASP 100 N -2.51 3.35 0.10 1.62 -1.08 -1.12 -4.95 116.67 112.08 1yee s ASP 100 Ca 0.22 -1.72 0.08 0.00 -0.52 0.00 0.00 52.55 50.61 1yee s ASP 100 Cb -0.10 0.63 -0.03 0.00 -1.46 0.00 0.00 42.92 41.95 1yee s ASP 100 CO 0.27 -0.96 -0.22 -0.31 0.52 0.00 0.00 175.17 174.47 1yee s TYR 100 N -3.08 1.86 0.24 -5.34 1.51 -1.26 -0.22 117.35 111.06 1yee s TYR 100 Ca 0.15 -0.41 0.09 0.00 -1.01 0.00 0.00 57.07 55.89 1yee s TYR 100 Cb 0.01 -1.02 -0.05 0.00 -0.11 0.00 0.00 41.96 40.79 1yee s TYR 100 CO 0.10 0.21 -0.16 0.54 -1.11 0.00 0.00 175.55 175.14 1yee s VAL 100 N -1.12 2.02 0.41 0.71 0.11 0.13 -4.97 120.40 117.68 1yee s VAL 100 Ca 0.07 -2.28 -0.25 0.00 -2.93 0.00 0.00 61.98 56.59 1yee s VAL 100 Cb -0.10 -2.19 -0.11 0.00 -1.53 0.00 0.00 36.38 32.45 1yee s VAL 100 CO 0.04 -0.49 1.14 -0.11 -3.33 0.00 0.00 175.10 172.36 1yee n LEU 100 N -0.50 3.23 -4.80 2.54 0.00 -1.26 -4.28 117.00 111.93 1yee n LEU 100 Ca -0.07 1.09 -0.39 0.00 0.00 0.00 0.00 56.01 56.64 1yee n LEU 100 Cb 0.61 -1.42 -0.06 0.00 0.00 0.00 0.00 43.42 42.55 1yee n LEU 100 CO 0.37 -1.05 0.37 1.51 0.00 0.00 0.00 177.39 178.58 1yee s ASP 101 N -0.61 7.21 -0.05 1.96 -4.77 -1.25 -4.34 116.67 114.82 1yee s ASP 101 Ca 0.61 1.44 0.03 0.00 -3.30 0.00 0.00 52.55 51.34 1yee s ASP 101 Cb -0.55 -2.42 0.00 0.00 -1.09 0.00 0.00 42.92 38.86 1yee s ASP 101 CO 0.58 0.23 -0.14 -0.31 0.70 0.00 0.00 175.17 176.23 1yee s TYR 102 N -1.16 1.51 0.11 2.11 2.02 -0.76 -4.99 117.35 116.19 1yee s TYR 102 Ca 0.33 -0.47 0.08 0.00 -0.37 0.00 0.00 57.07 56.64 1yee s TYR 102 Cb -0.21 -1.05 -0.04 0.00 -0.40 0.00 0.00 41.96 40.26 1yee s TYR 102 CO 0.22 -0.19 -0.15 -1.58 -1.57 0.00 0.00 175.55 172.28 1yee s TRP 103 N 0.25 2.61 0.78 2.71 0.52 -1.26 -0.36 118.94 124.19 1yee s TRP 103 Ca -0.07 -0.22 -0.11 0.00 0.02 0.00 0.00 56.10 55.71 1yee s TRP 103 Cb -0.12 -1.38 0.07 0.00 -1.15 0.00 0.00 33.47 30.89 1yee s TRP 103 CO 0.02 0.40 1.15 0.20 0.02 0.00 0.00 176.95 178.74 1yee s GLY 104 N -2.14 1.61 0.15 0.98 0.00 -0.03 -4.57 107.32 103.32 1yee s GLY 104 Ca 0.19 -0.66 0.24 0.00 0.00 0.00 0.00 44.72 44.48 1yee s GLY 104 CO 0.11 -0.20 1.72 0.61 0.00 0.00 0.00 173.10 175.35 1yee n GLN 105 N -3.23 0.14 0.00 2.90 0.00 -1.26 -4.78 117.38 111.16 1yee n GLN 105 Ca 0.08 0.25 0.00 0.00 0.00 0.00 0.00 57.00 57.33 1yee n GLN 105 Cb 0.61 -1.71 0.00 0.00 0.00 0.00 0.00 30.24 29.13 1yee n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1yee n GLY 106 N 0.65 1.99 3.05 2.61 0.00 -1.26 -5.04 105.19 107.20 1yee n GLY 106 Ca 0.04 -1.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.11 1yee n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yee s THR 107 N -1.53 1.75 -0.21 2.61 2.01 -0.72 -4.90 115.64 114.66 1yee s THR 107 Ca 0.00 -0.80 -0.21 0.00 0.31 0.00 0.00 61.69 60.99 1yee s THR 107 Cb 0.00 -1.65 -0.02 0.00 0.01 0.00 0.00 72.50 70.84 1yee s THR 107 CO 0.00 0.44 0.64 -0.22 -0.69 0.00 0.00 174.62 174.80 1yee s LEU 108 N 1.40 4.12 -0.18 4.42 1.98 -1.26 -1.28 118.68 127.88 1yee s LEU 108 Ca 0.04 0.82 -0.04 0.00 -2.89 0.00 0.00 54.13 52.07 1yee s LEU 108 Cb -0.13 -2.90 -0.02 0.00 0.66 0.00 0.00 46.19 43.79 1yee s LEU 108 CO -0.11 -0.31 -0.04 -0.69 -1.89 0.00 0.00 176.35 173.31 1yee s VAL 109 N 2.09 3.62 -0.22 1.68 1.01 0.14 -1.04 120.40 127.68 1yee s VAL 109 Ca 0.29 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 1yee s VAL 109 Cb -0.16 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1yee s VAL 109 CO 0.10 0.46 -0.09 -0.89 0.00 0.00 0.00 175.10 174.68 1yee s THR 110 N 0.88 2.90 -0.40 3.92 2.01 0.34 -1.83 115.64 123.45 1yee s THR 110 Ca -0.01 -0.75 -0.13 0.00 0.31 0.00 0.00 61.69 61.11 1yee s THR 110 Cb -0.15 -2.34 0.03 0.00 0.01 0.00 0.00 72.50 70.06 1yee s THR 110 CO 0.01 0.40 0.26 -0.69 -0.69 0.00 0.00 174.62 173.91 1yee s VAL 111 N 1.39 4.92 0.18 3.82 1.01 -1.26 -0.71 120.40 129.75 1yee s VAL 111 Ca 0.04 -0.79 -0.20 0.00 0.00 0.00 0.00 61.98 61.03 1yee s VAL 111 Cb -0.14 -3.76 0.05 0.00 0.00 0.00 0.00 36.38 32.52 1yee s VAL 111 CO -0.06 -0.29 0.56 -0.55 0.00 0.00 0.00 175.10 174.75 1yee s SER 112 N 1.66 -0.40 0.00 3.32 0.15 0.16 -4.34 113.70 114.24 1yee s SER 112 Ca 0.03 -0.25 0.16 0.00 0.70 0.00 0.00 55.95 56.59 1yee s SER 112 Cb -0.19 0.59 0.21 0.00 -1.71 0.00 0.00 66.02 64.91 1yee s SER 112 CO 0.08 -1.01 1.10 -1.54 1.20 0.00 0.00 173.24 173.07 1yee n SER 113 N -0.35 2.58 -4.76 5.45 3.41 -1.26 -3.98 113.62 114.70 1yee n SER 113 Ca -0.14 -1.75 -0.38 0.00 -0.26 0.00 0.00 58.87 56.35 1yee n SER 113 Cb 0.63 -0.09 0.01 0.00 -0.26 0.00 0.00 64.21 64.51 1yee n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yee s ALA 114 N -1.23 2.93 0.21 7.33 0.00 -1.26 -4.99 121.76 124.76 1yee s ALA 114 Ca 0.22 1.11 -0.09 0.00 0.00 0.00 0.00 51.96 53.20 1yee s ALA 114 Cb 0.14 -3.46 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1yee s ALA 114 CO 0.20 -0.95 0.52 -1.59 0.00 0.00 0.00 175.76 173.95 1yee s LYS 115 N -2.75 3.77 0.22 0.00 -2.85 -1.26 -5.00 119.74 111.87 1yee s LYS 115 Ca 0.66 0.21 -0.32 0.00 -1.00 0.00 0.00 55.97 55.53 1yee s LYS 115 Cb -0.34 -2.68 -0.12 0.00 -2.06 0.00 0.00 37.83 32.63 1yee s LYS 115 CO 0.41 0.34 1.69 2.41 0.10 0.00 0.00 175.35 180.30 1yee n THR 116 N -0.10 0.22 -3.80 3.79 -1.04 -1.26 -4.74 114.28 107.35 1yee n THR 116 Ca 0.00 -0.06 -0.16 0.00 -2.04 0.00 0.00 64.05 61.80 1yee n THR 116 Cb 0.52 -1.95 -0.16 0.00 -1.82 0.00 0.00 70.33 66.92 1yee n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1yee s THR 117 N 0.90 -0.01 0.46 12.58 2.01 0.15 -4.92 115.64 126.81 1yee s THR 117 Ca 0.73 0.20 -0.22 0.00 0.31 0.00 0.00 61.69 62.71 1yee s THR 117 Cb -0.51 -0.12 -0.08 0.00 0.01 0.00 0.00 72.50 71.80 1yee s THR 117 CO 0.36 0.10 1.10 0.00 -0.69 0.00 0.00 174.62 175.50 1yee s ALA 118 N 1.10 2.93 0.48 7.40 0.00 -1.26 -0.94 121.76 131.47 1yee s ALA 118 Ca -0.09 0.79 -0.02 0.00 0.00 0.00 0.00 51.96 52.65 1yee s ALA 118 Cb -0.13 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 1yee s ALA 118 CO -0.03 -0.49 0.72 -1.25 0.00 0.00 0.00 175.76 174.71 1yee s PRO 119 N -2.86 3.11 -0.15 0.00 0.04 -1.26 -4.50 135.00 129.38 1yee s PRO 119 Ca 0.64 -0.31 -0.05 0.00 0.04 0.00 0.00 61.00 61.33 1yee s PRO 119 Cb -0.24 -2.49 -0.03 0.00 0.04 0.00 0.00 34.50 31.78 1yee s PRO 119 CO 0.28 -0.33 0.01 -1.12 0.04 0.00 0.00 177.00 175.89 1yee s SER 120 N -4.21 5.26 -0.21 6.66 0.01 -0.56 -4.94 113.70 115.70 1yee s SER 120 Ca 0.49 0.03 -0.03 0.00 1.31 0.00 0.00 55.95 57.74 1yee s SER 120 Cb -0.10 -1.80 -0.01 0.00 0.21 0.00 0.00 66.02 64.33 1yee s SER 120 CO 0.40 0.22 -0.06 -0.69 0.41 0.00 0.00 173.24 173.52 1yee s VAL 121 N 0.06 3.27 -0.04 3.43 1.01 -1.26 -0.81 120.40 126.06 1yee s VAL 121 Ca 0.03 -0.53 0.06 0.00 0.00 0.00 0.00 61.98 61.54 1yee s VAL 121 Cb -0.13 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 1yee s VAL 121 CO 0.02 0.44 -0.23 -0.31 0.00 0.00 0.00 175.10 175.01 1yee s TYR 122 N 1.42 2.45 0.24 5.22 2.02 0.17 -4.98 117.35 123.90 1yee s TYR 122 Ca 0.05 -0.48 -0.27 0.00 -0.37 0.00 0.00 57.07 56.00 1yee s TYR 122 Cb -0.14 -1.57 -0.09 0.00 -0.40 0.00 0.00 41.96 39.76 1yee s TYR 122 CO -0.04 -0.06 0.89 -1.25 -1.57 0.00 0.00 175.55 173.52 1yee s PRO 123 N -0.46 4.68 -0.35 -1.71 0.04 -1.26 -1.22 135.00 134.72 1yee s PRO 123 Ca 0.05 1.33 0.02 0.00 0.04 0.00 0.00 61.00 62.44 1yee s PRO 123 Cb -0.11 -3.14 0.10 0.00 0.04 0.00 0.00 34.50 31.38 1yee s PRO 123 CO 0.01 0.47 0.07 -0.51 0.04 0.00 0.00 177.00 177.08 1yee s LEU 124 N -1.43 4.73 -0.01 -3.56 1.43 0.17 -4.91 118.68 115.11 1yee s LEU 124 Ca 0.42 -2.02 0.01 0.00 -1.03 0.00 0.00 54.13 51.51 1yee s LEU 124 Cb -0.23 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1yee s LEU 124 CO 0.28 -0.40 -0.00 0.00 0.23 0.00 0.00 176.35 176.46 1yee s ALA 125 N 0.99 3.26 0.47 4.21 0.00 -1.26 -0.52 121.76 128.92 1yee s ALA 125 Ca 0.08 -0.94 -0.24 0.00 0.00 0.00 0.00 51.96 50.86 1yee s ALA 125 Cb -0.20 -1.34 -0.07 0.00 0.00 0.00 0.00 23.12 21.51 1yee s ALA 125 CO -0.06 0.64 1.33 -1.25 0.00 0.00 0.00 175.76 176.41 1yee s PRO 126 N -1.47 3.62 0.00 0.00 0.04 -1.26 -4.95 135.00 130.98 1yee s PRO 126 Ca 0.19 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.41 1yee s PRO 126 Cb -0.11 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1yee s PRO 126 CO 0.09 -0.79 0.00 0.28 0.04 0.00 0.00 177.00 176.62 1yee n VAL 127 N -0.39 0.00 0.13 -0.36 0.31 -1.26 -4.98 118.33 111.78 1yee n VAL 127 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1yee n VAL 127 Cb 0.44 -0.77 0.00 0.00 -0.91 0.00 0.00 33.84 32.60 1yee n VAL 127 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yee s GLY 129 N -3.75 1.62 0.00 0.00 0.00 -1.26 -4.60 107.32 99.33 1yee s GLY 129 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.27 1yee s GLY 129 CO 0.00 2.60 0.00 2.09 0.00 0.00 0.00 173.10 177.79 1yee n ASP 130 N 6.70 0.00 0.00 1.64 5.68 -1.26 -4.55 116.55 124.76 1yee n ASP 130 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.44 1yee n ASP 130 Cb 0.44 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.42 1yee n ASP 130 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1yee n THR 131 N -1.36 0.00 0.00 2.12 -1.04 -1.26 -1.59 114.28 111.15 1yee n THR 131 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1yee n THR 131 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1yee n THR 131 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1yee n THR 132 N 0.00 0.00 -2.59 12.58 -1.04 -0.89 -4.84 114.28 117.50 1yee n THR 132 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 1yee n THR 132 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 1yee n THR 132 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1yee s GLY 133 N 0.00 2.85 0.00 3.41 0.00 -1.26 -3.99 107.32 108.33 1yee s GLY 133 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 44.72 45.43 1yee s GLY 133 CO 0.00 1.64 0.00 -1.26 0.00 0.00 0.00 173.10 173.48 1yee n SER 134 N 2.86 0.00 -4.07 1.64 2.88 -1.26 -4.89 113.62 110.77 1yee n SER 134 Ca 0.04 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.50 1yee n SER 134 Cb 0.48 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.83 1yee n SER 134 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1yee s SER 135 N 0.00 0.48 0.02 -3.46 1.04 -1.26 -2.02 113.70 108.50 1yee s SER 135 Ca 0.00 -0.91 0.02 0.00 0.48 0.00 0.00 55.95 55.54 1yee s SER 135 Cb 0.00 0.18 -0.01 0.00 0.10 0.00 0.00 66.02 66.28 1yee s SER 135 CO 0.00 -0.54 -0.06 0.54 0.98 0.00 0.00 173.24 174.16 1yee s VAL 136 N -3.46 0.44 -0.11 5.02 0.11 0.76 -2.09 120.40 121.08 1yee s VAL 136 Ca 0.03 -0.68 0.03 0.00 -2.93 0.00 0.00 61.98 58.43 1yee s VAL 136 Cb 0.05 -0.46 0.00 0.00 -1.53 0.00 0.00 36.38 34.44 1yee s VAL 136 CO -0.08 -0.18 -0.22 0.28 -3.33 0.00 0.00 175.10 171.57 1yee s THR 137 N -0.83 1.96 0.42 5.04 -1.32 -0.62 -0.62 115.64 119.68 1yee s THR 137 Ca -0.05 -0.95 0.07 0.00 -1.21 0.00 0.00 61.69 59.55 1yee s THR 137 Cb -0.06 -1.71 -0.03 0.00 -1.51 0.00 0.00 72.50 69.19 1yee s THR 137 CO 0.00 0.54 0.33 -0.76 -2.21 0.00 0.00 174.62 172.52 1yee s LEU 138 N 0.52 3.27 0.26 9.08 2.01 0.62 -4.52 118.68 129.92 1yee s LEU 138 Ca -0.15 -0.87 -0.09 0.00 0.01 0.00 0.00 54.13 53.04 1yee s LEU 138 Cb -0.17 -1.83 -0.01 0.00 0.01 0.00 0.00 46.19 44.19 1yee s LEU 138 CO 0.05 -0.66 0.42 -0.83 1.01 0.00 0.00 176.35 176.35 1yee s GLY 139 N -4.08 0.89 -0.08 -3.19 0.00 0.33 -0.47 107.32 100.72 1yee s GLY 139 Ca 0.45 -1.16 -0.03 0.00 0.00 0.00 0.00 44.72 43.98 1yee s GLY 139 CO 0.26 -0.84 0.17 0.00 0.00 0.00 0.00 173.10 172.69 1yee s LEU 141 N 1.44 2.90 -0.33 0.00 2.96 -0.36 -1.47 118.68 123.83 1yee s LEU 141 Ca -0.07 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 1yee s LEU 141 Cb -0.11 -1.69 0.08 0.00 0.50 0.00 0.00 46.19 44.97 1yee s LEU 141 CO -0.06 0.11 0.04 -0.69 -1.32 0.00 0.00 176.35 174.42 1yee s VAL 142 N 0.71 2.61 0.15 1.68 1.01 0.52 -0.65 120.40 126.42 1yee s VAL 142 Ca -0.04 -1.95 0.07 0.00 0.00 0.00 0.00 61.98 60.05 1yee s VAL 142 Cb -0.15 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1yee s VAL 142 CO 0.02 -0.41 -0.14 -1.59 0.00 0.00 0.00 175.10 172.98 1yee s LYS 143 N 1.06 1.14 -0.22 2.72 -2.85 0.01 -1.04 119.74 120.56 1yee s LYS 143 Ca 0.03 -1.38 -0.00 0.00 -1.00 0.00 0.00 55.97 53.62 1yee s LYS 143 Cb -0.20 -0.98 0.00 0.00 -2.06 0.00 0.00 37.83 34.59 1yee s LYS 143 CO -0.05 0.18 0.18 0.41 0.10 0.00 0.00 175.35 176.17 1yee n GLY 144 N 0.18 0.32 3.33 0.59 0.00 0.56 -1.50 105.19 108.68 1yee n GLY 144 Ca -0.13 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 1yee n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yee s TYR 145 N -3.07 1.63 -0.28 1.61 -0.85 -1.08 -4.24 117.35 111.07 1yee s TYR 145 Ca 0.01 -0.63 -0.23 0.00 -0.52 0.00 0.00 57.07 55.70 1yee s TYR 145 Cb -0.00 -0.78 0.09 0.00 0.38 0.00 0.00 41.96 41.64 1yee s TYR 145 CO 0.13 0.29 0.82 0.12 -1.52 0.00 0.00 175.55 175.39 1yee s PHE 146 N -3.06 -0.73 0.32 -3.49 5.36 -0.11 -0.63 117.98 115.64 1yee s PHE 146 Ca 0.22 1.70 0.02 0.00 -0.96 0.00 0.00 56.93 57.91 1yee s PHE 146 Cb 0.00 0.35 0.06 0.00 -0.34 0.00 0.00 43.02 43.09 1yee s PHE 146 CO 0.06 -0.35 0.44 -0.35 -1.46 0.00 0.00 175.22 173.55 1yee n PRO 147 N 2.84 0.50 -1.88 10.12 -0.04 -1.26 0.34 135.00 145.63 1yee n PRO 147 Ca -0.15 -1.39 -0.32 0.00 -0.04 0.00 0.00 63.50 61.60 1yee n PRO 147 Cb 0.56 -0.23 0.02 0.00 -0.04 0.00 0.00 33.50 33.81 1yee n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1yee s GLU 148 N -3.51 3.25 0.54 0.54 0.41 -1.26 -4.73 118.70 113.95 1yee s GLU 148 Ca 0.31 1.04 0.08 0.00 -0.41 0.00 0.00 54.97 55.99 1yee s GLU 148 Cb -0.02 -2.03 0.06 0.00 -1.78 0.00 0.00 34.13 30.36 1yee s GLU 148 CO 0.20 -0.85 0.64 -1.25 -0.49 0.00 0.00 175.26 173.51 1yee s PRO 149 N -4.55 2.36 0.12 0.39 0.04 -1.26 -4.97 135.00 127.12 1yee s PRO 149 Ca 0.60 -1.69 0.07 0.00 0.04 0.00 0.00 61.00 60.02 1yee s PRO 149 Cb -0.14 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.86 1yee s PRO 149 CO 0.45 -0.69 -0.18 0.08 0.04 0.00 0.00 177.00 176.70 1yee s VAL 150 N -2.65 1.56 -0.13 -0.36 1.01 -1.26 -4.57 120.40 114.00 1yee s VAL 150 Ca 0.53 -1.63 0.02 0.00 0.00 0.00 0.00 61.98 60.90 1yee s VAL 150 Cb -0.05 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.79 1yee s VAL 150 CO 0.33 -0.22 -0.20 -0.89 0.00 0.00 0.00 175.10 174.12 1yee s THR 151 N -1.59 2.34 -0.08 3.92 2.01 0.58 -4.96 115.64 117.86 1yee s THR 151 Ca 0.08 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.20 1yee s THR 151 Cb -0.08 -1.94 0.01 0.00 0.01 0.00 0.00 72.50 70.50 1yee s THR 151 CO 0.04 0.54 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.13 1yee s LEU 152 N 0.59 1.78 0.16 4.42 0.20 -1.26 -0.33 118.68 124.25 1yee s LEU 152 Ca -0.11 -0.38 -0.01 0.00 0.69 0.00 0.00 54.13 54.31 1yee s LEU 152 Cb -0.16 -1.02 -0.04 0.00 -0.43 0.00 0.00 46.19 44.54 1yee s LEU 152 CO 0.03 0.07 0.09 0.42 -0.29 0.00 0.00 176.35 176.67 1yee s THR 154 N 0.58 0.07 -0.14 3.68 -4.23 -0.33 -4.97 115.64 110.29 1yee s THR 154 Ca -0.16 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.44 1yee s THR 154 Cb -0.16 -2.20 -0.00 0.00 1.34 0.00 0.00 72.50 71.48 1yee s THR 154 CO 0.05 -0.30 -0.18 0.26 -0.54 0.00 0.00 174.62 173.92 1yee s TRP 155 N -4.08 2.73 -1.44 3.99 0.52 -1.26 -0.21 118.94 119.18 1yee s TRP 155 Ca 0.29 -1.06 -0.07 0.00 0.02 0.00 0.00 56.10 55.28 1yee s TRP 155 Cb 0.07 -1.84 0.05 0.00 -1.15 0.00 0.00 33.47 30.60 1yee s TRP 155 CO 0.05 -0.46 0.80 0.09 0.02 0.00 0.00 176.95 177.45 1yee n ASN 160 N 3.91 -2.76 0.00 2.95 3.02 -0.44 -0.44 115.26 121.51 1yee n ASN 160 Ca -0.19 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 1yee n ASN 160 Cb 0.52 -3.81 0.00 0.00 -0.61 0.00 0.00 39.78 35.88 1yee n ASN 160 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1yee n SER 161 N -2.93 -3.65 0.00 6.41 7.64 -1.26 -1.58 113.62 118.25 1yee n SER 161 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1yee n SER 161 Cb 0.60 -2.34 0.00 0.00 -1.01 0.00 0.00 64.21 61.47 1yee n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yee n GLY 162 N -0.73 0.67 0.23 0.23 0.00 0.42 -4.95 105.19 101.05 1yee n GLY 162 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1yee n GLY 162 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yee h SER 163 N 0.00 0.00 -3.22 1.61 4.64 -1.15 -3.37 113.55 112.05 1yee h SER 163 Ca 0.00 0.00 -0.75 0.00 -0.47 0.00 0.00 61.79 60.57 1yee h SER 163 Cb 0.00 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 61.85 1yee h SER 163 CO 0.00 0.21 -0.29 -0.76 -0.87 0.00 0.00 176.83 175.11 1yee s LEU 164 N -6.75 5.83 -0.01 5.97 1.02 -1.07 -4.86 118.68 118.81 1yee s LEU 164 Ca 0.01 -1.54 0.01 0.00 0.02 0.00 0.00 54.13 52.63 1yee s LEU 164 Cb 0.10 -2.18 -0.02 0.00 0.02 0.00 0.00 46.19 44.11 1yee s LEU 164 CO 0.63 -0.73 0.01 -1.54 0.02 0.00 0.00 176.35 174.74 1yee n SER 165 N 5.20 4.66 -4.82 2.29 3.41 -1.26 -4.38 113.62 118.73 1yee n SER 165 Ca -0.13 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.15 1yee n SER 165 Cb 0.42 0.60 -0.07 0.00 -0.26 0.00 0.00 64.21 64.90 1yee n SER 165 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1yee s SER 166 N -3.05 6.98 -0.38 4.04 0.01 -1.26 -3.79 113.70 116.25 1yee s SER 166 Ca -0.01 1.68 0.00 0.00 1.31 0.00 0.00 55.95 58.94 1yee s SER 166 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1yee s SER 166 CO 0.06 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.01 1yee n GLY 167 N -0.46 0.62 3.55 3.44 0.00 -1.26 -4.75 105.19 106.33 1yee n GLY 167 Ca 0.06 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 1yee n GLY 167 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yee s VAL 169 N -1.92 3.40 -0.09 1.61 -7.23 -1.25 -1.48 120.40 113.45 1yee s VAL 169 Ca 0.00 -0.86 -0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1yee s VAL 169 Cb 0.00 -2.46 0.03 0.00 0.56 0.00 0.00 36.38 34.51 1yee s VAL 169 CO 0.00 0.40 -0.04 -1.00 -0.31 0.00 0.00 175.10 174.15 1yee s HIS 170 N -0.96 1.07 -0.22 2.82 3.76 -0.69 -4.98 115.29 116.09 1yee s HIS 170 Ca 0.16 -0.45 -0.05 0.00 -0.15 0.00 0.00 55.06 54.57 1yee s HIS 170 Cb -0.11 -1.01 -0.02 0.00 1.11 0.00 0.00 32.58 32.55 1yee s HIS 170 CO 0.06 -0.42 0.01 0.99 -0.85 0.00 0.00 174.74 174.53 1yee s THR 171 N 1.82 3.83 0.06 1.30 2.01 -1.26 -0.87 115.64 122.53 1yee s THR 171 Ca 0.05 -0.34 -0.20 0.00 0.31 0.00 0.00 61.69 61.51 1yee s THR 171 Cb -0.12 -2.76 -0.07 0.00 0.01 0.00 0.00 72.50 69.56 1yee s THR 171 CO -0.07 0.40 0.58 -0.36 -0.69 0.00 0.00 174.62 174.48 1yee s PHE 172 N 1.40 3.79 0.21 4.92 0.40 -0.13 -5.00 117.98 123.57 1yee s PHE 172 Ca 0.05 1.27 -0.32 0.00 -0.60 0.00 0.00 56.93 57.33 1yee s PHE 172 Cb -0.15 -2.52 -0.14 0.00 0.51 0.00 0.00 43.02 40.72 1yee s PHE 172 CO 0.00 0.55 1.32 -2.30 0.70 0.00 0.00 175.22 175.50 1yee n PRO 173 N 1.86 1.72 -1.88 0.24 -0.02 -1.26 -4.15 135.00 131.52 1yee n PRO 173 Ca -0.10 0.61 -0.39 0.00 -2.02 0.00 0.00 63.50 61.61 1yee n PRO 173 Cb 0.51 -2.21 0.02 0.00 -0.02 0.00 0.00 33.50 31.79 1yee n PRO 173 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yee s ALA 174 N -0.08 3.06 -0.09 3.55 0.00 -1.26 -4.86 121.76 122.07 1yee s ALA 174 Ca 0.70 1.33 0.03 0.00 0.00 0.00 0.00 51.96 54.03 1yee s ALA 174 Cb -0.72 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 18.85 1yee s ALA 174 CO 0.50 -1.15 -0.21 0.08 0.00 0.00 0.00 175.76 174.98 1yee s VAL 175 N -1.28 1.84 -0.11 0.00 1.01 -0.54 -4.93 120.40 116.38 1yee s VAL 175 Ca 0.65 -0.89 -0.21 0.00 0.00 0.00 0.00 61.98 61.53 1yee s VAL 175 Cb -0.40 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 1yee s VAL 175 CO 0.50 0.51 0.59 -0.22 0.00 0.00 0.00 175.10 176.48 1yee s LEU 176 N 0.44 4.27 -0.10 3.92 1.98 -1.26 -1.47 118.68 126.47 1yee s LEU 176 Ca -0.17 0.97 -0.03 0.00 -2.89 0.00 0.00 54.13 52.00 1yee s LEU 176 Cb -0.17 -2.88 0.05 0.00 0.66 0.00 0.00 46.19 43.85 1yee s LEU 176 CO 0.07 -0.09 0.11 -1.10 -1.89 0.00 0.00 176.35 173.46 1yee s GLN 177 N 0.88 0.01 -1.23 1.98 -0.21 0.99 -4.91 119.66 117.17 1yee s GLN 177 Ca 0.31 0.30 -0.04 0.00 0.02 0.00 0.00 55.36 55.96 1yee s GLN 177 Cb -0.16 -0.83 -0.01 0.00 1.00 0.00 0.00 33.01 33.01 1yee s GLN 177 CO 0.13 -0.44 0.79 -1.13 -2.12 0.00 0.00 175.29 172.53 1yee n SER 178 N 5.30 -2.59 -1.62 5.90 3.41 -1.26 -2.17 113.62 120.59 1yee n SER 178 Ca -0.05 -0.80 -0.19 0.00 -0.26 0.00 0.00 58.87 57.57 1yee n SER 178 Cb 0.50 -4.31 -0.07 0.00 -0.26 0.00 0.00 64.21 60.07 1yee n SER 178 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1yee n ASP 181 N -3.04 -5.37 -3.95 4.04 8.00 -1.26 -4.99 116.55 109.98 1yee n ASP 181 Ca -0.24 0.38 -0.11 0.00 0.71 0.00 0.00 54.79 55.53 1yee n ASP 181 Cb 0.66 -4.54 -0.12 0.00 -0.02 0.00 0.00 41.12 37.10 1yee n ASP 181 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1yee s LEU 182 N -4.62 2.15 0.20 0.64 1.43 -0.92 -4.77 118.68 112.78 1yee s LEU 182 Ca 0.00 -0.32 0.05 0.00 -1.03 0.00 0.00 54.13 52.84 1yee s LEU 182 Cb 0.00 0.01 -0.04 0.00 0.03 0.00 0.00 46.19 46.19 1yee s LEU 182 CO 0.00 -0.17 0.22 -0.31 0.23 0.00 0.00 176.35 176.33 1yee s TYR 183 N -0.88 3.26 -0.02 0.29 2.02 0.20 -0.00 117.35 122.21 1yee s TYR 183 Ca -0.09 -0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.61 1yee s TYR 183 Cb -0.06 -1.52 0.01 0.00 -0.40 0.00 0.00 41.96 39.98 1yee s TYR 183 CO -0.00 0.51 -0.05 0.99 -1.57 0.00 0.00 175.55 175.43 1yee s THR 184 N -1.90 0.43 0.01 -0.71 2.01 -0.54 -0.32 115.64 114.63 1yee s THR 184 Ca 0.33 -0.16 -0.00 0.00 0.31 0.00 0.00 61.69 62.16 1yee s THR 184 Cb -0.09 -0.41 -0.01 0.00 0.01 0.00 0.00 72.50 71.99 1yee s THR 184 CO 0.26 0.16 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.11 1yee s LEU 185 N 0.32 2.11 0.12 4.42 0.20 -0.21 -1.47 118.68 124.17 1yee s LEU 185 Ca -0.04 -0.28 0.01 0.00 0.69 0.00 0.00 54.13 54.51 1yee s LEU 185 Cb -0.07 0.09 -0.04 0.00 -0.43 0.00 0.00 46.19 45.73 1yee s LEU 185 CO -0.00 -0.18 -0.02 -0.94 -0.29 0.00 0.00 176.35 174.92 1yee s SER 186 N -0.87 0.91 -0.05 3.68 1.04 -1.26 -0.36 113.70 116.79 1yee s SER 186 Ca -0.10 -1.10 -0.14 0.00 0.48 0.00 0.00 55.95 55.10 1yee s SER 186 Cb -0.06 0.16 0.03 0.00 0.10 0.00 0.00 66.02 66.24 1yee s SER 186 CO -0.01 -0.57 0.32 -0.55 0.98 0.00 0.00 173.24 173.42 1yee s SER 187 N -3.07 -0.25 0.16 7.02 0.15 -0.54 -0.96 113.70 116.21 1yee s SER 187 Ca 0.17 0.30 0.10 0.00 0.70 0.00 0.00 55.95 57.21 1yee s SER 187 Cb 0.06 0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 64.78 1yee s SER 187 CO -0.02 -0.34 -0.21 -0.94 1.20 0.00 0.00 173.24 172.93 1yee s SER 188 N -0.81 2.96 -0.03 5.45 1.04 -0.05 -1.27 113.70 121.00 1yee s SER 188 Ca -0.09 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.52 1yee s SER 188 Cb -0.04 -0.19 0.03 0.00 0.10 0.00 0.00 66.02 65.91 1yee s SER 188 CO 0.03 0.05 -0.01 0.54 0.98 0.00 0.00 173.24 174.84 1yee s VAL 189 N -1.66 0.23 -0.20 5.02 0.11 0.38 -1.71 120.40 122.57 1yee s VAL 189 Ca 0.15 0.06 -0.05 0.00 -2.93 0.00 0.00 61.98 59.22 1yee s VAL 189 Cb -0.08 -0.32 -0.02 0.00 -1.53 0.00 0.00 36.38 34.43 1yee s VAL 189 CO 0.07 0.16 -0.01 -0.89 -3.33 0.00 0.00 175.10 171.10 1yee s THR 190 N 1.05 3.87 0.37 5.04 2.01 -0.55 -0.28 115.64 127.16 1yee s THR 190 Ca -0.09 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.60 1yee s THR 190 Cb -0.14 -2.75 -0.04 0.00 0.01 0.00 0.00 72.50 69.58 1yee s THR 190 CO -0.02 0.43 0.09 0.68 -0.69 0.00 0.00 174.62 175.11 1yee s VAL 191 N 1.05 0.88 0.62 3.82 -7.23 0.21 -4.73 120.40 115.02 1yee s VAL 191 Ca 0.02 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.07 1yee s VAL 191 Cb -0.14 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.21 1yee s VAL 191 CO 0.01 0.00 1.03 0.42 -0.31 0.00 0.00 175.10 176.26 1yee s THR 192 N -3.27 4.50 0.58 5.32 -4.23 -1.26 -0.17 115.64 117.10 1yee s THR 192 Ca 0.29 0.87 0.33 0.00 -1.18 0.00 0.00 61.69 62.01 1yee s THR 192 Cb 0.06 -3.72 0.37 0.00 1.34 0.00 0.00 72.50 70.54 1yee s THR 192 CO 0.14 -1.00 2.26 0.28 -0.54 0.00 0.00 174.62 175.76 1yee h SER 193 N -0.23 0.00 1.88 3.99 0.02 -1.66 -1.73 113.55 115.82 1yee h SER 193 Ca -0.44 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 1yee h SER 193 Cb 1.20 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.73 1yee h SER 193 CO 0.61 0.02 -0.12 0.28 -1.14 0.00 0.00 176.83 176.48 1yee h SER 194 N 0.00 0.00 0.00 3.07 0.02 -1.92 -3.36 113.55 111.36 1yee h SER 194 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1yee h SER 194 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1yee h SER 194 CO 0.00 0.04 -0.01 0.74 -1.14 0.00 0.00 176.83 176.46 1yee h THR 196 N 0.00 0.00 -3.59 -2.27 2.02 -1.69 -3.42 112.91 103.96 1yee h THR 196 Ca -0.00 -0.99 -0.68 0.00 0.77 0.00 0.00 66.41 65.51 1yee h THR 196 Cb 1.03 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 67.26 1yee h THR 196 CO 0.00 0.00 -0.69 0.86 0.37 0.00 0.00 175.52 176.07 1yee s TRP 197 N -1.56 2.95 -0.80 3.16 -0.00 -1.18 -0.24 118.94 121.28 1yee s TRP 197 Ca -0.00 0.02 0.23 0.00 -0.00 0.00 0.00 56.10 56.34 1yee s TRP 197 Cb 0.00 -1.68 0.90 0.00 -0.00 0.00 0.00 33.47 32.69 1yee s TRP 197 CO 0.01 0.37 1.70 -2.30 -0.00 0.00 0.00 176.95 176.72 1yee n PRO 198 N 1.91 0.11 -0.31 5.86 -0.02 -1.26 -4.61 135.00 136.67 1yee n PRO 198 Ca -0.17 0.24 0.05 0.00 -2.02 0.00 0.00 63.50 61.60 1yee n PRO 198 Cb 0.53 -1.67 0.12 0.00 -0.02 0.00 0.00 33.50 32.46 1yee n PRO 198 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1yee n SER 200 N -1.86 -0.32 -4.77 2.55 7.64 -1.00 -4.60 113.62 111.25 1yee n SER 200 Ca 0.04 1.50 -0.27 0.00 1.01 0.00 0.00 58.87 61.15 1yee n SER 200 Cb 0.28 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 62.96 1yee n SER 200 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yee s GLN 201 N -6.09 2.20 0.03 1.43 1.03 0.67 -5.11 119.66 113.83 1yee s GLN 201 Ca -0.13 -2.05 -0.23 0.00 0.04 0.00 0.00 55.36 52.99 1yee s GLN 201 Cb 0.23 -1.87 -0.06 0.00 0.03 0.00 0.00 33.01 31.35 1yee s GLN 201 CO 0.68 -0.29 0.70 0.45 -2.54 0.00 0.00 175.29 174.29 1yee s SER 202 N -3.97 7.13 -0.13 12.60 0.15 -1.26 -4.65 113.70 123.56 1yee s SER 202 Ca 0.30 1.35 -0.01 0.00 0.70 0.00 0.00 55.95 58.29 1yee s SER 202 Cb 0.02 -2.43 0.04 0.00 -1.71 0.00 0.00 66.02 61.94 1yee s SER 202 CO 0.17 0.06 -0.01 -0.63 1.20 0.00 0.00 173.24 174.03 1yee s ILE 203 N -0.17 0.65 0.12 6.45 1.01 -1.26 -5.01 121.20 122.99 1yee s ILE 203 Ca 0.36 -0.29 0.11 0.00 0.00 0.00 0.00 60.65 60.83 1yee s ILE 203 Cb -0.20 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.33 1yee s ILE 203 CO 0.21 0.11 -0.26 -0.89 0.00 0.00 0.00 174.94 174.10 1yee s THR 204 N 1.84 2.21 -0.21 2.92 2.01 -1.26 -1.19 115.64 121.95 1yee s THR 204 Ca 0.02 -1.72 -0.06 0.00 0.31 0.00 0.00 61.69 60.24 1yee s THR 204 Cb -0.14 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1yee s THR 204 CO -0.07 0.10 0.04 0.00 -0.69 0.00 0.00 174.62 174.00 1yee s ASN 207 N 0.99 5.01 -0.07 0.00 -0.87 0.70 -1.18 114.94 119.53 1yee s ASN 207 Ca 0.03 -0.18 0.04 0.00 -1.57 0.00 0.00 52.86 51.18 1yee s ASN 207 Cb -0.14 -1.87 0.00 0.00 -0.02 0.00 0.00 41.25 39.22 1yee s ASN 207 CO 0.02 0.04 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.73 1yee s VAL 208 N 1.16 1.49 -0.02 1.60 1.01 -0.40 -1.19 120.40 124.06 1yee s VAL 208 Ca 0.03 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1yee s VAL 208 Cb -0.14 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 1yee s VAL 208 CO 0.02 0.43 -0.13 0.00 0.00 0.00 0.00 175.10 175.43 1yee s ALA 209 N 0.33 1.10 -0.41 5.51 0.00 0.55 -1.14 121.76 127.71 1yee s ALA 209 Ca -0.11 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.34 1yee s ALA 209 Cb -0.15 -0.33 0.15 0.00 0.00 0.00 0.00 23.12 22.79 1yee s ALA 209 CO 0.04 0.23 0.27 -1.58 0.00 0.00 0.00 175.76 174.73 1yee s HIS 210 N -0.11 1.28 0.49 0.00 2.46 -0.33 -0.31 115.29 118.77 1yee s HIS 210 Ca 0.01 -2.09 0.20 0.00 0.47 0.00 0.00 55.06 53.65 1yee s HIS 210 Cb -0.07 -1.25 1.24 0.00 -0.13 0.00 0.00 32.58 32.37 1yee s HIS 210 CO 0.00 -0.80 2.00 -1.00 -2.47 0.00 0.00 174.74 172.47 1yee h PRO 211 N 6.50 0.16 -0.41 2.88 0.13 -1.81 -0.99 132.00 138.45 1yee h PRO 211 Ca 0.10 -0.01 0.12 0.00 -0.87 0.00 0.00 66.00 65.34 1yee h PRO 211 Cb 0.93 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.01 1yee h PRO 211 CO 0.37 0.10 0.30 0.00 -0.23 0.00 0.00 178.00 178.54 1yee h ALA 212 N 1.75 2.36 -0.11 -0.56 0.00 -1.92 -0.81 119.26 119.97 1yee h ALA 212 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1yee h ALA 212 Cb 0.74 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1yee h ALA 212 CO -0.04 -0.51 0.00 -1.13 0.00 0.00 0.00 179.25 177.57 1yee n SER 213 N -4.36 2.08 -3.52 0.00 3.41 -0.45 -4.99 113.62 105.78 1yee n SER 213 Ca 0.07 -1.69 -0.20 0.00 -0.26 0.00 0.00 58.87 56.78 1yee n SER 213 Cb 0.50 -0.07 0.08 0.00 -0.26 0.00 0.00 64.21 64.46 1yee n SER 213 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1yee n SER 214 N 0.14 -3.86 -4.57 4.04 7.64 -0.31 -4.99 113.62 111.71 1yee n SER 214 Ca 0.05 -0.60 -0.34 0.00 1.01 0.00 0.00 58.87 58.99 1yee n SER 214 Cb 0.26 -5.02 -0.11 0.00 -1.01 0.00 0.00 64.21 58.32 1yee n SER 214 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1yee s THR 215 N -3.35 3.68 -0.26 0.44 2.01 -0.86 -5.00 115.64 112.30 1yee s THR 215 Ca 0.26 -0.49 -0.01 0.00 0.31 0.00 0.00 61.69 61.76 1yee s THR 215 Cb -0.11 -2.51 0.14 0.00 0.01 0.00 0.00 72.50 70.03 1yee s THR 215 CO 0.74 0.59 0.38 -0.75 -0.69 0.00 0.00 174.62 174.89 1yee s LYS 216 N -0.75 0.37 0.13 4.92 2.47 -1.26 -1.18 119.74 124.43 1yee s LYS 216 Ca 0.11 0.39 0.08 0.00 -1.56 0.00 0.00 55.97 55.00 1yee s LYS 216 Cb -0.11 -0.44 -0.04 0.00 -1.46 0.00 0.00 37.83 35.78 1yee s LYS 216 CO 0.01 -0.77 -0.20 0.54 0.16 0.00 0.00 175.35 175.10 1yee s VAL 217 N 2.54 1.75 -0.10 4.02 0.11 -0.29 -5.00 120.40 123.42 1yee s VAL 217 Ca 0.12 -1.69 0.01 0.00 -2.93 0.00 0.00 61.98 57.49 1yee s VAL 217 Cb -0.15 -1.67 0.02 0.00 -1.53 0.00 0.00 36.38 33.06 1yee s VAL 217 CO -0.21 -0.16 -0.10 -1.81 -3.33 0.00 0.00 175.10 169.49 1yee s ASP 218 N -2.20 2.12 -0.22 3.54 1.01 -1.26 -1.27 116.67 118.39 1yee s ASP 218 Ca 0.10 -0.33 0.00 0.00 0.71 0.00 0.00 52.55 53.03 1yee s ASP 218 Cb -0.08 -0.89 0.03 0.00 1.01 0.00 0.00 42.92 42.99 1yee s ASP 218 CO 0.05 -0.06 -0.12 -0.54 0.21 0.00 0.00 175.17 174.71 1yee s LYS 219 N 1.32 2.84 0.13 8.23 -0.14 -0.32 -4.95 119.74 126.84 1yee s LYS 219 Ca -0.02 -0.96 -0.29 0.00 -1.36 0.00 0.00 55.97 53.35 1yee s LYS 219 Cb -0.14 -2.80 -0.06 0.00 -1.68 0.00 0.00 37.83 33.15 1yee s LYS 219 CO -0.04 -0.34 0.92 0.21 -0.76 0.00 0.00 175.35 175.34 1yee s LYS 220 N 1.28 4.69 -0.57 1.68 2.20 -1.26 -0.62 119.74 127.14 1yee s LYS 220 Ca 0.01 1.39 -0.20 0.00 -0.36 0.00 0.00 55.97 56.81 1yee s LYS 220 Cb -0.16 -3.35 0.07 0.00 -1.51 0.00 0.00 37.83 32.88 1yee s LYS 220 CO -0.08 0.29 0.76 0.42 -0.36 0.00 0.00 175.35 176.38 1yee s ILE 221 N -0.25 4.68 0.10 5.43 -1.09 -0.33 -4.89 121.20 124.85 1yee s ILE 221 Ca 0.44 -0.51 0.03 0.00 -2.23 0.00 0.00 60.65 58.38 1yee s ILE 221 Cb -0.23 -4.46 -0.04 0.00 -1.58 0.00 0.00 42.46 36.14 1yee s ILE 221 CO 0.29 -1.07 0.12 -1.61 -1.23 0.00 0.00 174.94 171.44 1yee s GLU 222 N 3.10 2.97 0.00 2.79 2.02 -1.26 -4.69 118.70 123.63 1yee s GLU 222 Ca 0.17 -0.70 0.04 0.00 0.02 0.00 0.00 54.97 54.51 1yee s GLU 222 Cb -0.19 -2.76 0.23 0.00 0.10 0.00 0.00 34.13 31.51 1yee s GLU 222 CO 0.11 0.55 0.70 -2.30 0.02 0.00 0.00 175.26 174.34