#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0x s ILE 2 N 0.00 2.86 -0.11 6.31 1.01 -1.26 -4.98 121.20 125.04 1n0x s ILE 2 Ca 0.00 0.61 0.04 0.00 0.00 0.00 0.00 60.65 61.30 1n0x s ILE 2 Cb 0.00 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 39.08 1n0x s ILE 2 CO 0.00 0.05 -0.23 -0.69 0.00 0.00 0.00 174.94 174.06 1n0x s VAL 3 N 1.18 2.08 -0.14 2.92 1.01 -1.26 -4.86 120.40 121.33 1n0x s VAL 3 Ca 0.68 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 1n0x s VAL 3 Cb -0.41 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 1n0x s VAL 3 CO 0.31 0.56 -0.07 -0.76 0.00 0.00 0.00 175.10 175.14 1n0x s LEU 4 N 0.43 3.07 -0.18 3.92 1.43 -1.26 -1.54 118.68 124.56 1n0x s LEU 4 Ca -0.17 -0.19 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1n0x s LEU 4 Cb -0.17 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.34 1n0x s LEU 4 CO 0.07 0.18 -0.19 -0.89 0.23 0.00 0.00 176.35 175.74 1n0x s THR 5 N 0.30 2.02 0.19 5.49 2.01 0.51 -4.32 115.64 121.84 1n0x s THR 5 Ca -0.06 -0.92 -0.00 0.00 0.31 0.00 0.00 61.69 61.02 1n0x s THR 5 Cb -0.15 -1.83 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 1n0x s THR 5 CO 0.04 0.53 0.37 -1.10 -0.69 0.00 0.00 174.62 173.77 1n0x s GLN 6 N 1.31 3.51 -0.11 4.92 -0.21 -1.26 -0.27 119.66 127.54 1n0x s GLN 6 Ca 0.05 -0.37 -0.25 0.00 0.02 0.00 0.00 55.36 54.81 1n0x s GLN 6 Cb -0.13 -2.86 0.06 0.00 1.00 0.00 0.00 33.01 31.08 1n0x s GLN 6 CO -0.13 0.42 0.59 -1.54 -2.12 0.00 0.00 175.29 172.52 1n0x s SER 7 N -3.14 -0.57 0.97 5.90 1.04 -0.62 -4.68 113.70 112.60 1n0x s SER 7 Ca 0.38 0.81 -0.16 0.00 0.48 0.00 0.00 55.95 57.46 1n0x s SER 7 Cb -0.11 0.78 0.21 0.00 0.10 0.00 0.00 66.02 66.99 1n0x s SER 7 CO 0.29 -0.43 1.33 -2.16 0.98 0.00 0.00 173.24 173.25 1n0x s PRO 8 N -0.63 0.57 0.21 4.02 0.04 -1.26 -1.24 135.00 136.71 1n0x s PRO 8 Ca -0.07 -0.44 -0.02 0.00 0.04 0.00 0.00 61.00 60.51 1n0x s PRO 8 Cb -0.03 -1.84 0.18 0.00 0.04 0.00 0.00 34.50 32.85 1n0x s PRO 8 CO 0.06 -2.46 1.56 0.78 0.04 0.00 0.00 177.00 176.97 1n0x h GLY 9 N -1.67 0.60 -5.91 0.56 0.00 -1.88 -3.42 103.07 91.34 1n0x h GLY 9 Ca -0.44 -0.64 -0.23 0.00 0.00 0.00 0.00 47.33 46.02 1n0x h GLY 9 CO 0.36 0.57 -0.61 -1.59 0.00 0.00 0.00 176.54 175.27 1n0x s THR 10 N -4.13 -0.03 -0.20 4.70 2.01 -1.26 -1.76 115.64 114.97 1n0x s THR 10 Ca -0.07 0.10 -0.03 0.00 0.31 0.00 0.00 61.69 61.99 1n0x s THR 10 Cb 0.12 -0.18 -0.01 0.00 0.01 0.00 0.00 72.50 72.44 1n0x s THR 10 CO 0.83 0.04 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.99 1n0x s LEU 11 N 0.63 2.95 -0.37 4.42 1.43 0.12 -4.94 118.68 122.92 1n0x s LEU 11 Ca -0.05 -0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 52.65 1n0x s LEU 11 Cb -0.07 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.48 1n0x s LEU 11 CO -0.03 0.03 0.16 -0.44 0.23 0.00 0.00 176.35 176.31 1n0x s SER 12 N 1.16 5.41 0.07 2.29 0.01 -1.26 -0.10 113.70 121.28 1n0x s SER 12 Ca 0.02 -1.35 0.02 0.00 1.31 0.00 0.00 55.95 55.95 1n0x s SER 12 Cb -0.14 -1.90 -0.03 0.00 0.21 0.00 0.00 66.02 64.15 1n0x s SER 12 CO -0.01 -0.42 -0.06 -0.76 0.41 0.00 0.00 173.24 172.40 1n0x s LEU 13 N 1.38 2.40 0.18 2.44 1.43 -0.56 -4.62 118.68 121.33 1n0x s LEU 13 Ca 0.01 -0.81 0.04 0.00 -1.03 0.00 0.00 54.13 52.33 1n0x s LEU 13 Cb -0.21 -0.07 -0.03 0.00 0.03 0.00 0.00 46.19 45.91 1n0x s LEU 13 CO 0.02 -0.38 0.28 -0.94 0.23 0.00 0.00 176.35 175.56 1n0x s SER 14 N -2.41 6.16 0.33 2.29 1.04 -1.26 -1.09 113.70 118.76 1n0x s SER 14 Ca 0.02 0.07 -0.28 0.00 0.48 0.00 0.00 55.95 56.24 1n0x s SER 14 Cb -0.01 -1.80 -0.13 0.00 0.10 0.00 0.00 66.02 64.19 1n0x s SER 14 CO -0.03 0.01 1.18 -2.65 0.98 0.00 0.00 173.24 172.73 1n0x n PRO 15 N -0.82 1.82 0.00 4.02 -0.02 -1.26 -2.29 135.00 136.46 1n0x n PRO 15 Ca -0.08 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1n0x n PRO 15 Cb 0.55 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1n0x n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n0x n GLY 16 N 0.94 3.21 3.91 -1.23 0.00 0.74 -4.90 105.19 107.85 1n0x n GLY 16 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1n0x n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n0x s GLU 17 N -1.00 2.77 -0.12 1.61 2.02 -0.97 -4.49 118.70 118.52 1n0x s GLU 17 Ca 0.00 0.06 -0.12 0.00 0.02 0.00 0.00 54.97 54.93 1n0x s GLU 17 Cb 0.00 -2.19 -0.05 0.00 0.10 0.00 0.00 34.13 31.99 1n0x s GLU 17 CO 0.00 -0.88 0.28 0.50 0.02 0.00 0.00 175.26 175.17 1n0x s ARG 18 N -5.13 4.02 -0.18 1.61 3.52 -1.24 0.38 118.95 121.93 1n0x s ARG 18 Ca 0.56 0.09 -0.06 0.00 -0.13 0.00 0.00 55.73 56.19 1n0x s ARG 18 Cb -0.11 -3.34 -0.03 0.00 -1.56 0.00 0.00 34.95 29.91 1n0x s ARG 18 CO 0.47 0.44 0.03 0.00 -0.81 0.00 0.00 175.30 175.43 1n0x s ALA 19 N -0.16 3.21 -0.17 6.12 0.00 -0.50 -4.95 121.76 125.30 1n0x s ALA 19 Ca 0.17 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.31 1n0x s ALA 19 Cb -0.13 -1.80 0.03 0.00 0.00 0.00 0.00 23.12 21.21 1n0x s ALA 19 CO 0.05 0.09 -0.14 0.99 0.00 0.00 0.00 175.76 176.76 1n0x s THR 20 N 0.55 1.71 -0.13 0.00 2.01 -1.26 -0.45 115.64 118.07 1n0x s THR 20 Ca 0.01 -0.85 -0.05 0.00 0.31 0.00 0.00 61.69 61.11 1n0x s THR 20 Cb -0.13 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1n0x s THR 20 CO 0.02 0.37 0.04 -0.36 -0.69 0.00 0.00 174.62 174.00 1n0x s PHE 21 N 1.41 3.26 0.00 4.92 0.40 0.51 -4.80 117.98 123.67 1n0x s PHE 21 Ca 0.03 0.17 0.02 0.00 -0.60 0.00 0.00 56.93 56.55 1n0x s PHE 21 Cb -0.14 -1.93 -0.03 0.00 0.51 0.00 0.00 43.02 41.42 1n0x s PHE 21 CO -0.10 0.36 -0.03 -1.12 0.70 0.00 0.00 175.22 175.03 1n0x s SER 22 N -0.36 4.88 -0.10 1.36 0.01 -0.37 -1.61 113.70 117.51 1n0x s SER 22 Ca 0.08 -0.08 -0.03 0.00 1.31 0.00 0.00 55.95 57.23 1n0x s SER 22 Cb -0.12 -1.21 0.05 0.00 0.21 0.00 0.00 66.02 64.95 1n0x s SER 22 CO 0.02 0.28 0.09 0.00 0.41 0.00 0.00 173.24 174.04 1n0x s ARG 24 N 2.18 3.77 0.04 0.00 6.06 0.63 -1.26 118.95 130.36 1n0x s ARG 24 Ca 0.04 -0.45 0.01 0.00 -2.50 0.00 0.00 55.73 52.82 1n0x s ARG 24 Cb -0.14 -3.12 -0.04 0.00 0.06 0.00 0.00 34.95 31.71 1n0x s ARG 24 CO -0.06 0.14 0.12 0.45 -2.50 0.00 0.00 175.30 173.45 1n0x s SER 25 N 0.70 5.84 0.39 -2.12 0.15 -0.08 -0.36 113.70 118.21 1n0x s SER 25 Ca 0.01 0.14 0.21 0.00 0.70 0.00 0.00 55.95 57.01 1n0x s SER 25 Cb -0.14 -1.69 0.45 0.00 -1.71 0.00 0.00 66.02 62.93 1n0x s SER 25 CO 0.02 0.21 1.63 0.77 1.20 0.00 0.00 173.24 177.07 1n0x h SER 26 N 3.55 0.00 -3.39 5.45 4.64 -1.60 -3.44 113.55 118.75 1n0x h SER 26 Ca -0.47 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.26 1n0x h SER 26 Cb 1.17 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.93 1n0x h SER 26 CO 0.67 0.24 -0.84 -1.00 -0.87 0.00 0.00 176.83 175.03 1n0x s HIS 27 N -3.25 1.92 0.19 4.77 3.76 -1.26 -4.99 115.29 116.43 1n0x s HIS 27 Ca 0.04 -0.75 -0.33 0.00 -0.15 0.00 0.00 55.06 53.87 1n0x s HIS 27 Cb 0.07 -1.34 -0.14 0.00 1.11 0.00 0.00 32.58 32.29 1n0x s HIS 27 CO 0.68 -0.33 1.52 -1.13 -0.85 0.00 0.00 174.74 174.63 1n0x n SER 28 N 3.68 2.99 -4.20 1.40 3.41 -1.26 -4.77 113.62 114.87 1n0x n SER 28 Ca -0.21 1.10 -0.44 0.00 -0.26 0.00 0.00 58.87 59.06 1n0x n SER 28 Cb 0.52 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 1n0x n SER 28 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1n0x n ILE 28 N 2.93 4.77 0.30 -1.33 2.08 -0.13 -4.83 119.36 123.15 1n0x n ILE 28 Ca 0.15 -5.58 0.18 0.00 0.56 0.00 0.00 62.75 58.06 1n0x n ILE 28 Cb 0.30 -2.39 0.88 0.00 -0.75 0.00 0.00 39.64 37.68 1n0x n ILE 28 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 1n0x h ARG 29 N 6.14 0.00 0.00 0.38 3.08 -1.90 -2.47 114.38 119.60 1n0x h ARG 29 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1n0x h ARG 29 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1n0x h ARG 29 CO 1.13 0.03 0.00 0.66 -1.07 0.00 0.00 179.97 180.72 1n0x h SER 30 N 0.00 0.00 0.00 7.04 4.64 -1.99 -3.47 113.55 119.78 1n0x h SER 30 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n0x h SER 30 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1n0x h SER 30 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 1n0x n ARG 31 N -2.42 -0.61 -2.33 4.77 5.12 -0.93 -4.91 116.66 115.36 1n0x n ARG 31 Ca 0.03 0.15 -0.43 0.00 -1.93 0.00 0.00 57.85 55.68 1n0x n ARG 31 Cb 0.34 -3.69 0.00 0.00 -1.16 0.00 0.00 32.46 27.95 1n0x n ARG 31 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1n0x n ARG 32 N -1.52 3.10 -4.50 5.56 1.74 -1.26 -2.73 116.66 117.04 1n0x n ARG 32 Ca 0.00 -3.09 -0.22 0.00 -0.77 0.00 0.00 57.85 53.77 1n0x n ARG 32 Cb 0.15 -3.42 -0.16 0.00 -1.02 0.00 0.00 32.46 28.01 1n0x n ARG 32 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1n0x s VAL 33 N 3.85 0.97 0.15 1.55 1.01 -1.26 -2.96 120.40 123.72 1n0x s VAL 33 Ca 0.52 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 62.11 1n0x s VAL 33 Cb 0.07 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1n0x s VAL 33 CO 0.03 0.30 -0.12 0.00 0.00 0.00 0.00 175.10 175.32 1n0x s ALA 34 N 0.36 1.55 -0.01 5.51 0.00 0.61 -0.76 121.76 129.02 1n0x s ALA 34 Ca -0.07 -1.48 0.06 0.00 0.00 0.00 0.00 51.96 50.47 1n0x s ALA 34 Cb -0.12 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 1n0x s ALA 34 CO 0.02 -0.03 -0.18 -1.58 0.00 0.00 0.00 175.76 173.98 1n0x s TRP 35 N -3.03 1.61 0.13 0.00 0.52 0.16 -0.44 118.94 117.89 1n0x s TRP 35 Ca 0.16 -0.31 0.06 0.00 0.02 0.00 0.00 56.10 56.03 1n0x s TRP 35 Cb 0.00 -1.02 -0.04 0.00 -1.15 0.00 0.00 33.47 31.26 1n0x s TRP 35 CO 0.02 -0.01 -0.14 0.71 0.02 0.00 0.00 176.95 177.54 1n0x s TYR 36 N -0.48 1.47 -0.08 -1.98 1.51 0.88 -0.73 117.35 117.93 1n0x s TYR 36 Ca 0.07 -0.55 0.03 0.00 -1.01 0.00 0.00 57.07 55.61 1n0x s TYR 36 Cb -0.07 -0.76 -0.02 0.00 -0.11 0.00 0.00 41.96 41.01 1n0x s TYR 36 CO -0.00 0.18 -0.18 -1.14 -1.11 0.00 0.00 175.55 173.29 1n0x s GLN 37 N -2.77 2.85 -0.07 -0.62 0.74 0.22 -1.34 119.66 118.68 1n0x s GLN 37 Ca 0.11 -0.78 -0.02 0.00 0.05 0.00 0.00 55.36 54.72 1n0x s GLN 37 Cb -0.05 -2.38 0.03 0.00 1.10 0.00 0.00 33.01 31.72 1n0x s GLN 37 CO 0.04 0.37 0.04 -1.58 -0.55 0.00 0.00 175.29 173.61 1n0x s HIS 38 N -0.10 0.35 0.04 1.67 2.46 0.15 -0.18 115.29 119.67 1n0x s HIS 38 Ca -0.03 0.00 0.02 0.00 0.47 0.00 0.00 55.06 55.52 1n0x s HIS 38 Cb -0.14 -0.65 -0.04 0.00 -0.13 0.00 0.00 32.58 31.62 1n0x s HIS 38 CO 0.04 -0.29 0.03 0.15 -2.47 0.00 0.00 174.74 172.21 1n0x s LYS 39 N 2.08 2.80 -0.07 2.88 1.02 -1.26 -1.96 119.74 125.22 1n0x s LYS 39 Ca 0.05 -0.67 -0.38 0.00 0.02 0.00 0.00 55.97 54.99 1n0x s LYS 39 Cb -0.13 -2.68 -0.16 0.00 -0.52 0.00 0.00 37.83 34.34 1n0x s LYS 39 CO -0.05 0.59 1.55 -2.30 -0.92 0.00 0.00 175.35 174.23 1n0x n PRO 40 N 0.91 1.25 -1.01 -1.68 -0.02 -1.26 -1.64 135.00 131.55 1n0x n PRO 40 Ca -0.12 0.46 -0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1n0x n PRO 40 Cb 0.52 -2.13 -0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1n0x n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n0x n GLY 41 N 3.36 0.36 3.39 -1.23 0.00 -1.26 -5.01 105.19 104.80 1n0x n GLY 41 Ca 0.22 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1n0x n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n0x s GLN 42 N -0.86 1.44 0.31 1.61 -0.21 -0.65 -5.11 119.66 116.18 1n0x s GLN 42 Ca 0.00 -1.54 -0.29 0.00 0.02 0.00 0.00 55.36 53.55 1n0x s GLN 42 Cb 0.00 -1.56 -0.10 0.00 1.00 0.00 0.00 33.01 32.35 1n0x s GLN 42 CO 0.00 0.31 1.25 0.00 -2.12 0.00 0.00 175.29 174.73 1n0x s ALA 43 N -2.12 3.48 0.78 6.09 0.00 -1.26 -4.55 121.76 124.17 1n0x s ALA 43 Ca 0.21 1.15 -0.14 0.00 0.00 0.00 0.00 51.96 53.17 1n0x s ALA 43 Cb -0.06 -3.44 0.06 0.00 0.00 0.00 0.00 23.12 19.69 1n0x s ALA 43 CO 0.09 -0.50 1.17 -2.30 0.00 0.00 0.00 175.76 174.23 1n0x n PRO 44 N 1.05 0.35 -4.68 0.00 -0.02 -1.26 -4.76 135.00 125.68 1n0x n PRO 44 Ca 0.00 0.19 -0.24 0.00 -2.02 0.00 0.00 63.50 61.43 1n0x n PRO 44 Cb 0.43 -2.41 -0.16 0.00 -0.02 0.00 0.00 33.50 31.33 1n0x n PRO 44 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1n0x s ARG 45 N -3.90 1.54 0.16 -0.52 3.52 0.74 -4.95 118.95 115.54 1n0x s ARG 45 Ca 0.74 -0.50 -0.30 0.00 -0.13 0.00 0.00 55.73 55.54 1n0x s ARG 45 Cb -0.31 -1.35 -0.08 0.00 -1.56 0.00 0.00 34.95 31.65 1n0x s ARG 45 CO 0.49 0.18 1.27 -1.17 -0.81 0.00 0.00 175.30 175.26 1n0x s LEU 46 N 0.15 4.41 -0.13 -0.88 2.96 -1.26 -0.61 118.68 123.33 1n0x s LEU 46 Ca -0.05 2.27 -0.05 0.00 -0.22 0.00 0.00 54.13 56.08 1n0x s LEU 46 Cb -0.11 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.92 1n0x s LEU 46 CO 0.02 -0.48 -0.16 0.52 -1.32 0.00 0.00 176.35 174.93 1n0x n VAL 47 N 3.02 0.71 -4.06 1.68 0.31 0.09 -4.70 118.33 115.39 1n0x n VAL 47 Ca 0.07 -0.20 -0.14 0.00 -0.01 0.00 0.00 64.34 64.05 1n0x n VAL 47 Cb 0.44 -1.51 -0.14 0.00 -0.91 0.00 0.00 33.84 31.73 1n0x n VAL 47 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1n0x s ILE 48 N -2.24 0.30 0.06 2.52 -1.09 -1.07 -1.43 121.20 118.25 1n0x s ILE 48 Ca -0.18 -0.30 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 1n0x s ILE 48 Cb 0.06 -0.29 -0.03 0.00 -1.58 0.00 0.00 42.46 40.63 1n0x s ILE 48 CO 0.24 -0.00 -0.06 -1.38 -1.23 0.00 0.00 174.94 172.51 1n0x s HIS 49 N -0.31 0.63 -1.40 3.97 -3.43 0.24 -0.66 115.29 114.33 1n0x s HIS 49 Ca -0.01 -0.72 -0.02 0.00 -0.80 0.00 0.00 55.06 53.52 1n0x s HIS 49 Cb -0.03 -0.39 0.00 0.00 -1.43 0.00 0.00 32.58 30.73 1n0x s HIS 49 CO -0.00 -0.17 0.22 0.41 -2.00 0.00 0.00 174.74 173.20 1n0x n GLY 50 N 0.83 -0.33 4.81 -1.38 0.00 -0.79 -1.19 105.19 107.14 1n0x n GLY 50 Ca -0.19 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1n0x n GLY 50 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n0x n VAL 51 N -4.14 0.00 -0.58 1.61 0.31 0.06 -4.21 118.33 111.38 1n0x n VAL 51 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1n0x n VAL 51 Cb 0.63 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 1n0x n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1n0x n SER 52 N 1.89 0.83 -4.61 4.52 3.41 -1.23 -3.16 113.62 115.27 1n0x n SER 52 Ca 0.00 -1.41 -0.39 0.00 -0.26 0.00 0.00 58.87 56.82 1n0x n SER 52 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 1n0x n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1n0x s ASN 53 N -0.41 6.21 0.20 4.04 0.01 -0.34 -4.56 114.94 120.10 1n0x s ASN 53 Ca 0.00 0.23 -0.30 0.00 -0.71 0.00 0.00 52.86 52.08 1n0x s ASN 53 Cb 0.00 -2.19 -0.08 0.00 0.41 0.00 0.00 41.25 39.39 1n0x s ASN 53 CO 0.00 -0.14 1.24 -0.13 -1.51 0.00 0.00 177.10 176.57 1n0x s ARG 54 N 1.91 4.45 1.06 -0.60 0.52 -1.26 -0.59 118.95 124.44 1n0x s ARG 54 Ca 0.13 1.96 -0.15 0.00 -0.52 0.00 0.00 55.73 57.15 1n0x s ARG 54 Cb -0.16 -3.21 0.22 0.00 0.52 0.00 0.00 34.95 32.32 1n0x s ARG 54 CO 0.10 -0.14 1.11 0.00 0.02 0.00 0.00 175.30 176.38 1n0x s ALA 55 N -0.10 0.91 0.40 2.13 0.00 -0.51 -4.89 121.76 119.69 1n0x s ALA 55 Ca 0.54 -0.60 -0.25 0.00 0.00 0.00 0.00 51.96 51.64 1n0x s ALA 55 Cb -0.34 -3.02 -0.08 0.00 0.00 0.00 0.00 23.12 19.67 1n0x s ALA 55 CO 0.38 -3.05 1.19 -1.54 0.00 0.00 0.00 175.76 172.74 1n0x s SER 56 N -3.69 6.48 -0.04 0.00 1.04 -1.26 -2.88 113.70 113.34 1n0x s SER 56 Ca 0.67 2.40 0.00 0.00 0.48 0.00 0.00 55.95 59.50 1n0x s SER 56 Cb -0.15 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.35 1n0x s SER 56 CO 0.57 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.68 1n0x n GLY 57 N 0.64 0.28 3.68 7.32 0.00 -1.26 -4.98 105.19 110.88 1n0x n GLY 57 Ca 0.04 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1n0x n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n0x s ILE 58 N -1.53 5.23 0.53 -0.61 -1.09 -1.14 -5.05 121.20 117.54 1n0x s ILE 58 Ca 0.00 0.64 -0.21 0.00 -2.23 0.00 0.00 60.65 58.85 1n0x s ILE 58 Cb 0.00 -3.70 -0.06 0.00 -1.58 0.00 0.00 42.46 37.12 1n0x s ILE 58 CO 0.00 0.28 1.12 -0.24 -1.23 0.00 0.00 174.94 174.87 1n0x n SER 59 N 4.34 1.62 0.00 3.58 2.88 -1.26 -4.84 113.62 119.94 1n0x n SER 59 Ca -0.09 0.93 0.07 0.00 -1.33 0.00 0.00 58.87 58.45 1n0x n SER 59 Cb 0.51 -1.45 0.42 0.00 -0.75 0.00 0.00 64.21 62.94 1n0x n SER 59 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1n0x n ASP 60 N -0.51 0.00 0.19 -3.46 3.85 -1.26 -1.92 116.55 113.44 1n0x n ASP 60 Ca 0.11 -0.59 0.14 0.00 -0.71 0.00 0.00 54.79 53.74 1n0x n ASP 60 Cb 0.44 0.00 0.44 0.00 -1.35 0.00 0.00 41.12 40.66 1n0x n ASP 60 CO 0.00 0.00 0.00 0.03 -1.01 0.00 0.00 177.20 176.22 1n0x h ARG 61 N 0.00 0.00 -5.27 0.11 3.08 -1.93 -3.43 114.38 106.94 1n0x h ARG 61 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1n0x h ARG 61 Cb 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 29.93 1n0x h ARG 61 CO 0.00 0.00 -0.49 -0.06 -1.07 0.00 0.00 179.97 178.35 1n0x s PHE 62 N -3.34 3.41 -0.06 3.04 0.40 -0.81 -1.12 117.98 119.50 1n0x s PHE 62 Ca 0.06 0.33 -0.05 0.00 -0.60 0.00 0.00 56.93 56.67 1n0x s PHE 62 Cb 0.09 -2.16 0.02 0.00 0.51 0.00 0.00 43.02 41.48 1n0x s PHE 62 CO 0.55 0.29 0.15 -1.54 0.70 0.00 0.00 175.22 175.38 1n0x s SER 63 N 0.36 -0.15 0.08 1.36 1.04 -0.21 -4.92 113.70 111.26 1n0x s SER 63 Ca 0.08 0.31 0.04 0.00 0.48 0.00 0.00 55.95 56.86 1n0x s SER 63 Cb -0.11 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.26 1n0x s SER 63 CO -0.02 -0.07 0.03 -0.83 0.98 0.00 0.00 173.24 173.33 1n0x s GLY 64 N 0.30 1.95 0.39 7.32 0.00 -1.26 -0.27 107.32 115.74 1n0x s GLY 64 Ca -0.02 -1.06 -0.11 0.00 0.00 0.00 0.00 44.72 43.53 1n0x s GLY 64 CO -0.01 -1.03 0.72 -1.14 0.00 0.00 0.00 173.10 171.64 1n0x n SER 65 N 0.63 -2.07 0.00 1.64 3.41 -0.09 -4.34 113.62 112.80 1n0x n SER 65 Ca -0.10 -2.69 0.00 0.00 -0.26 0.00 0.00 58.87 55.81 1n0x n SER 65 Cb 0.52 3.53 0.00 0.00 -0.26 0.00 0.00 64.21 68.00 1n0x n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n0x n GLY 66 N -0.55 1.39 3.60 5.00 0.00 -1.26 -1.04 105.19 112.33 1n0x n GLY 66 Ca -0.06 -2.18 -0.05 0.00 0.00 0.00 0.00 46.02 43.73 1n0x n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n0x s SER 67 N 0.00 -0.22 1.65 1.61 1.04 -0.57 -4.96 113.70 112.25 1n0x s SER 67 Ca 0.00 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1n0x s SER 67 Cb 0.00 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1n0x s SER 67 CO 0.00 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1n0x n GLY 68 N -0.30 2.29 0.59 7.32 0.00 -1.26 -2.47 105.19 111.35 1n0x n GLY 68 Ca -0.06 0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1n0x n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n0x n THR 69 N 0.00 0.08 -4.49 2.61 -2.24 -1.26 -0.96 114.28 108.02 1n0x n THR 69 Ca 0.00 -0.54 -0.28 0.00 -2.27 0.00 0.00 64.05 60.96 1n0x n THR 69 Cb 0.00 1.23 -0.17 0.00 -2.10 0.00 0.00 70.33 69.30 1n0x n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1n0x s ASP 70 N -1.17 2.30 0.09 3.42 1.01 -1.03 -0.90 116.67 120.38 1n0x s ASP 70 Ca 0.18 -0.40 0.06 0.00 0.71 0.00 0.00 52.55 53.10 1n0x s ASP 70 Cb 0.12 -1.03 -0.03 0.00 1.01 0.00 0.00 42.92 42.99 1n0x s ASP 70 CO 0.18 0.02 -0.16 -0.36 0.21 0.00 0.00 175.17 175.06 1n0x s PHE 71 N 0.92 1.40 0.01 4.23 0.08 -0.39 -1.52 117.98 122.71 1n0x s PHE 71 Ca -0.08 -0.47 0.02 0.00 0.12 0.00 0.00 56.93 56.51 1n0x s PHE 71 Cb -0.15 -0.77 -0.01 0.00 -0.57 0.00 0.00 43.02 41.52 1n0x s PHE 71 CO -0.00 0.12 -0.07 0.99 -0.10 0.00 0.00 175.22 176.16 1n0x s THR 72 N -1.45 0.51 -0.12 0.64 2.01 -0.21 -1.35 115.64 115.68 1n0x s THR 72 Ca 0.03 -0.53 0.02 0.00 0.31 0.00 0.00 61.69 61.52 1n0x s THR 72 Cb -0.09 -0.48 -0.00 0.00 0.01 0.00 0.00 72.50 71.94 1n0x s THR 72 CO 0.03 -0.03 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.52 1n0x s LEU 73 N -0.61 2.33 -0.02 4.42 2.96 -0.63 -0.92 118.68 126.20 1n0x s LEU 73 Ca -0.01 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.46 1n0x s LEU 73 Cb -0.05 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 45.14 1n0x s LEU 73 CO 0.00 0.14 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.10 1n0x s THR 74 N 0.46 1.44 -0.44 3.68 2.01 0.63 -0.37 115.64 123.05 1n0x s THR 74 Ca -0.13 -0.76 -0.00 0.00 0.31 0.00 0.00 61.69 61.10 1n0x s THR 74 Cb -0.17 -1.21 0.12 0.00 0.01 0.00 0.00 72.50 71.25 1n0x s THR 74 CO 0.06 0.41 0.21 -0.63 -0.69 0.00 0.00 174.62 173.97 1n0x s ILE 75 N -0.26 3.02 0.21 1.82 1.01 0.41 -1.04 121.20 126.36 1n0x s ILE 75 Ca 0.03 -2.41 -0.13 0.00 0.00 0.00 0.00 60.65 58.14 1n0x s ILE 75 Cb -0.09 -3.09 0.26 0.00 0.01 0.00 0.00 42.46 39.55 1n0x s ILE 75 CO 0.00 -0.71 1.34 0.41 0.00 0.00 0.00 174.94 175.99 1n0x n THR 76 N 4.17 -0.43 -3.71 2.92 -1.04 -0.28 -1.41 114.28 114.50 1n0x n THR 76 Ca 0.02 2.02 -0.17 0.00 -2.04 0.00 0.00 64.05 63.87 1n0x n THR 76 Cb 0.40 -2.69 -0.17 0.00 -1.82 0.00 0.00 70.33 66.05 1n0x n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1n0x s ARG 77 N -5.89 -0.02 0.33 -2.82 1.70 -1.25 -3.63 118.95 107.36 1n0x s ARG 77 Ca -0.12 0.36 -0.28 0.00 -0.47 0.00 0.00 55.73 55.22 1n0x s ARG 77 Cb 0.19 -0.35 -0.09 0.00 -0.57 0.00 0.00 34.95 34.13 1n0x s ARG 77 CO 0.63 -0.26 1.10 0.08 -1.08 0.00 0.00 175.30 175.77 1n0x s VAL 78 N 1.75 3.48 0.20 4.99 1.01 0.16 -4.76 120.40 127.23 1n0x s VAL 78 Ca -0.01 1.37 0.09 0.00 0.00 0.00 0.00 61.98 63.43 1n0x s VAL 78 Cb -0.12 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1n0x s VAL 78 CO -0.04 0.23 -0.19 -1.61 0.00 0.00 0.00 175.10 173.50 1n0x s GLU 79 N -1.82 1.40 0.45 2.72 0.41 -1.26 -0.19 118.70 120.42 1n0x s GLU 79 Ca 0.49 -1.54 0.24 0.00 -0.41 0.00 0.00 54.97 53.75 1n0x s GLU 79 Cb -0.30 -1.44 1.25 0.00 -1.78 0.00 0.00 34.13 31.86 1n0x s GLU 79 CO 0.38 0.28 1.82 -1.35 -0.49 0.00 0.00 175.26 175.89 1n0x h PRO 80 N 2.88 0.25 0.00 0.39 0.11 -1.99 0.29 132.00 133.93 1n0x h PRO 80 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1n0x h PRO 80 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1n0x h PRO 80 CO 0.55 0.17 0.00 -0.85 -0.21 0.00 0.00 178.00 177.66 1n0x n GLU 81 N -4.46 0.11 0.15 1.05 0.28 -1.26 -3.43 120.64 113.08 1n0x n GLU 81 Ca 0.23 0.29 0.07 0.00 -0.16 0.00 0.00 57.16 57.59 1n0x n GLU 81 Cb 0.92 -1.69 0.06 0.00 1.43 0.00 0.00 31.44 32.16 1n0x n GLU 81 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1n0x h ASP 82 N 0.00 0.00 -2.39 -1.84 3.32 -0.82 -3.46 116.42 111.23 1n0x h ASP 82 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 1n0x h ASP 82 Cb 0.38 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.96 1n0x h ASP 82 CO 0.00 0.23 1.19 0.49 -1.72 0.00 0.00 179.24 179.43 1n0x n PHE 83 N -3.04 2.55 -2.23 4.55 3.01 -1.22 -4.83 117.46 116.24 1n0x n PHE 83 Ca 0.01 -0.29 0.00 0.00 1.01 0.00 0.00 57.45 58.18 1n0x n PHE 83 Cb 0.64 -2.78 0.00 0.00 -0.01 0.00 0.00 39.48 37.33 1n0x n PHE 83 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1n0x n ALA 84 N 6.83 0.00 -2.65 4.37 0.00 -0.99 -4.95 120.51 123.12 1n0x n ALA 84 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.27 1n0x n ALA 84 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 1n0x n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n0x s LEU 85 N 0.00 4.40 -0.06 0.00 1.43 -0.83 -0.75 118.68 122.87 1n0x s LEU 85 Ca 0.00 0.73 0.03 0.00 -1.03 0.00 0.00 54.13 53.87 1n0x s LEU 85 Cb 0.00 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.62 1n0x s LEU 85 CO 0.00 0.29 -0.16 -0.31 0.23 0.00 0.00 176.35 176.39 1n0x s TYR 86 N -1.20 1.77 0.05 0.29 2.02 -0.10 -0.68 117.35 119.50 1n0x s TYR 86 Ca 0.25 -0.62 0.08 0.00 -0.37 0.00 0.00 57.07 56.40 1n0x s TYR 86 Cb -0.14 -1.23 -0.03 0.00 -0.40 0.00 0.00 41.96 40.16 1n0x s TYR 86 CO 0.13 -0.27 -0.21 0.71 -1.57 0.00 0.00 175.55 174.35 1n0x s TYR 87 N 0.38 1.85 0.24 2.71 1.51 -0.45 -0.96 117.35 122.62 1n0x s TYR 87 Ca -0.12 -0.38 0.07 0.00 -1.01 0.00 0.00 57.07 55.63 1n0x s TYR 87 Cb -0.15 -1.09 -0.04 0.00 -0.11 0.00 0.00 41.96 40.58 1n0x s TYR 87 CO 0.04 0.11 0.16 0.00 -1.11 0.00 0.00 175.55 174.75 1n0x s GLN 89 N -3.73 0.90 0.03 0.00 0.74 0.41 -1.04 119.66 116.98 1n0x s GLN 89 Ca 0.32 0.31 0.03 0.00 0.05 0.00 0.00 55.36 56.07 1n0x s GLN 89 Cb -0.08 0.43 -0.04 0.00 1.10 0.00 0.00 33.01 34.42 1n0x s GLN 89 CO 0.24 -0.25 0.01 0.14 -0.55 0.00 0.00 175.29 174.88 1n0x s VAL 90 N -0.87 4.15 0.19 1.34 -7.23 -0.71 -0.28 120.40 116.98 1n0x s VAL 90 Ca -0.09 -0.73 -0.04 0.00 -1.81 0.00 0.00 61.98 59.30 1n0x s VAL 90 Cb -0.02 -2.90 -0.03 0.00 0.56 0.00 0.00 36.38 33.99 1n0x s VAL 90 CO 0.07 0.27 0.20 -0.72 -0.31 0.00 0.00 175.10 174.61 1n0x s TYR 91 N -1.18 0.84 0.00 2.82 -0.85 -1.15 -2.80 117.35 115.03 1n0x s TYR 91 Ca 0.22 -1.14 0.00 0.00 -0.52 0.00 0.00 57.07 55.63 1n0x s TYR 91 Cb -0.12 -0.34 0.00 0.00 0.38 0.00 0.00 41.96 41.88 1n0x s TYR 91 CO 0.14 -0.69 0.00 0.41 -1.52 0.00 0.00 175.55 173.89 1n0x n GLY 92 N -0.24 -1.05 4.17 5.49 0.00 -1.23 -4.81 105.19 107.53 1n0x n GLY 92 Ca -0.02 -1.61 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 1n0x n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n0x n ALA 93 N -0.83 -1.33 -0.92 4.61 0.00 -1.26 -1.07 120.51 119.71 1n0x n ALA 93 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1n0x n ALA 93 Cb 0.00 -3.41 0.00 0.00 0.00 0.00 0.00 19.45 16.04 1n0x n ALA 93 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1n0x n SER 94 N -2.70 -3.31 -4.11 0.00 7.64 -1.26 -4.96 113.62 104.92 1n0x n SER 94 Ca 0.04 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.57 1n0x n SER 94 Cb 0.51 -1.92 -0.13 0.00 -1.01 0.00 0.00 64.21 61.66 1n0x n SER 94 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1n0x s SER 95 N -2.13 5.03 -0.29 6.43 0.01 -0.23 -5.03 113.70 117.49 1n0x s SER 95 Ca 0.00 -1.84 0.00 0.00 1.31 0.00 0.00 55.95 55.42 1n0x s SER 95 Cb 0.00 -1.75 0.09 0.00 0.21 0.00 0.00 66.02 64.57 1n0x s SER 95 CO 0.00 -0.42 0.05 -0.31 0.41 0.00 0.00 173.24 172.97 1n0x s TYR 96 N 1.12 2.18 0.01 2.43 1.51 -1.26 -3.17 117.35 120.17 1n0x s TYR 96 Ca 0.05 -1.91 0.01 0.00 -1.01 0.00 0.00 57.07 54.21 1n0x s TYR 96 Cb -0.21 -1.86 -0.01 0.00 -0.11 0.00 0.00 41.96 39.77 1n0x s TYR 96 CO -0.04 -0.85 -0.04 -0.08 -1.11 0.00 0.00 175.55 173.44 1n0x s THR 97 N 1.46 0.23 0.22 -0.71 -1.32 -1.12 -4.99 115.64 109.40 1n0x s THR 97 Ca 0.06 -0.53 0.08 0.00 -1.21 0.00 0.00 61.69 60.09 1n0x s THR 97 Cb -0.18 -0.28 -0.04 0.00 -1.51 0.00 0.00 72.50 70.49 1n0x s THR 97 CO -0.16 -0.20 0.02 -0.36 -2.21 0.00 0.00 174.62 171.71 1n0x s PHE 98 N -0.73 2.81 0.84 9.09 0.40 -1.26 -1.73 117.98 127.40 1n0x s PHE 98 Ca -0.06 -0.17 -0.13 0.00 -0.60 0.00 0.00 56.93 55.97 1n0x s PHE 98 Cb -0.05 -1.31 0.10 0.00 0.51 0.00 0.00 43.02 42.27 1n0x s PHE 98 CO -0.00 0.56 1.21 0.20 0.70 0.00 0.00 175.22 177.88 1n0x s GLY 99 N -3.33 1.62 0.00 4.36 0.00 -0.21 -4.58 107.32 105.18 1n0x s GLY 99 Ca 0.30 -0.75 0.30 0.00 0.00 0.00 0.00 44.72 44.57 1n0x s GLY 99 CO 0.20 -0.21 2.02 0.61 0.00 0.00 0.00 173.10 175.72 1n0x n GLN 100 N -3.41 0.35 0.00 2.90 0.00 -1.26 -4.76 117.38 111.20 1n0x n GLN 100 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 57.00 57.09 1n0x n GLN 100 Cb 0.61 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.35 1n0x n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n0x n GLY 101 N 1.33 -0.30 3.12 2.61 0.00 -1.26 -5.03 105.19 105.65 1n0x n GLY 101 Ca 0.13 -1.53 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 1n0x n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n0x s THR 102 N -3.00 1.55 -0.23 2.61 2.01 -0.14 -4.82 115.64 113.62 1n0x s THR 102 Ca 0.00 -0.73 -0.17 0.00 0.31 0.00 0.00 61.69 61.10 1n0x s THR 102 Cb 0.00 -1.37 -0.03 0.00 0.01 0.00 0.00 72.50 71.11 1n0x s THR 102 CO 0.00 0.45 0.44 -0.75 -0.69 0.00 0.00 174.62 174.07 1n0x s LYS 103 N 0.46 4.12 -0.40 4.92 2.20 -0.72 -0.93 119.74 129.39 1n0x s LYS 103 Ca -0.15 0.24 -0.17 0.00 -0.36 0.00 0.00 55.97 55.53 1n0x s LYS 103 Cb -0.16 -3.60 0.01 0.00 -1.51 0.00 0.00 37.83 32.57 1n0x s LYS 103 CO 0.06 -0.19 0.42 -1.17 -0.36 0.00 0.00 175.35 174.11 1n0x s LEU 104 N 1.79 4.74 0.36 5.43 2.96 0.07 0.16 118.68 134.19 1n0x s LEU 104 Ca 0.20 -0.54 0.09 0.00 -0.22 0.00 0.00 54.13 53.65 1n0x s LEU 104 Cb -0.15 -2.38 -0.06 0.00 0.50 0.00 0.00 46.19 44.10 1n0x s LEU 104 CO 0.09 -0.51 0.01 -1.83 -1.32 0.00 0.00 176.35 172.79 1n0x s GLU 105 N 2.11 2.03 -0.23 1.98 4.04 0.85 -2.35 118.70 127.13 1n0x s GLU 105 Ca 0.12 -1.85 -0.20 0.00 0.04 0.00 0.00 54.97 53.08 1n0x s GLU 105 Cb -0.17 -1.85 -0.02 0.00 0.02 0.00 0.00 34.13 32.11 1n0x s GLU 105 CO 0.13 0.08 0.61 0.50 -1.84 0.00 0.00 175.26 174.73 1n0x s ARG 106 N -3.72 4.14 0.30 -4.83 3.52 -1.26 -1.50 118.95 115.61 1n0x s ARG 106 Ca 0.35 0.53 -0.28 0.00 -0.13 0.00 0.00 55.73 56.20 1n0x s ARG 106 Cb 0.02 -3.62 -0.09 0.00 -1.56 0.00 0.00 34.95 29.70 1n0x s ARG 106 CO 0.19 -0.33 1.07 0.21 -0.81 0.00 0.00 175.30 175.63 1n0x s LYS 107 N 2.24 4.55 0.33 5.12 2.20 -0.25 -4.81 119.74 129.12 1n0x s LYS 107 Ca 0.26 1.70 -0.09 0.00 -0.36 0.00 0.00 55.97 57.47 1n0x s LYS 107 Cb -0.16 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.14 1n0x s LYS 107 CO 0.09 0.16 0.57 -0.98 -0.36 0.00 0.00 175.35 174.83 1n0x s ARG 108 N -1.68 1.90 0.63 4.03 1.70 -1.26 -4.54 118.95 119.74 1n0x s ARG 108 Ca 0.47 -1.52 -0.17 0.00 -0.47 0.00 0.00 55.73 54.05 1n0x s ARG 108 Cb -0.29 0.51 -0.02 0.00 -0.57 0.00 0.00 34.95 34.58 1n0x s ARG 108 CO 0.37 -0.82 1.14 0.95 -1.08 0.00 0.00 175.30 175.85 1n0x s THR 109 N -3.13 3.03 0.31 4.99 -4.23 -1.26 -4.94 115.64 110.42 1n0x s THR 109 Ca 0.24 0.55 -0.29 0.00 -1.18 0.00 0.00 61.69 61.00 1n0x s THR 109 Cb -0.02 -3.11 -0.11 0.00 1.34 0.00 0.00 72.50 70.59 1n0x s THR 109 CO 0.15 -0.23 1.56 -0.69 -0.54 0.00 0.00 174.62 174.87 1n0x s VAL 110 N -2.04 2.07 -0.07 2.29 1.01 -1.26 -4.81 120.40 117.58 1n0x s VAL 110 Ca 0.71 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.74 1n0x s VAL 110 Cb -0.24 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.13 1n0x s VAL 110 CO 0.37 0.01 -0.01 0.00 0.00 0.00 0.00 175.10 175.47 1n0x s ALA 111 N -0.29 0.75 0.46 5.51 0.00 0.13 -4.93 121.76 123.38 1n0x s ALA 111 Ca 0.60 -0.16 -0.22 0.00 0.00 0.00 0.00 51.96 52.19 1n0x s ALA 111 Cb -0.47 -0.73 -0.08 0.00 0.00 0.00 0.00 23.12 21.83 1n0x s ALA 111 CO 0.52 -0.42 1.06 0.00 0.00 0.00 0.00 175.76 176.92 1n0x s ALA 112 N 1.85 2.94 0.36 0.00 0.00 -1.26 -0.97 121.76 124.68 1n0x s ALA 112 Ca 0.04 0.68 -0.16 0.00 0.00 0.00 0.00 51.96 52.52 1n0x s ALA 112 Cb -0.12 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 1n0x s ALA 112 CO -0.05 -0.34 0.80 -1.25 0.00 0.00 0.00 175.76 174.92 1n0x s PRO 113 N -2.95 4.04 -0.14 0.00 0.04 -1.26 -4.61 135.00 130.13 1n0x s PRO 113 Ca 0.64 0.78 -0.18 0.00 0.04 0.00 0.00 61.00 62.28 1n0x s PRO 113 Cb -0.20 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 1n0x s PRO 113 CO 0.24 0.08 0.46 -1.12 0.04 0.00 0.00 177.00 176.70 1n0x s SER 114 N -2.34 6.63 -0.08 6.66 0.01 -0.87 -4.83 113.70 118.89 1n0x s SER 114 Ca 0.56 0.75 -0.02 0.00 1.31 0.00 0.00 55.95 58.56 1n0x s SER 114 Cb -0.10 -2.27 -0.03 0.00 0.21 0.00 0.00 66.02 63.82 1n0x s SER 114 CO 0.18 -0.01 0.01 -0.69 0.41 0.00 0.00 173.24 173.13 1n0x s VAL 115 N 0.75 4.35 0.00 3.43 1.01 -1.26 -0.58 120.40 128.10 1n0x s VAL 115 Ca 0.25 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1n0x s VAL 115 Cb -0.15 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 1n0x s VAL 115 CO 0.09 0.60 -0.01 -0.36 0.00 0.00 0.00 175.10 175.42 1n0x s PHE 116 N -0.90 0.10 -0.02 5.22 0.08 -0.36 -4.98 117.98 117.12 1n0x s PHE 116 Ca 0.14 -0.09 0.07 0.00 0.12 0.00 0.00 56.93 57.17 1n0x s PHE 116 Cb -0.11 -0.07 -0.02 0.00 -0.57 0.00 0.00 43.02 42.25 1n0x s PHE 116 CO 0.03 -0.03 -0.23 -1.50 -0.10 0.00 0.00 175.22 173.39 1n0x s ILE 117 N -0.23 1.84 -0.13 0.64 2.07 -1.26 -0.39 121.20 123.74 1n0x s ILE 117 Ca -0.02 -0.99 0.01 0.00 -1.41 0.00 0.00 60.65 58.24 1n0x s ILE 117 Cb -0.02 -1.54 0.02 0.00 0.13 0.00 0.00 42.46 41.05 1n0x s ILE 117 CO -0.00 0.52 -0.15 -0.36 -1.91 0.00 0.00 174.94 173.04 1n0x s PHE 118 N -0.46 2.12 0.76 3.50 0.08 0.12 -5.01 117.98 119.10 1n0x s PHE 118 Ca 0.07 -1.12 -0.11 0.00 0.12 0.00 0.00 56.93 55.89 1n0x s PHE 118 Cb -0.10 -1.54 0.05 0.00 -0.57 0.00 0.00 43.02 40.86 1n0x s PHE 118 CO -0.00 -0.59 1.09 -2.14 -0.10 0.00 0.00 175.22 173.47 1n0x s PRO 119 N 1.26 2.37 0.54 0.24 0.02 -1.26 -1.77 135.00 136.40 1n0x s PRO 119 Ca -0.00 0.68 -0.20 0.00 0.02 0.00 0.00 61.00 61.49 1n0x s PRO 119 Cb -0.14 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 1n0x s PRO 119 CO -0.07 -1.43 1.20 -1.25 -0.33 0.00 0.00 177.00 175.13 1n0x s PRO 120 N -5.16 3.26 0.43 5.54 0.04 -1.20 -4.85 135.00 133.07 1n0x s PRO 120 Ca 0.60 1.83 -0.20 0.00 0.04 0.00 0.00 61.00 63.26 1n0x s PRO 120 Cb -0.14 -2.11 -0.11 0.00 0.04 0.00 0.00 34.50 32.19 1n0x s PRO 120 CO 0.54 -0.97 0.94 -1.54 0.04 0.00 0.00 177.00 176.01 1n0x s SER 121 N -1.48 6.91 0.35 6.66 1.04 -1.26 -4.93 113.70 120.99 1n0x s SER 121 Ca 0.72 1.66 0.08 0.00 0.48 0.00 0.00 55.95 58.89 1n0x s SER 121 Cb -0.30 -2.53 0.80 0.00 0.10 0.00 0.00 66.02 64.09 1n0x s SER 121 CO 0.34 -0.37 1.87 0.44 0.98 0.00 0.00 173.24 176.50 1n0x h ASP 122 N 1.85 0.67 -0.01 7.02 5.19 -1.99 -1.22 116.42 127.94 1n0x h ASP 122 Ca -0.49 0.04 0.02 0.00 -0.62 0.00 0.00 57.03 55.98 1n0x h ASP 122 Cb 1.18 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.57 1n0x h ASP 122 CO 0.61 0.34 -0.10 -0.33 -3.12 0.00 0.00 179.24 176.65 1n0x h GLU 123 N 0.71 -0.15 -0.64 3.56 3.07 -1.98 0.45 114.58 119.59 1n0x h GLU 123 Ca 0.45 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.27 1n0x h GLU 123 Cb 0.70 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.61 1n0x h GLU 123 CO -0.21 -0.10 0.23 0.37 -1.40 0.00 0.00 179.01 177.90 1n0x h GLN 124 N -0.16 0.97 -0.59 2.33 4.15 -1.61 -0.45 115.11 119.75 1n0x h GLN 124 Ca 0.04 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.25 1n0x h GLN 124 Cb 0.21 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 1n0x h GLN 124 CO -0.11 0.84 0.30 -0.07 -1.93 0.00 0.00 178.83 177.86 1n0x h LEU 125 N 0.91 0.76 -1.43 -2.39 3.38 -0.91 -1.05 115.31 114.57 1n0x h LEU 125 Ca 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1n0x h LEU 125 Cb 0.25 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1n0x h LEU 125 CO -0.01 0.66 0.27 0.50 0.09 0.00 0.00 178.44 179.94 1n0x h LYS 126 N 0.80 0.65 0.00 1.13 3.64 0.34 -1.79 116.57 121.33 1n0x h LYS 126 Ca 0.20 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1n0x h LYS 126 Cb 0.09 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1n0x h LYS 126 CO -0.03 0.48 0.00 -1.13 -2.27 0.00 0.00 179.45 176.50 1n0x n SER 127 N -4.42 0.62 0.00 4.20 3.41 -0.22 -4.96 113.62 112.25 1n0x n SER 127 Ca 0.04 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 1n0x n SER 127 Cb 0.09 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.31 1n0x n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n0x n GLY 128 N 1.02 3.37 1.43 5.00 0.00 -0.50 -5.07 105.19 110.44 1n0x n GLY 128 Ca 0.05 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 1n0x n GLY 128 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1n0x n THR 129 N 0.00 0.00 -3.88 2.61 5.66 -1.16 -4.11 114.28 113.41 1n0x n THR 129 Ca 0.00 -1.02 -0.16 0.00 -3.05 0.00 0.00 64.05 59.82 1n0x n THR 129 Cb 0.00 0.38 -0.16 0.00 -1.55 0.00 0.00 70.33 69.01 1n0x n THR 129 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1n0x s ALA 130 N -2.49 0.20 -0.11 1.79 0.00 -1.14 -3.29 121.76 116.73 1n0x s ALA 130 Ca 0.10 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.25 1n0x s ALA 130 Cb 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1n0x s ALA 130 CO 0.07 -0.06 -0.18 -1.12 0.00 0.00 0.00 175.76 174.47 1n0x s SER 131 N 0.83 2.65 -0.17 0.00 0.01 -1.26 -2.72 113.70 113.03 1n0x s SER 131 Ca -0.08 -0.48 -0.05 0.00 1.31 0.00 0.00 55.95 56.66 1n0x s SER 131 Cb -0.11 -1.21 -0.03 0.00 0.21 0.00 0.00 66.02 64.89 1n0x s SER 131 CO -0.02 0.06 -0.01 -0.69 0.41 0.00 0.00 173.24 172.99 1n0x s VAL 132 N 0.79 4.03 -0.07 3.43 1.01 -0.36 -3.24 120.40 125.99 1n0x s VAL 132 Ca -0.10 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1n0x s VAL 132 Cb -0.16 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1n0x s VAL 132 CO 0.01 0.47 -0.20 -0.69 0.00 0.00 0.00 175.10 174.69 1n0x s VAL 133 N 0.55 2.55 -0.10 2.92 1.01 -0.73 -0.26 120.40 126.34 1n0x s VAL 133 Ca -0.01 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.11 1n0x s VAL 133 Cb -0.14 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1n0x s VAL 133 CO 0.02 0.57 -0.20 0.00 0.00 0.00 0.00 175.10 175.49 1n0x s LEU 135 N 0.52 2.80 -0.26 0.00 2.96 0.48 -0.95 118.68 124.22 1n0x s LEU 135 Ca -0.16 -0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 53.50 1n0x s LEU 135 Cb -0.17 -1.61 0.04 0.00 0.50 0.00 0.00 46.19 44.95 1n0x s LEU 135 CO 0.06 0.23 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.50 1n0x s LEU 136 N -0.04 3.41 -0.11 -0.68 1.02 0.09 -1.22 118.68 121.14 1n0x s LEU 136 Ca -0.02 -1.11 -0.03 0.00 0.02 0.00 0.00 54.13 52.99 1n0x s LEU 136 Cb -0.14 -1.64 -0.03 0.00 0.02 0.00 0.00 46.19 44.40 1n0x s LEU 136 CO 0.04 -0.18 -0.01 0.21 0.02 0.00 0.00 176.35 176.43 1n0x s ASN 137 N 1.25 5.13 -0.76 2.29 2.47 0.25 -0.56 114.94 125.01 1n0x s ASN 137 Ca -0.03 0.06 -0.05 0.00 0.42 0.00 0.00 52.86 53.26 1n0x s ASN 137 Cb -0.18 -1.57 0.01 0.00 -1.45 0.00 0.00 41.25 38.05 1n0x s ASN 137 CO -0.04 0.31 0.63 0.59 -3.72 0.00 0.00 177.10 174.86 1n0x n ASN 138 N 2.61 -5.49 -4.47 -4.21 3.02 -0.95 -2.05 115.26 103.73 1n0x n ASN 138 Ca -0.18 -0.69 -0.23 0.00 -0.03 0.00 0.00 54.58 53.45 1n0x n ASN 138 Cb 0.53 -2.36 -0.10 0.00 -0.61 0.00 0.00 39.78 37.24 1n0x n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1n0x s PHE 139 N -2.80 2.08 -0.28 3.10 -0.12 0.46 -4.56 117.98 115.86 1n0x s PHE 139 Ca 0.05 -0.71 -0.23 0.00 -0.05 0.00 0.00 56.93 55.99 1n0x s PHE 139 Cb -0.01 -1.26 0.10 0.00 -0.63 0.00 0.00 43.02 41.23 1n0x s PHE 139 CO 0.87 0.29 0.86 -0.47 -0.05 0.00 0.00 175.22 176.72 1n0x s TYR 140 N -2.97 -0.69 1.22 3.49 6.14 -0.14 -0.73 117.35 123.66 1n0x s TYR 140 Ca 0.32 1.59 -0.20 0.00 0.64 0.00 0.00 57.07 59.42 1n0x s TYR 140 Cb 0.05 0.37 0.30 0.00 0.42 0.00 0.00 41.96 43.09 1n0x s TYR 140 CO 0.14 -0.34 1.13 -1.25 0.64 0.00 0.00 175.55 175.88 1n0x s PRO 141 N 0.61 -1.36 0.28 4.97 0.04 -1.26 0.18 135.00 138.46 1n0x s PRO 141 Ca -0.01 -0.21 -0.03 0.00 0.04 0.00 0.00 61.00 60.79 1n0x s PRO 141 Cb -0.05 -1.59 0.39 0.00 0.04 0.00 0.00 34.50 33.28 1n0x s PRO 141 CO -0.06 -3.78 1.89 -0.09 0.04 0.00 0.00 177.00 175.00 1n0x h ARG 142 N -2.62 1.02 -6.31 4.56 9.65 -1.97 -3.44 114.38 115.26 1n0x h ARG 142 Ca -0.43 -0.12 -0.64 0.00 -1.10 0.00 0.00 59.98 57.69 1n0x h ARG 142 Cb 1.28 -0.20 0.03 0.00 -1.39 0.00 0.00 29.97 29.70 1n0x h ARG 142 CO 0.30 0.77 0.89 0.39 2.80 0.00 0.00 179.97 185.11 1n0x n GLU 143 N -4.34 1.82 -3.60 0.20 4.71 -1.26 -4.96 120.64 113.20 1n0x n GLU 143 Ca 0.07 0.66 -0.16 0.00 -0.01 0.00 0.00 57.16 57.72 1n0x n GLU 143 Cb 0.12 -2.43 -0.07 0.00 -1.01 0.00 0.00 31.44 28.05 1n0x n GLU 143 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1n0x s ALA 144 N 2.60 -1.55 -0.09 0.62 0.00 -1.26 -4.67 121.76 117.41 1n0x s ALA 144 Ca 0.89 1.31 0.04 0.00 0.00 0.00 0.00 51.96 54.20 1n0x s ALA 144 Cb -0.80 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.00 1n0x s ALA 144 CO 0.50 -0.33 -0.23 0.21 0.00 0.00 0.00 175.76 175.91 1n0x s LYS 145 N -0.73 2.86 -0.14 0.00 2.20 -0.70 -4.99 119.74 118.23 1n0x s LYS 145 Ca -0.08 -0.84 0.02 0.00 -0.36 0.00 0.00 55.97 54.71 1n0x s LYS 145 Cb -0.02 -2.20 0.01 0.00 -1.51 0.00 0.00 37.83 34.11 1n0x s LYS 145 CO 0.06 0.20 -0.21 0.08 -0.36 0.00 0.00 175.35 175.11 1n0x s VAL 146 N 0.29 2.03 -0.15 4.02 1.01 -1.26 -1.07 120.40 125.27 1n0x s VAL 146 Ca -0.16 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 60.87 1n0x s VAL 146 Cb -0.17 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.42 1n0x s VAL 146 CO 0.08 0.54 -0.19 -1.58 0.00 0.00 0.00 175.10 173.95 1n0x s GLN 147 N 0.87 2.77 0.00 2.72 2.00 -0.12 -4.96 119.66 122.94 1n0x s GLN 147 Ca -0.06 -0.75 -0.15 0.00 -2.00 0.00 0.00 55.36 52.40 1n0x s GLN 147 Cb -0.15 -2.34 -0.06 0.00 0.80 0.00 0.00 33.01 31.26 1n0x s GLN 147 CO -0.03 -0.13 0.41 -1.58 -0.50 0.00 0.00 175.29 173.47 1n0x s TRP 148 N 1.12 3.73 -0.05 1.67 0.52 -1.26 -0.63 118.94 124.03 1n0x s TRP 148 Ca -0.01 1.00 0.01 0.00 0.02 0.00 0.00 56.10 57.13 1n0x s TRP 148 Cb -0.14 -2.30 0.02 0.00 -1.15 0.00 0.00 33.47 29.90 1n0x s TRP 148 CO -0.07 0.63 -0.08 0.15 0.02 0.00 0.00 176.95 177.61 1n0x s LYS 149 N -1.05 1.18 -0.20 4.98 -0.14 -0.16 -0.87 119.74 123.48 1n0x s LYS 149 Ca 0.24 -0.23 0.01 0.00 -1.36 0.00 0.00 55.97 54.63 1n0x s LYS 149 Cb -0.17 -1.07 0.04 0.00 -1.68 0.00 0.00 37.83 34.95 1n0x s LYS 149 CO 0.14 -0.04 -0.13 0.08 -0.76 0.00 0.00 175.35 174.63 1n0x s VAL 150 N 0.83 1.84 -1.50 3.17 1.01 -0.30 -1.25 120.40 124.20 1n0x s VAL 150 Ca -0.12 -1.08 -0.10 0.00 0.00 0.00 0.00 61.98 60.67 1n0x s VAL 150 Cb -0.15 -1.84 0.07 0.00 0.00 0.00 0.00 36.38 34.46 1n0x s VAL 150 CO 0.01 0.24 0.85 0.47 0.00 0.00 0.00 175.10 176.67 1n0x n ASP 151 N 4.63 -3.45 0.00 3.32 8.00 0.43 -0.83 116.55 128.65 1n0x n ASP 151 Ca -0.16 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1n0x n ASP 151 Cb 0.47 -3.68 0.00 0.00 -0.02 0.00 0.00 41.12 37.88 1n0x n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1n0x n ASN 152 N -2.87 -0.50 -4.68 -2.24 3.02 -1.26 -4.99 115.26 101.74 1n0x n ASN 152 Ca -0.06 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.09 1n0x n ASN 152 Cb 0.57 -1.00 -0.05 0.00 -0.61 0.00 0.00 39.78 38.68 1n0x n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0x s ALA 153 N -2.74 3.48 -0.05 5.41 0.00 -0.01 -5.02 121.76 122.83 1n0x s ALA 153 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 1n0x s ALA 153 Cb 0.00 -2.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 1n0x s ALA 153 CO 0.00 -0.40 1.39 -1.17 0.00 0.00 0.00 175.76 175.58 1n0x s LEU 154 N 1.55 4.28 -0.10 0.00 2.96 -1.26 -1.15 118.68 124.97 1n0x s LEU 154 Ca 0.32 2.01 -0.15 0.00 -0.22 0.00 0.00 54.13 56.09 1n0x s LEU 154 Cb -0.16 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.93 1n0x s LEU 154 CO 0.13 -0.75 0.38 -1.10 -1.32 0.00 0.00 176.35 173.69 1n0x s GLN 155 N 2.88 4.15 -0.07 1.98 -1.52 -0.05 -4.98 119.66 122.06 1n0x s GLN 155 Ca 0.63 0.29 -0.03 0.00 -1.95 0.00 0.00 55.36 54.30 1n0x s GLN 155 Cb -0.29 -3.36 0.04 0.00 -0.22 0.00 0.00 33.01 29.18 1n0x s GLN 155 CO 0.24 0.37 0.13 -1.54 -0.25 0.00 0.00 175.29 174.24 1n0x s SER 156 N 0.00 0.73 0.00 5.90 1.04 -1.26 -4.50 113.70 115.62 1n0x s SER 156 Ca 0.22 0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.90 1n0x s SER 156 Cb -0.15 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.12 1n0x s SER 156 CO 0.09 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.69 1n0x n GLY 157 N 5.16 0.48 1.31 7.32 0.00 -1.26 -4.94 105.19 113.26 1n0x n GLY 157 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 1n0x n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1n0x n ASN 158 N 0.00 2.79 -4.06 1.61 6.94 -1.26 -4.97 115.26 116.31 1n0x n ASN 158 Ca 0.00 -3.69 -0.11 0.00 -0.02 0.00 0.00 54.58 50.76 1n0x n ASN 158 Cb 0.00 -0.66 -0.11 0.00 -2.36 0.00 0.00 39.78 36.65 1n0x n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1n0x s SER 159 N -2.30 0.68 -0.02 0.53 1.04 -1.26 -1.85 113.70 110.53 1n0x s SER 159 Ca 0.46 -0.64 0.05 0.00 0.48 0.00 0.00 55.95 56.30 1n0x s SER 159 Cb 0.41 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 1n0x s SER 159 CO 0.02 -0.30 -0.16 -1.10 0.98 0.00 0.00 173.24 172.68 1n0x s GLN 160 N -2.06 1.42 0.06 4.02 -0.21 -0.66 -4.94 119.66 117.29 1n0x s GLN 160 Ca -0.07 -0.56 0.04 0.00 0.02 0.00 0.00 55.36 54.79 1n0x s GLN 160 Cb -0.06 -1.32 -0.04 0.00 1.00 0.00 0.00 33.01 32.59 1n0x s GLN 160 CO -0.02 0.30 -0.02 -1.21 -2.12 0.00 0.00 175.29 172.22 1n0x s GLU 161 N -0.20 2.53 -0.01 2.91 2.02 -1.26 -1.30 118.70 123.38 1n0x s GLU 161 Ca 0.02 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.22 1n0x s GLU 161 Cb -0.08 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.63 1n0x s GLU 161 CO 0.00 0.56 -0.02 0.45 0.02 0.00 0.00 175.26 176.27 1n0x s SER 162 N -2.02 0.33 0.02 -0.19 0.15 -0.32 -4.99 113.70 106.67 1n0x s SER 162 Ca 0.23 -0.04 0.06 0.00 0.70 0.00 0.00 55.95 56.90 1n0x s SER 162 Cb -0.11 -0.08 -0.02 0.00 -1.71 0.00 0.00 66.02 64.09 1n0x s SER 162 CO 0.15 -0.01 -0.18 -0.69 1.20 0.00 0.00 173.24 173.71 1n0x s VAL 163 N 0.24 1.47 0.66 4.45 1.01 -1.26 -1.19 120.40 125.78 1n0x s VAL 163 Ca -0.02 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 60.88 1n0x s VAL 163 Cb -0.05 -1.26 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 1n0x s VAL 163 CO -0.01 0.27 1.05 0.42 0.00 0.00 0.00 175.10 176.83 1n0x s THR 164 N -0.63 4.00 0.68 3.92 -4.23 -0.55 -5.01 115.64 113.82 1n0x s THR 164 Ca 0.06 0.59 -0.14 0.00 -1.18 0.00 0.00 61.69 61.02 1n0x s THR 164 Cb -0.08 -3.64 0.01 0.00 1.34 0.00 0.00 72.50 70.13 1n0x s THR 164 CO 0.01 -0.82 1.10 -1.61 -0.54 0.00 0.00 174.62 172.76 1n0x s GLU 165 N -5.25 2.74 0.24 3.99 0.41 -1.26 -4.61 118.70 114.97 1n0x s GLU 165 Ca 0.56 1.33 -0.31 0.00 -0.41 0.00 0.00 54.97 56.14 1n0x s GLU 165 Cb -0.11 -1.95 -0.13 0.00 -1.78 0.00 0.00 34.13 30.17 1n0x s GLU 165 CO 0.52 -1.29 1.55 0.94 -0.49 0.00 0.00 175.26 176.49 1n0x n GLN 166 N -2.60 2.39 -1.87 1.61 7.27 -1.26 -4.82 117.38 118.10 1n0x n GLN 166 Ca 0.10 0.85 -0.42 0.00 0.07 0.00 0.00 57.00 57.60 1n0x n GLN 166 Cb 0.52 -2.60 -0.03 0.00 2.41 0.00 0.00 30.24 30.54 1n0x n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1n0x s ASP 167 N 0.59 6.52 0.16 1.69 -1.08 0.10 -4.89 116.67 119.75 1n0x s ASP 167 Ca 0.69 2.71 0.22 0.00 -0.52 0.00 0.00 52.55 55.66 1n0x s ASP 167 Cb -0.58 -2.60 0.88 0.00 -1.46 0.00 0.00 42.92 39.16 1n0x s ASP 167 CO 0.45 -0.87 1.67 -1.54 0.52 0.00 0.00 175.17 175.40 1n0x n SER 168 N 3.79 0.46 -0.14 -0.34 3.41 -1.26 -1.23 113.62 118.31 1n0x n SER 168 Ca 0.14 0.60 -0.29 0.00 -0.26 0.00 0.00 58.87 59.05 1n0x n SER 168 Cb 0.37 -0.70 -0.10 0.00 -0.26 0.00 0.00 64.21 63.53 1n0x n SER 168 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1n0x n LYS 169 N -1.99 0.58 -0.02 4.33 4.81 -1.26 -4.75 118.16 119.86 1n0x n LYS 169 Ca 0.03 0.25 0.04 0.00 -0.87 0.00 0.00 58.31 57.77 1n0x n LYS 169 Cb 0.25 -1.47 0.05 0.00 0.02 0.00 0.00 35.03 33.88 1n0x n LYS 169 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1n0x n ASP 170 N -4.20 1.87 -1.45 3.14 5.68 -1.25 -5.01 116.55 115.33 1n0x n ASP 170 Ca -0.54 -1.47 -0.17 0.00 -0.50 0.00 0.00 54.79 52.11 1n0x n ASP 170 Cb 0.88 -0.03 -0.06 0.00 -1.14 0.00 0.00 41.12 40.77 1n0x n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1n0x n SER 171 N 0.42 -5.09 -5.00 -1.12 7.64 -0.36 -4.97 113.62 105.14 1n0x n SER 171 Ca 0.05 0.34 -0.18 0.00 1.01 0.00 0.00 58.87 60.09 1n0x n SER 171 Cb 0.24 -4.13 0.02 0.00 -1.01 0.00 0.00 64.21 59.33 1n0x n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1n0x s THR 172 N -2.69 2.70 0.27 0.44 -4.23 -1.26 -4.62 115.64 106.26 1n0x s THR 172 Ca 0.00 -1.06 0.11 0.00 -1.18 0.00 0.00 61.69 59.56 1n0x s THR 172 Cb 0.00 -2.76 -0.05 0.00 1.34 0.00 0.00 72.50 71.03 1n0x s THR 172 CO 0.00 0.00 -0.17 -0.31 -0.54 0.00 0.00 174.62 173.60 1n0x s TYR 173 N -2.46 2.18 0.04 3.99 1.51 0.09 -0.73 117.35 121.97 1n0x s TYR 173 Ca 0.55 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 56.21 1n0x s TYR 173 Cb -0.08 -1.01 -0.02 0.00 -0.11 0.00 0.00 41.96 40.74 1n0x s TYR 173 CO 0.33 0.61 -0.06 -1.12 -1.11 0.00 0.00 175.55 174.20 1n0x s SER 174 N -3.48 0.69 -0.02 2.29 0.01 -1.26 -0.40 113.70 111.52 1n0x s SER 174 Ca 0.29 -0.56 -0.06 0.00 1.31 0.00 0.00 55.95 56.93 1n0x s SER 174 Cb -0.03 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.27 1n0x s SER 174 CO 0.13 -0.25 0.12 -0.22 0.41 0.00 0.00 173.24 173.44 1n0x s LEU 175 N -1.64 1.58 0.00 2.44 0.20 0.28 -1.49 118.68 120.06 1n0x s LEU 175 Ca -0.10 -0.04 0.07 0.00 0.69 0.00 0.00 54.13 54.74 1n0x s LEU 175 Cb -0.09 0.55 -0.02 0.00 -0.43 0.00 0.00 46.19 46.20 1n0x s LEU 175 CO -0.00 -0.24 -0.21 -0.94 -0.29 0.00 0.00 176.35 174.67 1n0x s SER 176 N -0.83 2.48 -0.07 3.68 1.04 -0.34 -0.74 113.70 118.93 1n0x s SER 176 Ca -0.09 -0.43 0.03 0.00 0.48 0.00 0.00 55.95 55.94 1n0x s SER 176 Cb -0.05 -0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.82 1n0x s SER 176 CO 0.01 0.23 -0.14 -0.55 0.98 0.00 0.00 173.24 173.76 1n0x s SER 177 N -0.72 2.02 -0.16 7.02 0.15 -0.12 -1.18 113.70 120.71 1n0x s SER 177 Ca 0.08 -0.35 0.01 0.00 0.70 0.00 0.00 55.95 56.40 1n0x s SER 177 Cb -0.08 -0.93 0.01 0.00 -1.71 0.00 0.00 66.02 63.31 1n0x s SER 177 CO 0.00 0.06 -0.20 -0.89 1.20 0.00 0.00 173.24 173.41 1n0x s THR 178 N 0.60 2.19 -0.22 6.45 2.01 -0.42 -0.91 115.64 125.34 1n0x s THR 178 Ca -0.15 -0.92 -0.15 0.00 0.31 0.00 0.00 61.69 60.78 1n0x s THR 178 Cb -0.16 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 1n0x s THR 178 CO 0.05 0.54 0.36 -0.22 -0.69 0.00 0.00 174.62 174.65 1n0x s LEU 179 N 1.03 4.12 -0.12 4.42 2.96 0.64 -1.65 118.68 130.07 1n0x s LEU 179 Ca -0.02 0.40 -0.04 0.00 -0.22 0.00 0.00 54.13 54.26 1n0x s LEU 179 Cb -0.14 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 1n0x s LEU 179 CO -0.06 -0.08 0.01 -0.89 -1.32 0.00 0.00 176.35 174.01 1n0x s THR 180 N 1.44 4.37 0.14 3.68 2.01 -0.77 -1.23 115.64 125.29 1n0x s THR 180 Ca 0.16 -0.21 -0.19 0.00 0.31 0.00 0.00 61.69 61.76 1n0x s THR 180 Cb -0.15 -2.88 0.05 0.00 0.01 0.00 0.00 72.50 69.53 1n0x s THR 180 CO 0.08 0.55 0.49 -1.48 -0.69 0.00 0.00 174.62 173.58 1n0x s LEU 181 N -0.37 -0.05 0.65 4.42 0.05 -1.10 -4.89 118.68 117.38 1n0x s LEU 181 Ca 0.08 -0.17 -0.15 0.00 0.05 0.00 0.00 54.13 53.93 1n0x s LEU 181 Cb -0.12 2.19 -0.01 0.00 -2.05 0.00 0.00 46.19 46.21 1n0x s LEU 181 CO 0.02 -0.91 1.09 -0.94 -0.55 0.00 0.00 176.35 175.06 1n0x s SER 182 N -2.78 5.26 0.25 1.48 1.04 -1.26 -2.87 113.70 114.83 1n0x s SER 182 Ca 0.02 1.93 -0.04 0.00 0.48 0.00 0.00 55.95 58.34 1n0x s SER 182 Cb 0.00 -2.54 0.35 0.00 0.10 0.00 0.00 66.02 63.94 1n0x s SER 182 CO -0.12 -1.52 1.88 0.50 0.98 0.00 0.00 173.24 174.95 1n0x h LYS 183 N 0.05 1.11 -0.44 4.02 3.64 -1.86 -1.16 116.57 121.93 1n0x h LYS 183 Ca -0.46 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 58.88 1n0x h LYS 183 Cb 1.24 -0.25 -0.04 0.00 -0.41 0.00 0.00 32.23 32.77 1n0x h LYS 183 CO 0.55 0.73 0.22 0.00 -2.27 0.00 0.00 179.45 178.68 1n0x h ALA 184 N 1.42 0.56 -0.52 5.00 0.00 -1.91 -1.82 119.26 121.99 1n0x h ALA 184 Ca 0.40 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.21 1n0x h ALA 184 Cb 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1n0x h ALA 184 CO -0.16 -0.13 -0.15 -0.44 0.00 0.00 0.00 179.25 178.38 1n0x h ASP 185 N 0.44 1.03 -0.50 0.00 3.45 -1.77 -2.43 116.42 116.64 1n0x h ASP 185 Ca 0.19 -0.37 0.04 0.00 0.43 0.00 0.00 57.03 57.32 1n0x h ASP 185 Cb 0.10 -0.28 -0.04 0.00 -0.56 0.00 0.00 39.33 38.55 1n0x h ASP 185 CO -0.14 1.16 0.27 0.22 -1.57 0.00 0.00 179.24 179.18 1n0x h TYR 186 N 0.88 0.49 0.00 4.55 3.20 -0.86 -1.79 116.97 123.44 1n0x h TYR 186 Ca 0.13 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1n0x h TYR 186 Cb 0.72 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.84 1n0x h TYR 186 CO 0.05 0.25 -0.07 0.93 -1.64 0.00 0.00 178.16 177.68 1n0x h GLU 187 N 0.52 0.00 0.00 1.82 5.08 -1.27 -2.82 114.58 117.91 1n0x h GLU 187 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1n0x h GLU 187 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1n0x h GLU 187 CO -0.14 0.07 0.00 1.17 -1.00 0.00 0.00 179.01 179.11 1n0x n LYS 188 N -3.19 0.08 -4.38 2.33 4.81 -0.69 -4.86 118.16 112.26 1n0x n LYS 188 Ca 0.01 0.02 -0.19 0.00 -0.87 0.00 0.00 58.31 57.28 1n0x n LYS 188 Cb 0.35 -1.50 -0.10 0.00 0.02 0.00 0.00 35.03 33.80 1n0x n LYS 188 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1n0x s HIS 189 N -2.92 1.75 -0.04 5.64 3.76 -1.06 -5.08 115.29 117.33 1n0x s HIS 189 Ca 0.16 -0.85 -0.02 0.00 -0.15 0.00 0.00 55.06 54.20 1n0x s HIS 189 Cb 0.18 -1.03 -0.02 0.00 1.11 0.00 0.00 32.58 32.82 1n0x s HIS 189 CO 0.49 0.08 -0.05 1.17 -0.85 0.00 0.00 174.74 175.58 1n0x n LYS 190 N -0.51 0.10 -3.50 1.40 4.81 -1.26 -4.73 118.16 114.46 1n0x n LYS 190 Ca -0.05 0.04 -0.39 0.00 -0.87 0.00 0.00 58.31 57.04 1n0x n LYS 190 Cb 0.64 -0.76 -0.10 0.00 0.02 0.00 0.00 35.03 34.83 1n0x n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1n0x s VAL 191 N -2.08 5.25 -0.12 3.15 1.01 -1.26 -0.02 120.40 126.33 1n0x s VAL 191 Ca -0.06 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.23 1n0x s VAL 191 Cb 0.02 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 1n0x s VAL 191 CO 0.08 0.18 -0.14 -0.31 0.00 0.00 0.00 175.10 174.92 1n0x s TYR 192 N 1.90 2.79 -0.05 5.22 2.02 -0.66 -0.43 117.35 128.13 1n0x s TYR 192 Ca 0.10 -0.59 -0.14 0.00 -0.37 0.00 0.00 57.07 56.08 1n0x s TYR 192 Cb -0.16 -1.81 0.03 0.00 -0.40 0.00 0.00 41.96 39.62 1n0x s TYR 192 CO 0.11 -0.16 0.32 0.00 -1.57 0.00 0.00 175.55 174.24 1n0x s ALA 193 N 0.20 -0.80 -0.13 3.71 0.00 -0.38 -1.44 121.76 122.92 1n0x s ALA 193 Ca -0.08 0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.43 1n0x s ALA 193 Cb -0.15 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.85 1n0x s ALA 193 CO 0.05 -0.23 -0.19 0.00 0.00 0.00 0.00 175.76 175.40 1n0x s GLU 195 N 0.94 3.82 -0.15 0.00 2.12 0.19 -1.75 118.70 123.86 1n0x s GLU 195 Ca -0.06 -0.40 -0.03 0.00 0.36 0.00 0.00 54.97 54.85 1n0x s GLU 195 Cb -0.15 -3.38 -0.02 0.00 0.26 0.00 0.00 34.13 30.84 1n0x s GLU 195 CO -0.03 -0.06 -0.07 0.08 -0.54 0.00 0.00 175.26 174.65 1n0x s VAL 196 N 1.31 3.60 -0.15 3.70 1.01 0.12 -0.94 120.40 129.05 1n0x s VAL 196 Ca 0.06 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 1n0x s VAL 196 Cb -0.15 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 1n0x s VAL 196 CO 0.05 0.50 -0.12 -0.89 0.00 0.00 0.00 175.10 174.64 1n0x s THR 197 N 0.44 3.08 -0.02 3.92 2.01 -0.23 -1.36 115.64 123.47 1n0x s THR 197 Ca -0.06 -0.64 -0.20 0.00 0.31 0.00 0.00 61.69 61.11 1n0x s THR 197 Cb -0.15 -2.32 0.04 0.00 0.01 0.00 0.00 72.50 70.08 1n0x s THR 197 CO 0.03 0.51 0.42 -2.28 -0.69 0.00 0.00 174.62 172.61 1n0x s HIS 198 N 0.59 -0.32 0.47 4.92 2.46 -1.26 -1.72 115.29 120.42 1n0x s HIS 198 Ca -0.07 0.52 0.19 0.00 0.47 0.00 0.00 55.06 56.17 1n0x s HIS 198 Cb -0.15 0.19 1.19 0.00 -0.13 0.00 0.00 32.58 33.68 1n0x s HIS 198 CO 0.03 -0.46 1.96 0.37 -2.47 0.00 0.00 174.74 174.18 1n0x h GLN 199 N 3.61 0.23 0.00 2.88 4.15 -1.93 0.47 115.11 124.52 1n0x h GLN 199 Ca -0.29 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.12 1n0x h GLN 199 Cb 1.17 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.80 1n0x h GLN 199 CO 0.40 0.16 0.00 0.41 -1.93 0.00 0.00 178.83 177.86 1n0x n GLY 200 N -1.57 -1.23 3.48 2.39 0.00 -1.26 -4.71 105.19 102.28 1n0x n GLY 200 Ca 0.12 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1n0x n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n0x s LEU 201 N -2.51 3.56 0.28 0.99 1.43 0.15 -4.56 118.68 118.03 1n0x s LEU 201 Ca 0.30 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.26 1n0x s LEU 201 Cb 0.20 -1.96 0.61 0.00 0.03 0.00 0.00 46.19 45.07 1n0x s LEU 201 CO 0.44 -0.03 1.78 0.03 0.23 0.00 0.00 176.35 178.80 1n0x h ARG 202 N 8.17 0.70 -3.60 1.70 3.08 -1.84 -3.43 114.38 119.17 1n0x h ARG 202 Ca -0.38 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.52 1n0x h ARG 202 Cb 1.18 -0.16 -0.17 0.00 0.08 0.00 0.00 29.97 30.90 1n0x h ARG 202 CO 0.58 0.47 -0.41 -1.54 -1.07 0.00 0.00 179.97 178.00 1n0x s SER 203 N -5.46 0.05 0.30 7.04 1.04 -1.26 -5.13 113.70 110.28 1n0x s SER 203 Ca -0.12 -0.39 -0.28 0.00 0.48 0.00 0.00 55.95 55.64 1n0x s SER 203 Cb 0.23 0.28 -0.14 0.00 0.10 0.00 0.00 66.02 66.49 1n0x s SER 203 CO 0.79 -0.56 1.00 -2.65 0.98 0.00 0.00 173.24 172.80 1n0x n PRO 204 N 0.67 1.33 -4.28 4.02 -0.02 -1.26 -4.94 135.00 130.52 1n0x n PRO 204 Ca -0.19 0.47 -0.35 0.00 -2.02 0.00 0.00 63.50 61.41 1n0x n PRO 204 Cb 0.59 -1.84 -0.10 0.00 -0.02 0.00 0.00 33.50 32.13 1n0x n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1n0x s VAL 205 N -1.08 4.36 -0.08 -1.45 1.01 -0.47 -4.91 120.40 117.79 1n0x s VAL 205 Ca 0.59 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.40 1n0x s VAL 205 Cb -0.69 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 32.80 1n0x s VAL 205 CO 0.60 0.55 -0.21 -0.89 0.00 0.00 0.00 175.10 175.14 1n0x s THR 206 N -0.29 1.79 -0.05 3.92 2.01 -1.26 0.12 115.64 121.87 1n0x s THR 206 Ca 0.07 -0.88 0.06 0.00 0.31 0.00 0.00 61.69 61.25 1n0x s THR 206 Cb -0.12 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.82 1n0x s THR 206 CO 0.02 0.50 -0.23 -0.54 -0.69 0.00 0.00 174.62 173.68 1n0x s LYS 207 N 0.29 2.50 0.27 4.92 -0.14 -0.72 -4.98 119.74 121.88 1n0x s LYS 207 Ca -0.14 -0.87 -0.12 0.00 -1.36 0.00 0.00 55.97 53.48 1n0x s LYS 207 Cb -0.16 -2.19 0.00 0.00 -1.68 0.00 0.00 37.83 33.80 1n0x s LYS 207 CO 0.06 0.44 0.50 -1.54 -0.76 0.00 0.00 175.35 174.05 1n0x s SER 208 N -0.30 0.05 0.12 2.83 1.04 -1.26 -1.09 113.70 115.09 1n0x s SER 208 Ca 0.01 -1.01 -0.15 0.00 0.48 0.00 0.00 55.95 55.27 1n0x s SER 208 Cb -0.13 0.62 0.03 0.00 0.10 0.00 0.00 66.02 66.64 1n0x s SER 208 CO 0.02 -1.20 0.39 0.72 0.98 0.00 0.00 173.24 174.15 1n0x s PHE 209 N -3.78 -0.17 -0.21 5.02 -0.71 -0.52 -5.01 117.98 112.60 1n0x s PHE 209 Ca 0.23 -0.15 -0.06 0.00 -1.04 0.00 0.00 56.93 55.90 1n0x s PHE 209 Cb -0.01 0.24 -0.03 0.00 -1.21 0.00 0.00 43.02 42.01 1n0x s PHE 209 CO 0.11 -0.69 0.03 -0.80 -1.34 0.00 0.00 175.22 172.52 1n0x s ASN 210 N -2.81 5.07 -0.22 1.98 0.02 -1.26 -1.65 114.94 116.06 1n0x s ASN 210 Ca 0.03 -0.14 -0.28 0.00 -1.02 0.00 0.00 52.86 51.45 1n0x s ASN 210 Cb 0.02 -1.88 -0.05 0.00 0.02 0.00 0.00 41.25 39.36 1n0x s ASN 210 CO -0.12 0.06 2.21 -0.60 0.02 0.00 0.00 177.10 178.68 1n0x s ARG 211 N 1.01 3.14 0.00 -0.60 3.00 0.97 -3.13 118.95 123.34 1n0x s ARG 211 Ca 0.03 2.02 0.00 0.00 -1.00 0.00 0.00 55.73 56.78 1n0x s ARG 211 Cb -0.14 -4.37 0.00 0.00 0.00 0.00 0.00 34.95 30.44 1n0x s ARG 211 CO 0.02 -2.10 0.00 0.41 0.00 0.00 0.00 175.30 173.63 1n0x n GLY 212 N 5.74 2.86 3.21 8.12 0.00 -1.26 -4.90 105.19 118.96 1n0x n GLY 212 Ca 0.30 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1n0x n GLY 212 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n0x s GLU 213 N 0.00 2.41 0.00 1.61 2.12 -1.18 -5.29 118.70 118.37 1n0x s GLU 213 Ca 0.00 -1.51 0.00 0.00 0.36 0.00 0.00 54.97 53.82 1n0x s GLU 213 Cb 0.00 -3.61 0.00 0.00 0.26 0.00 0.00 34.13 30.78 1n0x s GLU 213 CO 0.00 -0.92 0.00 0.00 -0.54 0.00 0.00 175.26 173.80