#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 4.67 -0.15 6.31 1.01 -1.26 -4.97 121.20 126.81 1n0x s ILE 2 Ca 0.00 1.75 0.00 0.00 0.00 0.00 0.00 60.65 62.40 1n0x s ILE 2 Cb 0.00 -4.17 -0.00 0.00 0.01 0.00 0.00 42.46 38.30 1n0x s ILE 2 CO 0.00 0.35 -0.15 -0.69 0.00 0.00 0.00 174.94 174.45 1n0x s VAL 3 N -0.04 2.75 -0.16 2.92 1.01 -1.26 -4.79 120.40 120.84 1n0x s VAL 3 Ca 0.41 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.60 1n0x s VAL 3 Cb -0.21 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 1n0x s VAL 3 CO 0.25 0.51 -0.03 -0.76 0.00 0.00 0.00 175.10 175.07 1n0x s LEU 4 N 0.73 3.25 -0.19 3.92 1.43 -1.26 -0.89 118.68 125.67 1n0x s LEU 4 Ca -0.06 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1n0x s LEU 4 Cb -0.15 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.30 1n0x s LEU 4 CO 0.01 0.16 -0.17 -0.89 0.23 0.00 0.00 176.35 175.70 1n0x s THR 5 N 0.39 2.24 0.05 5.49 2.01 0.11 -4.28 115.64 121.65 1n0x s THR 5 Ca -0.04 -0.96 -0.06 0.00 0.31 0.00 0.00 61.69 60.94 1n0x s THR 5 Cb -0.14 -2.00 -0.05 0.00 0.01 0.00 0.00 72.50 70.32 1n0x s THR 5 CO 0.03 0.46 0.30 -1.10 -0.69 0.00 0.00 174.62 173.62 1n0x s GLN 6 N 1.29 3.60 -0.06 4.92 -0.21 -1.26 -0.14 119.66 127.80 1n0x s GLN 6 Ca 0.04 -0.08 -0.06 0.00 0.02 0.00 0.00 55.36 55.28 1n0x s GLN 6 Cb -0.14 -3.02 0.01 0.00 1.00 0.00 0.00 33.01 30.87 1n0x s GLN 6 CO -0.11 0.59 0.16 -1.12 -2.12 0.00 0.00 175.29 172.69 1n0x s SER 7 N -1.94 -0.16 0.83 5.90 0.01 -0.42 -4.60 113.70 113.32 1n0x s SER 7 Ca 0.32 0.30 -0.06 0.00 1.31 0.00 0.00 55.95 57.81 1n0x s SER 7 Cb -0.13 0.32 0.16 0.00 0.21 0.00 0.00 66.02 66.58 1n0x s SER 7 CO 0.19 -0.07 1.03 -0.81 0.41 0.00 0.00 173.24 174.00 1n0x n PRO 8 N 2.94 -0.52 -0.13 12.44 -0.04 -1.26 -0.88 135.00 147.55 1n0x n PRO 8 Ca -0.13 -2.21 -0.13 0.00 -0.04 0.00 0.00 63.50 60.99 1n0x n PRO 8 Cb 0.59 -0.87 -0.02 0.00 -0.04 0.00 0.00 33.50 33.16 1n0x n PRO 8 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1n0x h GLY 9 N -0.98 1.03 -5.10 0.55 0.00 -1.87 -3.42 103.07 93.28 1n0x h GLY 9 Ca -0.34 -1.03 -0.31 0.00 0.00 0.00 0.00 47.33 45.66 1n0x h GLY 9 CO 0.30 0.93 -0.75 -1.59 0.00 0.00 0.00 176.54 175.43 1n0x s THR 10 N -4.44 0.48 -0.25 4.70 2.01 -1.26 -1.96 115.64 114.91 1n0x s THR 10 Ca -0.11 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.30 1n0x s THR 10 Cb 0.11 -0.47 0.07 0.00 0.01 0.00 0.00 72.50 72.22 1n0x s THR 10 CO 0.88 -0.09 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.48 1n0x s LEU 11 N -0.74 2.54 -0.39 4.42 2.96 0.14 -4.91 118.68 122.69 1n0x s LEU 11 Ca -0.03 -1.27 -0.17 0.00 -0.22 0.00 0.00 54.13 52.44 1n0x s LEU 11 Cb -0.05 -1.10 0.01 0.00 0.50 0.00 0.00 46.19 45.54 1n0x s LEU 11 CO 0.00 -0.28 0.42 -0.44 -1.32 0.00 0.00 176.35 174.73 1n0x s SER 12 N 1.44 6.20 0.06 3.68 0.01 -1.26 -0.09 113.70 123.74 1n0x s SER 12 Ca -0.02 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.76 1n0x s SER 12 Cb -0.18 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 1n0x s SER 12 CO -0.09 -0.49 -0.04 -0.76 0.41 0.00 0.00 173.24 172.27 1n0x s LEU 13 N 2.11 2.46 0.07 2.44 1.43 -0.06 -4.70 118.68 122.43 1n0x s LEU 13 Ca 0.12 -0.92 0.02 0.00 -1.03 0.00 0.00 54.13 52.32 1n0x s LEU 13 Cb -0.17 0.09 -0.04 0.00 0.03 0.00 0.00 46.19 46.10 1n0x s LEU 13 CO 0.13 -0.51 0.13 -0.44 0.23 0.00 0.00 176.35 175.89 1n0x s SER 14 N -2.72 5.84 0.22 2.29 0.01 -1.26 -0.69 113.70 117.38 1n0x s SER 14 Ca 0.05 0.09 -0.31 0.00 1.31 0.00 0.00 55.95 57.10 1n0x s SER 14 Cb 0.04 -1.66 -0.15 0.00 0.21 0.00 0.00 66.02 64.46 1n0x s SER 14 CO -0.07 0.17 1.08 -2.65 0.41 0.00 0.00 173.24 172.18 1n0x n PRO 15 N 0.39 1.21 0.00 12.44 -0.02 -1.26 -1.76 135.00 145.99 1n0x n PRO 15 Ca -0.07 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1n0x n PRO 15 Cb 0.51 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 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 1.72 2.78 3.80 -1.23 0.00 0.10 -4.92 105.19 107.44 1n0x n GLY 16 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.25 2.48 -0.06 1.61 2.02 -0.72 -4.22 118.70 119.55 1n0x s GLU 17 Ca 0.00 0.88 -0.19 0.00 0.02 0.00 0.00 54.97 55.68 1n0x s GLU 17 Cb 0.00 -1.94 -0.05 0.00 0.10 0.00 0.00 34.13 32.24 1n0x s GLU 17 CO 0.00 -1.41 0.53 0.50 0.02 0.00 0.00 175.26 174.90 1n0x s ARG 18 N -5.05 4.30 -0.13 1.61 3.52 -1.24 -0.19 118.95 121.77 1n0x s ARG 18 Ca 0.60 0.58 -0.01 0.00 -0.13 0.00 0.00 55.73 56.77 1n0x s ARG 18 Cb -0.15 -3.38 -0.02 0.00 -1.56 0.00 0.00 34.95 29.84 1n0x s ARG 18 CO 0.55 0.28 -0.09 0.00 -0.81 0.00 0.00 175.30 175.23 1n0x s ALA 19 N 0.17 2.79 -0.17 6.12 0.00 -0.04 -4.98 121.76 125.66 1n0x s ALA 19 Ca 0.29 -0.86 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 1n0x s ALA 19 Cb -0.17 -1.34 0.04 0.00 0.00 0.00 0.00 23.12 21.65 1n0x s ALA 19 CO 0.14 0.26 -0.06 0.99 0.00 0.00 0.00 175.76 177.09 1n0x s THR 20 N 0.26 1.20 -0.13 0.00 2.01 -1.26 -0.63 115.64 117.09 1n0x s THR 20 Ca -0.06 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.18 1n0x s THR 20 Cb -0.15 -1.36 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 1n0x s THR 20 CO 0.04 0.13 0.07 -0.36 -0.69 0.00 0.00 174.62 173.81 1n0x s PHE 21 N 1.59 3.35 0.07 4.92 0.40 0.97 -4.79 117.98 124.48 1n0x s PHE 21 Ca 0.00 0.28 0.06 0.00 -0.60 0.00 0.00 56.93 56.67 1n0x s PHE 21 Cb -0.15 -1.93 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 1n0x s PHE 21 CO -0.08 0.47 -0.09 -1.12 0.70 0.00 0.00 175.22 175.10 1n0x s SER 22 N -0.54 4.44 -0.12 1.36 0.01 -0.06 -1.51 113.70 117.27 1n0x s SER 22 Ca 0.11 -0.31 -0.04 0.00 1.31 0.00 0.00 55.95 57.02 1n0x s SER 22 Cb -0.12 -0.90 0.06 0.00 0.21 0.00 0.00 66.02 65.27 1n0x s SER 22 CO 0.02 0.22 0.20 0.00 0.41 0.00 0.00 173.24 174.09 1n0x s ARG 24 N 2.34 3.51 0.07 0.00 3.52 0.80 -1.30 118.95 127.88 1n0x s ARG 24 Ca 0.03 -0.49 0.02 0.00 -0.13 0.00 0.00 55.73 55.16 1n0x s ARG 24 Cb -0.13 -2.89 -0.04 0.00 -1.56 0.00 0.00 34.95 30.33 1n0x s ARG 24 CO -0.08 0.36 0.09 0.45 -0.81 0.00 0.00 175.30 175.31 1n0x s SER 25 N 0.06 5.64 0.20 -2.12 0.15 -0.32 0.05 113.70 117.37 1n0x s SER 25 Ca 0.01 0.04 0.10 0.00 0.70 0.00 0.00 55.95 56.80 1n0x s SER 25 Cb -0.13 -1.56 0.06 0.00 -1.71 0.00 0.00 66.02 62.68 1n0x s SER 25 CO 0.02 0.18 1.43 0.77 1.20 0.00 0.00 173.24 176.85 1n0x h SER 26 N 3.36 0.00 -3.43 5.45 4.64 -1.35 -3.45 113.55 118.77 1n0x h SER 26 Ca -0.47 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.20 1n0x h SER 26 Cb 1.16 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.09 1n0x h SER 26 CO 0.67 0.78 -0.75 -1.00 -0.87 0.00 0.00 176.83 175.65 1n0x s HIS 27 N -3.07 2.64 0.05 4.77 3.76 -1.26 -4.97 115.29 117.21 1n0x s HIS 27 Ca 0.01 -0.21 -0.31 0.00 -0.15 0.00 0.00 55.06 54.40 1n0x s HIS 27 Cb 0.11 -1.36 -0.06 0.00 1.11 0.00 0.00 32.58 32.38 1n0x s HIS 27 CO 0.78 0.44 1.32 0.45 -0.85 0.00 0.00 174.74 176.89 1n0x s SER 28 N -2.39 6.93 -1.12 1.40 0.15 -1.26 -4.70 113.70 112.71 1n0x s SER 28 Ca 0.21 2.13 -0.07 0.00 0.70 0.00 0.00 55.95 58.92 1n0x s SER 28 Cb -0.10 -2.57 0.28 0.00 -1.71 0.00 0.00 66.02 61.91 1n0x s SER 28 CO 0.13 -0.61 1.33 -0.38 1.20 0.00 0.00 173.24 174.91 1n0x n ILE 28 N 4.19 4.84 0.23 6.45 2.08 -0.27 -4.82 119.36 132.05 1n0x n ILE 28 Ca 0.11 -5.49 0.07 0.00 0.56 0.00 0.00 62.75 58.00 1n0x n ILE 28 Cb 0.44 -2.37 0.55 0.00 -0.75 0.00 0.00 39.64 37.51 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 6.17 0.00 0.00 0.38 3.08 -1.92 -2.37 114.38 119.71 1n0x h ARG 29 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1n0x h ARG 29 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1n0x h ARG 29 CO 1.19 0.20 0.00 0.66 -1.07 0.00 0.00 179.97 180.95 1n0x h SER 30 N 0.00 0.00 -0.36 7.04 4.64 -2.00 -3.46 113.55 119.40 1n0x h SER 30 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1n0x h SER 30 Cb 0.39 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.42 1n0x h SER 30 CO 0.03 0.00 -0.14 0.54 -0.87 0.00 0.00 176.83 176.38 1n0x n ARG 31 N -2.83 -0.90 -2.34 4.77 1.74 -0.89 -4.92 116.66 111.30 1n0x n ARG 31 Ca 0.02 0.69 -0.43 0.00 -0.77 0.00 0.00 57.85 57.36 1n0x n ARG 31 Cb 0.32 -4.63 0.00 0.00 -1.02 0.00 0.00 32.46 27.13 1n0x n ARG 31 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1n0x n ARG 32 N -2.05 3.15 -4.62 5.56 1.74 -1.26 -3.25 116.66 115.94 1n0x n ARG 32 Ca -0.08 -3.16 -0.24 0.00 -0.77 0.00 0.00 57.85 53.60 1n0x n ARG 32 Cb 0.34 -3.32 -0.16 0.00 -1.02 0.00 0.00 32.46 28.31 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 3.18 1.15 0.14 1.55 1.01 -1.26 -2.46 120.40 123.71 1n0x s VAL 33 Ca 0.49 -0.53 0.05 0.00 0.00 0.00 0.00 61.98 61.99 1n0x s VAL 33 Cb 0.07 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1n0x s VAL 33 CO 0.01 0.35 -0.12 0.00 0.00 0.00 0.00 175.10 175.33 1n0x s ALA 34 N 0.31 1.50 -0.02 5.51 0.00 -0.02 -0.61 121.76 128.43 1n0x s ALA 34 Ca -0.08 -1.40 0.06 0.00 0.00 0.00 0.00 51.96 50.54 1n0x s ALA 34 Cb -0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 1n0x s ALA 34 CO 0.02 0.01 -0.20 -1.58 0.00 0.00 0.00 175.76 174.01 1n0x s TRP 35 N -2.72 1.84 0.11 0.00 0.52 -0.29 -0.72 118.94 117.69 1n0x s TRP 35 Ca 0.13 -0.38 0.07 0.00 0.02 0.00 0.00 56.10 55.94 1n0x s TRP 35 Cb -0.01 -1.19 -0.04 0.00 -1.15 0.00 0.00 33.47 31.08 1n0x s TRP 35 CO 0.02 -0.06 -0.18 0.71 0.02 0.00 0.00 176.95 177.46 1n0x s TYR 36 N -0.39 1.63 -0.10 -1.98 1.51 0.13 -0.52 117.35 117.62 1n0x s TYR 36 Ca 0.06 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 55.66 1n0x s TYR 36 Cb -0.09 -0.87 -0.02 0.00 -0.11 0.00 0.00 41.96 40.87 1n0x s TYR 36 CO -0.00 0.19 -0.10 -1.14 -1.11 0.00 0.00 175.55 173.39 1n0x s GLN 37 N -2.15 3.08 -0.11 -0.62 0.74 0.09 -0.80 119.66 119.89 1n0x s GLN 37 Ca 0.07 -0.62 -0.03 0.00 0.05 0.00 0.00 55.36 54.83 1n0x s GLN 37 Cb -0.08 -2.62 0.04 0.00 1.10 0.00 0.00 33.01 31.45 1n0x s GLN 37 CO 0.04 0.43 0.04 -1.58 -0.55 0.00 0.00 175.29 173.67 1n0x s HIS 38 N -0.19 0.53 -0.18 1.67 2.46 0.18 -0.45 115.29 119.31 1n0x s HIS 38 Ca 0.01 -0.26 -0.10 0.00 0.47 0.00 0.00 55.06 55.19 1n0x s HIS 38 Cb -0.13 -0.76 -0.05 0.00 -0.13 0.00 0.00 32.58 31.51 1n0x s HIS 38 CO 0.03 -0.40 0.15 0.15 -2.47 0.00 0.00 174.74 172.21 1n0x s LYS 39 N 2.02 4.03 0.05 2.88 1.02 -1.26 -1.77 119.74 126.71 1n0x s LYS 39 Ca 0.03 -0.16 -0.37 0.00 0.02 0.00 0.00 55.97 55.49 1n0x s LYS 39 Cb -0.14 -3.37 -0.17 0.00 -0.52 0.00 0.00 37.83 33.64 1n0x s LYS 39 CO -0.06 0.40 1.38 -2.30 -0.92 0.00 0.00 175.35 173.85 1n0x n PRO 40 N 3.17 1.14 -0.57 -1.68 -0.02 -1.26 -1.09 135.00 134.69 1n0x n PRO 40 Ca -0.16 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1n0x n PRO 40 Cb 0.53 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 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 2.69 1.15 3.41 -1.23 0.00 -1.26 -5.04 105.19 104.91 1n0x n GLY 41 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.28 1.51 0.28 1.61 -0.21 -0.25 -5.11 119.66 117.21 1n0x s GLN 42 Ca 0.00 -1.66 -0.29 0.00 0.02 0.00 0.00 55.36 53.42 1n0x s GLN 42 Cb 0.00 -1.49 -0.10 0.00 1.00 0.00 0.00 33.01 32.42 1n0x s GLN 42 CO 0.00 0.27 1.37 0.00 -2.12 0.00 0.00 175.29 174.81 1n0x s ALA 43 N -2.62 3.56 0.81 6.09 0.00 -1.26 -4.54 121.76 123.80 1n0x s ALA 43 Ca 0.26 1.28 -0.13 0.00 0.00 0.00 0.00 51.96 53.37 1n0x s ALA 43 Cb -0.04 -3.52 0.09 0.00 0.00 0.00 0.00 23.12 19.65 1n0x s ALA 43 CO 0.11 -0.69 1.21 -2.14 0.00 0.00 0.00 175.76 174.25 1n0x s PRO 44 N -0.96 1.59 -0.04 0.00 0.02 -1.26 -4.76 135.00 129.59 1n0x s PRO 44 Ca 0.55 1.76 0.04 0.00 0.02 0.00 0.00 61.00 63.36 1n0x s PRO 44 Cb -0.40 -1.77 -0.00 0.00 0.02 0.00 0.00 34.50 32.34 1n0x s PRO 44 CO 0.47 -2.25 -0.15 0.50 -0.33 0.00 0.00 177.00 175.24 1n0x s ARG 45 N -4.16 1.53 0.16 5.54 3.52 0.41 -4.96 118.95 120.98 1n0x s ARG 45 Ca 0.73 -0.52 -0.30 0.00 -0.13 0.00 0.00 55.73 55.51 1n0x s ARG 45 Cb -0.29 -1.36 -0.08 0.00 -1.56 0.00 0.00 34.95 31.67 1n0x s ARG 45 CO 0.51 0.21 1.26 -1.17 -0.81 0.00 0.00 175.30 175.31 1n0x s LEU 46 N 0.06 4.41 -0.15 -0.88 2.96 -1.26 -0.73 118.68 123.10 1n0x s LEU 46 Ca -0.03 2.27 -0.05 0.00 -0.22 0.00 0.00 54.13 56.10 1n0x s LEU 46 Cb -0.10 -3.60 -0.07 0.00 0.50 0.00 0.00 46.19 42.91 1n0x s LEU 46 CO 0.02 -0.48 -0.17 0.52 -1.32 0.00 0.00 176.35 174.91 1n0x n VAL 47 N 2.99 0.81 -4.00 1.68 0.31 0.32 -4.70 118.33 115.74 1n0x n VAL 47 Ca 0.07 -0.24 -0.12 0.00 -0.01 0.00 0.00 64.34 64.04 1n0x n VAL 47 Cb 0.44 -1.48 -0.13 0.00 -0.91 0.00 0.00 33.84 31.76 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 -2.27 0.22 0.05 2.52 -1.09 -1.02 -1.51 121.20 118.10 1n0x s ILE 48 Ca -0.20 -0.53 0.01 0.00 -2.23 0.00 0.00 60.65 57.70 1n0x s ILE 48 Cb 0.07 -0.27 -0.03 0.00 -1.58 0.00 0.00 42.46 40.65 1n0x s ILE 48 CO 0.28 -0.20 -0.06 -1.38 -1.23 0.00 0.00 174.94 172.35 1n0x s HIS 49 N -0.73 0.61 -1.45 3.97 -3.43 0.07 -1.14 115.29 113.21 1n0x s HIS 49 Ca -0.06 -0.71 -0.01 0.00 -0.80 0.00 0.00 55.06 53.47 1n0x s HIS 49 Cb -0.05 -0.38 0.00 0.00 -1.43 0.00 0.00 32.58 30.71 1n0x s HIS 49 CO -0.00 -0.17 0.19 0.41 -2.00 0.00 0.00 174.74 173.16 1n0x n GLY 50 N 0.88 -0.36 4.88 -1.38 0.00 -0.72 -1.26 105.19 107.22 1n0x n GLY 50 Ca -0.19 -0.09 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 -4.13 0.00 -0.52 1.61 0.31 0.22 -4.23 118.33 111.58 1n0x n VAL 51 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1n0x n VAL 51 Cb 0.64 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.57 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 2.12 0.74 -4.62 4.52 3.41 -1.23 -3.14 113.62 115.42 1n0x n SER 52 Ca 0.00 -1.26 -0.41 0.00 -0.26 0.00 0.00 58.87 56.93 1n0x n SER 52 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 -0.26 6.60 0.12 4.04 0.02 -0.39 -4.52 114.94 120.54 1n0x s ASN 53 Ca 0.00 0.64 -0.30 0.00 -1.02 0.00 0.00 52.86 52.17 1n0x s ASN 53 Cb 0.00 -2.36 -0.07 0.00 0.02 0.00 0.00 41.25 38.84 1n0x s ASN 53 CO 0.00 -0.49 1.22 -0.13 0.02 0.00 0.00 177.10 177.72 1n0x s ARG 54 N 2.69 4.45 0.70 -0.60 0.52 -1.26 -0.75 118.95 124.70 1n0x s ARG 54 Ca 0.28 1.84 -0.14 0.00 -0.52 0.00 0.00 55.73 57.20 1n0x s ARG 54 Cb -0.15 -3.29 0.02 0.00 0.52 0.00 0.00 34.95 32.05 1n0x s ARG 54 CO 0.10 -0.20 1.12 0.00 0.02 0.00 0.00 175.30 176.34 1n0x s ALA 55 N 0.60 2.35 0.32 2.13 0.00 -0.57 -4.92 121.76 121.68 1n0x s ALA 55 Ca 0.57 0.53 -0.29 0.00 0.00 0.00 0.00 51.96 52.77 1n0x s ALA 55 Cb -0.31 -3.33 -0.12 0.00 0.00 0.00 0.00 23.12 19.35 1n0x s ALA 55 CO 0.32 -1.50 1.38 -1.13 0.00 0.00 0.00 175.76 174.84 1n0x n SER 56 N -2.74 3.08 0.00 0.00 3.41 -1.26 -1.81 113.62 114.30 1n0x n SER 56 Ca 0.11 1.19 0.00 0.00 -0.26 0.00 0.00 58.87 59.91 1n0x n SER 56 Cb 0.52 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 1n0x n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n0x n GLY 57 N 1.12 1.20 3.71 5.00 0.00 -1.26 -5.02 105.19 109.94 1n0x n GLY 57 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.44 5.12 0.73 -0.61 -1.09 -0.75 -5.05 121.20 116.11 1n0x s ILE 58 Ca 0.00 1.15 -0.15 0.00 -2.23 0.00 0.00 60.65 59.42 1n0x s ILE 58 Cb 0.00 -3.91 0.04 0.00 -1.58 0.00 0.00 42.46 37.01 1n0x s ILE 58 CO 0.00 0.27 1.21 -0.55 -1.23 0.00 0.00 174.94 174.63 1n0x s SER 59 N 0.78 4.22 0.34 3.58 0.15 -1.26 -4.90 113.70 116.61 1n0x s SER 59 Ca 0.30 2.36 0.26 0.00 0.70 0.00 0.00 55.95 59.57 1n0x s SER 59 Cb -0.16 -2.59 1.13 0.00 -1.71 0.00 0.00 66.02 62.69 1n0x s SER 59 CO 0.13 -2.24 1.78 0.44 1.20 0.00 0.00 173.24 174.55 1n0x h ASP 60 N -0.27 0.00 0.31 5.45 5.19 -2.00 -2.37 116.42 122.73 1n0x h ASP 60 Ca -0.48 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 1n0x h ASP 60 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 1n0x h ASP 60 CO 0.50 0.00 0.00 0.08 -3.12 0.00 0.00 179.24 176.70 1n0x h ARG 61 N 0.00 0.00 -5.67 3.56 0.11 -1.93 -3.40 114.38 107.05 1n0x h ARG 61 Ca 0.00 0.00 -0.64 0.00 0.10 0.00 0.00 59.98 59.44 1n0x h ARG 61 Cb 0.34 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.35 1n0x h ARG 61 CO 0.00 0.00 -0.41 -0.06 0.10 0.00 0.00 179.97 179.60 1n0x s PHE 62 N -3.55 3.60 -0.21 4.08 0.40 -0.90 -0.58 117.98 120.82 1n0x s PHE 62 Ca -0.00 0.61 -0.15 0.00 -0.60 0.00 0.00 56.93 56.80 1n0x s PHE 62 Cb 0.08 -2.07 0.06 0.00 0.51 0.00 0.00 43.02 41.61 1n0x s PHE 62 CO 0.31 0.64 0.52 -1.54 0.70 0.00 0.00 175.22 175.85 1n0x s SER 63 N -0.79 -0.63 0.01 1.36 1.04 -0.31 -4.94 113.70 109.44 1n0x s SER 63 Ca 0.16 1.10 0.02 0.00 0.48 0.00 0.00 55.95 57.71 1n0x s SER 63 Cb -0.13 1.04 -0.04 0.00 0.10 0.00 0.00 66.02 66.99 1n0x s SER 63 CO 0.05 -0.20 0.02 -0.83 0.98 0.00 0.00 173.24 173.26 1n0x s GLY 64 N 0.98 1.91 0.27 7.32 0.00 -1.26 -0.93 107.32 115.61 1n0x s GLY 64 Ca -0.06 -0.96 -0.05 0.00 0.00 0.00 0.00 44.72 43.66 1n0x s GLY 64 CO -0.09 -0.85 0.44 -1.14 0.00 0.00 0.00 173.10 171.47 1n0x n SER 65 N 1.23 -1.25 0.00 1.64 3.41 -0.08 -4.13 113.62 114.44 1n0x n SER 65 Ca -0.14 -2.29 0.00 0.00 -0.26 0.00 0.00 58.87 56.19 1n0x n SER 65 Cb 0.53 2.20 0.00 0.00 -0.26 0.00 0.00 64.21 66.68 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 -0.41 0.02 3.61 5.00 0.00 -1.26 -0.93 105.19 111.22 1n0x n GLY 66 Ca -0.02 -2.30 -0.01 0.00 0.00 0.00 0.00 46.02 43.69 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 -0.11 -0.05 0.87 1.61 1.04 -0.56 -4.96 113.70 111.54 1n0x s SER 67 Ca 0.00 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1n0x s SER 67 Cb 0.00 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1n0x s SER 67 CO 0.00 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.70 1n0x n GLY 68 N -0.22 0.74 0.01 7.32 0.00 -1.26 -2.20 105.19 109.57 1n0x n GLY 68 Ca -0.02 0.47 0.01 0.00 0.00 0.00 0.00 46.02 46.49 1n0x n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n0x n THR 69 N 0.00 0.00 -4.10 2.61 -1.04 -1.26 -1.11 114.28 109.37 1n0x n THR 69 Ca 0.00 -0.44 -0.33 0.00 -2.04 0.00 0.00 64.05 61.24 1n0x n THR 69 Cb 0.00 1.00 -0.16 0.00 -1.82 0.00 0.00 70.33 69.36 1n0x n THR 69 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1n0x s ASP 70 N -1.20 3.26 0.09 8.00 1.01 -0.94 -1.17 116.67 125.73 1n0x s ASP 70 Ca 0.01 -0.65 0.09 0.00 0.71 0.00 0.00 52.55 52.71 1n0x s ASP 70 Cb 0.02 -1.50 -0.03 0.00 1.01 0.00 0.00 42.92 42.41 1n0x s ASP 70 CO 0.11 -0.01 -0.22 -0.36 0.21 0.00 0.00 175.17 174.90 1n0x s PHE 71 N 1.30 1.93 0.01 4.23 0.08 -0.42 -1.50 117.98 123.62 1n0x s PHE 71 Ca 0.05 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.71 1n0x s PHE 71 Cb -0.13 -1.08 -0.01 0.00 -0.57 0.00 0.00 43.02 41.23 1n0x s PHE 71 CO -0.12 0.21 -0.04 0.99 -0.10 0.00 0.00 175.22 176.15 1n0x s THR 72 N -1.05 0.31 -0.12 0.64 2.01 -0.11 -1.36 115.64 115.96 1n0x s THR 72 Ca 0.08 -0.49 0.01 0.00 0.31 0.00 0.00 61.69 61.61 1n0x s THR 72 Cb -0.10 -0.32 -0.01 0.00 0.01 0.00 0.00 72.50 72.08 1n0x s THR 72 CO 0.04 -0.12 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.45 1n0x s LEU 73 N -0.65 2.47 -0.02 4.42 2.96 -0.57 -0.90 118.68 126.38 1n0x s LEU 73 Ca -0.04 -0.42 0.04 0.00 -0.22 0.00 0.00 54.13 53.49 1n0x s LEU 73 Cb -0.05 -1.53 -0.01 0.00 0.50 0.00 0.00 46.19 45.10 1n0x s LEU 73 CO -0.00 0.16 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.15 1n0x s THR 74 N 0.36 1.22 -0.25 3.68 2.01 -0.10 -0.02 115.64 122.54 1n0x s THR 74 Ca -0.14 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.25 1n0x s THR 74 Cb -0.17 -1.03 0.05 0.00 0.01 0.00 0.00 72.50 71.36 1n0x s THR 74 CO 0.07 0.35 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.61 1n0x s ILE 75 N -0.14 2.30 0.10 1.82 1.01 0.19 -1.16 121.20 125.32 1n0x s ILE 75 Ca 0.01 -1.40 -0.25 0.00 0.00 0.00 0.00 60.65 59.01 1n0x s ILE 75 Cb -0.08 -2.25 -0.12 0.00 0.01 0.00 0.00 42.46 40.01 1n0x s ILE 75 CO 0.00 0.11 1.69 0.71 0.00 0.00 0.00 174.94 177.46 1n0x h THR 76 N 6.49 0.73 -3.41 2.92 1.35 -1.13 -0.08 112.91 119.79 1n0x h THR 76 Ca -0.26 0.00 -0.56 0.00 -0.55 0.00 0.00 66.41 65.04 1n0x h THR 76 Cb 1.07 0.73 -0.39 0.00 -1.73 0.00 0.00 68.15 67.83 1n0x h THR 76 CO 0.52 0.00 -0.77 0.00 -0.25 0.00 0.00 175.52 175.02 1n0x s ARG 77 N -6.14 1.04 0.16 4.72 1.70 -1.26 -3.60 118.95 115.56 1n0x s ARG 77 Ca -0.14 -0.71 -0.31 0.00 -0.47 0.00 0.00 55.73 54.10 1n0x s ARG 77 Cb 0.07 -2.30 -0.10 0.00 -0.57 0.00 0.00 34.95 32.04 1n0x s ARG 77 CO 0.65 -0.65 1.61 0.08 -1.08 0.00 0.00 175.30 175.91 1n0x s VAL 78 N 1.65 2.59 0.13 4.99 1.01 0.74 -4.74 120.40 126.78 1n0x s VAL 78 Ca -0.02 0.37 0.06 0.00 0.00 0.00 0.00 61.98 62.39 1n0x s VAL 78 Cb -0.18 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 1n0x s VAL 78 CO -0.09 0.02 0.00 -1.61 0.00 0.00 0.00 175.10 173.43 1n0x s GLU 79 N 1.43 2.48 0.52 2.72 0.41 -1.26 0.02 118.70 125.02 1n0x s GLU 79 Ca 0.72 -0.96 0.27 0.00 -0.41 0.00 0.00 54.97 54.59 1n0x s GLU 79 Cb -0.44 -2.46 1.40 0.00 -1.78 0.00 0.00 34.13 30.85 1n0x s GLU 79 CO 0.32 0.50 1.93 -1.00 -0.49 0.00 0.00 175.26 176.52 1n0x h PRO 80 N 3.09 0.05 0.00 0.39 0.13 -1.99 0.16 132.00 133.83 1n0x h PRO 80 Ca -0.48 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1n0x h PRO 80 Cb 1.18 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1n0x h PRO 80 CO 0.59 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.54 1n0x n GLU 81 N -4.34 0.08 0.08 0.86 0.28 -1.26 -3.08 120.64 113.26 1n0x n GLU 81 Ca 0.15 0.29 0.12 0.00 -0.16 0.00 0.00 57.16 57.56 1n0x n GLU 81 Cb 0.77 -1.64 0.20 0.00 1.43 0.00 0.00 31.44 32.21 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 -2.67 -1.84 3.32 -1.08 -3.46 116.42 110.69 1n0x h ASP 82 Ca 0.00 -0.15 -0.53 0.00 0.02 0.00 0.00 57.03 56.38 1n0x h ASP 82 Cb 0.32 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.91 1n0x h ASP 82 CO 0.00 0.07 1.00 -0.36 -1.72 0.00 0.00 179.24 178.24 1n0x s PHE 83 N -3.17 2.57 0.00 4.55 0.40 -1.18 -4.82 117.98 116.34 1n0x s PHE 83 Ca 0.07 0.30 0.00 0.00 -0.60 0.00 0.00 56.93 56.70 1n0x s PHE 83 Cb 0.12 -4.04 0.00 0.00 0.51 0.00 0.00 43.02 39.62 1n0x s PHE 83 CO 0.70 -4.10 0.00 0.00 0.70 0.00 0.00 175.22 172.52 1n0x n ALA 84 N 4.99 0.00 -2.70 5.36 0.00 -0.78 -4.92 120.51 122.47 1n0x n ALA 84 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.31 1n0x n ALA 84 Cb 0.39 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.67 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 2.02 -0.07 0.00 1.43 -0.73 0.17 118.68 121.50 1n0x s LEU 85 Ca 0.00 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.69 1n0x s LEU 85 Cb 0.00 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 45.01 1n0x s LEU 85 CO 0.00 0.23 -0.17 -0.31 0.23 0.00 0.00 176.35 176.33 1n0x s TYR 86 N -0.20 1.87 0.03 0.29 2.02 -0.22 0.49 117.35 121.64 1n0x s TYR 86 Ca -0.01 -0.68 0.06 0.00 -0.37 0.00 0.00 57.07 56.08 1n0x s TYR 86 Cb -0.12 -1.29 -0.02 0.00 -0.40 0.00 0.00 41.96 40.13 1n0x s TYR 86 CO 0.02 -0.29 -0.18 0.71 -1.57 0.00 0.00 175.55 174.24 1n0x s TYR 87 N 0.40 1.57 0.18 2.71 1.51 0.02 -0.82 117.35 122.92 1n0x s TYR 87 Ca -0.13 -0.35 0.06 0.00 -1.01 0.00 0.00 57.07 55.64 1n0x s TYR 87 Cb -0.15 -0.95 -0.04 0.00 -0.11 0.00 0.00 41.96 40.71 1n0x s TYR 87 CO 0.05 0.05 0.07 0.00 -1.11 0.00 0.00 175.55 174.61 1n0x s GLN 89 N -3.09 0.88 0.02 0.00 0.74 0.11 -0.59 119.66 117.72 1n0x s GLN 89 Ca 0.29 -0.00 0.02 0.00 0.05 0.00 0.00 55.36 55.73 1n0x s GLN 89 Cb -0.09 0.40 -0.04 0.00 1.10 0.00 0.00 33.01 34.38 1n0x s GLN 89 CO 0.21 -0.27 0.00 0.14 -0.55 0.00 0.00 175.29 174.83 1n0x s VAL 90 N -1.38 4.11 0.20 1.34 -7.23 -0.82 -0.84 120.40 115.77 1n0x s VAL 90 Ca -0.12 -0.71 -0.03 0.00 -1.81 0.00 0.00 61.98 59.31 1n0x s VAL 90 Cb -0.02 -2.87 -0.03 0.00 0.56 0.00 0.00 36.38 34.01 1n0x s VAL 90 CO 0.06 0.30 0.18 -0.72 -0.31 0.00 0.00 175.10 174.61 1n0x s TYR 91 N -1.15 0.98 0.00 2.82 -0.85 -1.03 -3.38 117.35 114.74 1n0x s TYR 91 Ca 0.21 -1.24 0.00 0.00 -0.52 0.00 0.00 57.07 55.52 1n0x s TYR 91 Cb -0.12 -0.42 0.00 0.00 0.38 0.00 0.00 41.96 41.80 1n0x s TYR 91 CO 0.13 -0.68 0.00 0.41 -1.52 0.00 0.00 175.55 173.89 1n0x n GLY 92 N -0.26 -1.81 4.01 5.49 0.00 -1.21 -4.79 105.19 106.62 1n0x n GLY 92 Ca 0.00 -1.52 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.30 -1.83 -1.64 4.61 0.00 -1.26 -1.94 120.51 117.15 1n0x n ALA 93 Ca 0.00 -0.20 -0.19 0.00 0.00 0.00 0.00 53.44 53.05 1n0x n ALA 93 Cb 0.00 -2.01 -0.07 0.00 0.00 0.00 0.00 19.45 17.37 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 -2.91 -5.27 -3.79 0.00 7.64 -1.26 -4.97 113.62 103.05 1n0x n SER 94 Ca -0.22 0.40 -0.29 0.00 1.01 0.00 0.00 58.87 59.77 1n0x n SER 94 Cb 0.64 -4.41 -0.16 0.00 -1.01 0.00 0.00 64.21 59.27 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 -2.72 3.50 -0.24 6.43 0.01 -0.82 -5.01 113.70 114.85 1n0x s SER 95 Ca 0.00 -1.16 0.15 0.00 1.31 0.00 0.00 55.95 56.25 1n0x s SER 95 Cb 0.00 -0.84 0.47 0.00 0.21 0.00 0.00 66.02 65.86 1n0x s SER 95 CO 0.00 -0.32 1.16 -1.22 0.41 0.00 0.00 173.24 173.27 1n0x n TYR 96 N 4.88 1.59 -2.56 2.43 4.02 -1.24 -2.91 117.16 123.36 1n0x n TYR 96 Ca -0.08 -1.92 -0.36 0.00 -0.01 0.00 0.00 57.90 55.53 1n0x n TYR 96 Cb 0.45 -0.27 -0.04 0.00 -0.02 0.00 0.00 39.34 39.46 1n0x n TYR 96 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1n0x s THR 97 N -3.66 3.77 0.25 -0.72 -4.23 -1.22 -4.79 115.64 105.04 1n0x s THR 97 Ca 0.39 1.32 0.09 0.00 -1.18 0.00 0.00 61.69 62.31 1n0x s THR 97 Cb 0.37 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.51 1n0x s THR 97 CO -0.02 -0.03 -0.00 -0.36 -0.54 0.00 0.00 174.62 173.66 1n0x s PHE 98 N -1.72 2.73 0.86 3.99 0.40 -1.26 -1.94 117.98 121.03 1n0x s PHE 98 Ca 0.59 -0.21 -0.13 0.00 -0.60 0.00 0.00 56.93 56.58 1n0x s PHE 98 Cb -0.21 -1.23 0.12 0.00 0.51 0.00 0.00 43.02 42.21 1n0x s PHE 98 CO 0.26 0.60 1.22 0.20 0.70 0.00 0.00 175.22 178.19 1n0x s GLY 99 N -3.52 1.67 0.00 4.36 0.00 0.24 -4.59 107.32 105.48 1n0x s GLY 99 Ca 0.30 -0.88 0.29 0.00 0.00 0.00 0.00 44.72 44.43 1n0x s GLY 99 CO 0.20 -0.30 1.96 0.61 0.00 0.00 0.00 173.10 175.57 1n0x n GLN 100 N -3.45 0.21 0.00 2.90 0.00 -1.26 -4.74 117.38 111.04 1n0x n GLN 100 Ca 0.11 0.01 0.00 0.00 0.00 0.00 0.00 57.00 57.12 1n0x n GLN 100 Cb 0.60 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.34 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 1.31 0.09 3.02 2.61 0.00 -1.26 -5.03 105.19 105.92 1n0x n GLY 101 Ca 0.10 -1.63 -0.25 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.93 1.15 -0.24 2.61 2.01 0.00 -4.80 115.64 113.44 1n0x s THR 102 Ca 0.00 -0.47 -0.20 0.00 0.31 0.00 0.00 61.69 61.33 1n0x s THR 102 Cb 0.00 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 1n0x s THR 102 CO 0.00 0.36 0.60 -0.75 -0.69 0.00 0.00 174.62 174.15 1n0x s LYS 103 N 0.78 4.13 -0.55 4.92 2.20 -0.83 -1.05 119.74 129.34 1n0x s LYS 103 Ca -0.12 0.51 -0.20 0.00 -0.36 0.00 0.00 55.97 55.80 1n0x s LYS 103 Cb -0.15 -3.63 0.07 0.00 -1.51 0.00 0.00 37.83 32.60 1n0x s LYS 103 CO 0.02 -0.36 0.72 -1.17 -0.36 0.00 0.00 175.35 174.20 1n0x s LEU 104 N 2.31 4.94 -0.00 5.43 2.96 0.44 0.25 118.68 135.02 1n0x s LEU 104 Ca 0.26 -1.02 0.00 0.00 -0.22 0.00 0.00 54.13 53.15 1n0x s LEU 104 Cb -0.16 -2.44 -0.04 0.00 0.50 0.00 0.00 46.19 44.06 1n0x s LEU 104 CO 0.09 -1.05 0.06 -0.70 -1.32 0.00 0.00 176.35 173.43 1n0x s GLU 105 N 2.93 2.98 -0.18 1.98 2.12 0.87 -1.87 118.70 127.54 1n0x s GLU 105 Ca 0.16 -0.53 -0.28 0.00 0.36 0.00 0.00 54.97 54.68 1n0x s GLU 105 Cb -0.20 -2.80 -0.00 0.00 0.26 0.00 0.00 34.13 31.39 1n0x s GLU 105 CO 0.11 0.64 0.99 0.50 -0.54 0.00 0.00 175.26 176.96 1n0x s ARG 106 N -1.72 4.32 0.21 4.30 3.52 -1.26 -0.89 118.95 127.44 1n0x s ARG 106 Ca 0.22 1.31 -0.23 0.00 -0.13 0.00 0.00 55.73 56.89 1n0x s ARG 106 Cb -0.12 -3.59 -0.08 0.00 -1.56 0.00 0.00 34.95 29.59 1n0x s ARG 106 CO 0.13 -0.46 0.78 0.21 -0.81 0.00 0.00 175.30 175.15 1n0x s LYS 107 N 2.59 4.46 0.31 5.12 2.20 0.13 -4.80 119.74 129.75 1n0x s LYS 107 Ca 0.44 1.08 -0.00 0.00 -0.36 0.00 0.00 55.97 57.13 1n0x s LYS 107 Cb -0.16 -3.06 -0.01 0.00 -1.51 0.00 0.00 37.83 33.08 1n0x s LYS 107 CO 0.11 0.47 0.36 -0.98 -0.36 0.00 0.00 175.35 174.96 1n0x s ARG 108 N -1.56 1.73 0.52 4.03 1.70 -1.26 -4.57 118.95 119.54 1n0x s ARG 108 Ca 0.40 -1.77 -0.22 0.00 -0.47 0.00 0.00 55.73 53.67 1n0x s ARG 108 Cb -0.20 0.38 -0.05 0.00 -0.57 0.00 0.00 34.95 34.51 1n0x s ARG 108 CO 0.24 -0.68 1.26 0.95 -1.08 0.00 0.00 175.30 176.00 1n0x s THR 109 N -3.42 2.54 0.44 4.99 -4.23 -1.26 -4.94 115.64 109.77 1n0x s THR 109 Ca 0.34 0.39 -0.26 0.00 -1.18 0.00 0.00 61.69 60.99 1n0x s THR 109 Cb 0.02 -3.19 -0.09 0.00 1.34 0.00 0.00 72.50 70.58 1n0x s THR 109 CO 0.20 -0.02 1.44 -0.69 -0.54 0.00 0.00 174.62 175.02 1n0x s VAL 110 N -1.44 2.04 -0.03 2.29 1.01 -1.26 -4.82 120.40 118.18 1n0x s VAL 110 Ca 0.70 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.71 1n0x s VAL 110 Cb -0.34 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.04 1n0x s VAL 110 CO 0.40 0.01 0.04 0.00 0.00 0.00 0.00 175.10 175.55 1n0x s ALA 111 N -1.19 0.23 0.49 5.51 0.00 0.08 -4.93 121.76 121.96 1n0x s ALA 111 Ca 0.60 0.20 -0.20 0.00 0.00 0.00 0.00 51.96 52.56 1n0x s ALA 111 Cb -0.44 -0.47 -0.08 0.00 0.00 0.00 0.00 23.12 22.12 1n0x s ALA 111 CO 0.58 -0.32 1.06 0.00 0.00 0.00 0.00 175.76 177.09 1n0x s ALA 112 N 1.67 2.84 0.40 0.00 0.00 -1.26 -1.17 121.76 124.24 1n0x s ALA 112 Ca -0.01 0.67 -0.22 0.00 0.00 0.00 0.00 51.96 52.40 1n0x s ALA 112 Cb -0.13 -3.28 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 1n0x s ALA 112 CO -0.03 -0.42 0.96 -1.25 0.00 0.00 0.00 175.76 175.02 1n0x s PRO 113 N -3.19 4.29 -0.20 0.00 0.04 -1.26 -4.59 135.00 130.09 1n0x s PRO 113 Ca 0.68 1.21 -0.19 0.00 0.04 0.00 0.00 61.00 62.74 1n0x s PRO 113 Cb -0.19 -2.35 -0.03 0.00 0.04 0.00 0.00 34.50 31.97 1n0x s PRO 113 CO 0.22 0.02 0.55 -1.12 0.04 0.00 0.00 177.00 176.71 1n0x s SER 114 N -1.99 6.59 -0.12 6.66 0.01 -0.68 -4.81 113.70 119.37 1n0x s SER 114 Ca 0.59 0.72 -0.04 0.00 1.31 0.00 0.00 55.95 58.53 1n0x s SER 114 Cb -0.13 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.76 1n0x s SER 114 CO 0.17 -0.20 0.04 -0.69 0.41 0.00 0.00 173.24 172.96 1n0x s VAL 115 N 1.69 4.61 -0.00 3.43 1.01 -1.26 -0.26 120.40 129.62 1n0x s VAL 115 Ca 0.25 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.12 1n0x s VAL 115 Cb -0.16 -2.99 -0.00 0.00 0.00 0.00 0.00 36.38 33.24 1n0x s VAL 115 CO 0.10 0.57 -0.03 -0.36 0.00 0.00 0.00 175.10 175.38 1n0x s PHE 116 N -0.59 0.28 -0.03 5.22 0.40 -0.19 -4.97 117.98 118.11 1n0x s PHE 116 Ca 0.10 -0.05 0.07 0.00 -0.60 0.00 0.00 56.93 56.46 1n0x s PHE 116 Cb -0.12 -0.20 -0.02 0.00 0.51 0.00 0.00 43.02 43.19 1n0x s PHE 116 CO 0.02 -0.02 -0.24 -1.50 0.70 0.00 0.00 175.22 174.18 1n0x s ILE 117 N 0.01 2.18 -0.09 0.64 2.07 -1.26 0.11 121.20 124.87 1n0x s ILE 117 Ca 0.00 -1.06 0.04 0.00 -1.41 0.00 0.00 60.65 58.22 1n0x s ILE 117 Cb -0.02 -1.77 0.00 0.00 0.13 0.00 0.00 42.46 40.80 1n0x s ILE 117 CO -0.00 0.58 -0.21 -0.36 -1.91 0.00 0.00 174.94 173.04 1n0x s PHE 118 N -0.60 2.22 0.69 3.50 0.08 0.95 -5.01 117.98 119.80 1n0x s PHE 118 Ca 0.10 -0.87 -0.09 0.00 0.12 0.00 0.00 56.93 56.18 1n0x s PHE 118 Cb -0.10 -1.51 0.03 0.00 -0.57 0.00 0.00 43.02 40.87 1n0x s PHE 118 CO -0.01 -0.36 1.04 -2.14 -0.10 0.00 0.00 175.22 173.66 1n0x s PRO 119 N 0.39 2.63 0.56 0.24 0.02 -1.26 -2.09 135.00 135.49 1n0x s PRO 119 Ca -0.17 0.16 -0.18 0.00 0.02 0.00 0.00 61.00 60.83 1n0x s PRO 119 Cb -0.17 -2.10 -0.05 0.00 0.02 0.00 0.00 34.50 32.20 1n0x s PRO 119 CO 0.07 -1.06 1.10 -1.25 -0.33 0.00 0.00 177.00 175.52 1n0x s PRO 120 N -5.27 3.35 0.53 5.54 0.04 -1.22 -4.84 135.00 133.13 1n0x s PRO 120 Ca 0.58 1.47 -0.17 0.00 0.04 0.00 0.00 61.00 62.92 1n0x s PRO 120 Cb -0.11 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1n0x s PRO 120 CO 0.48 -0.82 1.00 -1.54 0.04 0.00 0.00 177.00 176.16 1n0x s SER 121 N -2.07 6.43 0.39 6.66 1.04 -1.26 -4.93 113.70 119.96 1n0x s SER 121 Ca 0.70 1.66 0.13 0.00 0.48 0.00 0.00 55.95 58.91 1n0x s SER 121 Cb -0.21 -2.52 0.78 0.00 0.10 0.00 0.00 66.02 64.18 1n0x s SER 121 CO 0.29 -0.72 1.87 0.44 0.98 0.00 0.00 173.24 176.10 1n0x h ASP 122 N 0.92 0.02 -0.50 7.02 3.32 -1.99 -1.61 116.42 123.61 1n0x h ASP 122 Ca -0.47 -0.01 0.03 0.00 0.02 0.00 0.00 57.03 56.60 1n0x h ASP 122 Cb 1.19 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.70 1n0x h ASP 122 CO 0.60 0.33 0.29 -0.08 -1.72 0.00 0.00 179.24 178.67 1n0x h GLU 123 N 0.02 0.57 -0.20 3.56 4.81 -2.00 -2.13 114.58 119.20 1n0x h GLU 123 Ca 0.00 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.11 1n0x h GLU 123 Cb 0.57 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.82 1n0x h GLU 123 CO 0.04 0.37 -0.19 0.37 -0.73 0.00 0.00 179.01 178.88 1n0x h GLN 124 N 0.58 0.49 -0.32 1.92 4.15 -1.76 -3.04 115.11 117.13 1n0x h GLN 124 Ca 0.20 -0.25 0.09 0.00 0.77 0.00 0.00 58.65 59.46 1n0x h GLN 124 Cb 0.03 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 1n0x h GLN 124 CO -0.10 0.83 0.36 -0.07 -1.93 0.00 0.00 178.83 177.92 1n0x h LEU 125 N 0.16 0.00 0.00 -2.39 3.38 -0.99 0.32 115.31 115.79 1n0x h LEU 125 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1n0x h LEU 125 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1n0x h LEU 125 CO 0.05 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.87 1n0x n LYS 126 N -3.70 0.17 0.00 1.13 5.02 -0.83 -3.08 118.16 116.88 1n0x n LYS 126 Ca 0.05 0.14 0.05 0.00 -2.02 0.00 0.00 58.31 56.54 1n0x n LYS 126 Cb 0.52 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 34.04 1n0x n LYS 126 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1n0x n SER 127 N -1.35 1.43 0.00 4.39 3.41 0.10 -5.02 113.62 116.57 1n0x n SER 127 Ca 0.07 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.47 1n0x n SER 127 Cb 0.16 0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 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 0.83 1.55 3.46 5.00 0.00 -1.18 -5.08 105.19 109.78 1n0x n GLY 128 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1n0x n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n0x s THR 129 N -1.68 2.49 -0.09 2.61 -4.23 -1.26 0.43 115.64 113.90 1n0x s THR 129 Ca 0.00 -2.17 0.01 0.00 -1.18 0.00 0.00 61.69 58.35 1n0x s THR 129 Cb 0.00 -2.25 0.02 0.00 1.34 0.00 0.00 72.50 71.61 1n0x s THR 129 CO 0.00 -0.24 -0.10 0.00 -0.54 0.00 0.00 174.62 173.74 1n0x s ALA 130 N -2.05 1.30 -0.21 3.99 0.00 0.11 -3.82 121.76 121.07 1n0x s ALA 130 Ca 0.25 -0.49 -0.05 0.00 0.00 0.00 0.00 51.96 51.67 1n0x s ALA 130 Cb -0.07 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.27 1n0x s ALA 130 CO 0.13 -0.18 0.01 -1.12 0.00 0.00 0.00 175.76 174.59 1n0x s SER 131 N 1.25 4.82 -0.20 0.00 0.01 -1.26 -1.23 113.70 117.09 1n0x s SER 131 Ca -0.04 -0.23 -0.05 0.00 1.31 0.00 0.00 55.95 56.95 1n0x s SER 131 Cb -0.14 -1.83 -0.02 0.00 0.21 0.00 0.00 66.02 64.23 1n0x s SER 131 CO -0.03 0.03 0.00 -0.69 0.41 0.00 0.00 173.24 172.97 1n0x s VAL 132 N 1.18 3.97 -0.07 3.43 1.01 0.29 -3.37 120.40 126.85 1n0x s VAL 132 Ca 0.03 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1n0x s VAL 132 Cb -0.14 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 1n0x s VAL 132 CO 0.01 0.42 -0.10 -0.69 0.00 0.00 0.00 175.10 174.74 1n0x s VAL 133 N 1.02 3.37 -0.07 2.92 1.01 -0.89 0.18 120.40 127.94 1n0x s VAL 133 Ca 0.02 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.46 1n0x s VAL 133 Cb -0.14 -2.37 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 1n0x s VAL 133 CO 0.02 0.58 -0.24 0.00 0.00 0.00 0.00 175.10 175.46 1n0x s LEU 135 N 0.08 2.41 -0.29 0.00 2.96 0.12 -1.28 118.68 122.68 1n0x s LEU 135 Ca -0.10 -0.44 -0.01 0.00 -0.22 0.00 0.00 54.13 53.36 1n0x s LEU 135 Cb -0.15 -1.51 0.05 0.00 0.50 0.00 0.00 46.19 45.07 1n0x s LEU 135 CO 0.06 0.16 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.48 1n0x s LEU 136 N 0.34 3.83 -0.14 -0.68 1.02 -0.19 -1.02 118.68 121.85 1n0x s LEU 136 Ca -0.15 -1.26 -0.07 0.00 0.02 0.00 0.00 54.13 52.67 1n0x s LEU 136 Cb -0.17 -1.70 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 1n0x s LEU 136 CO 0.07 -0.25 0.12 0.21 0.02 0.00 0.00 176.35 176.53 1n0x s ASN 137 N 1.25 6.21 -0.48 2.29 2.47 0.64 -0.59 114.94 126.72 1n0x s ASN 137 Ca -0.05 0.37 -0.18 0.00 0.42 0.00 0.00 52.86 53.41 1n0x s ASN 137 Cb -0.20 -2.02 0.03 0.00 -1.45 0.00 0.00 41.25 37.61 1n0x s ASN 137 CO -0.01 0.34 0.51 0.59 -3.72 0.00 0.00 177.10 174.81 1n0x n ASN 138 N 2.42 -4.09 -4.49 -4.21 3.02 -1.05 -1.69 115.26 105.18 1n0x n ASN 138 Ca -0.19 -0.41 -0.23 0.00 -0.03 0.00 0.00 54.58 53.72 1n0x n ASN 138 Cb 0.54 -1.26 -0.11 0.00 -0.61 0.00 0.00 39.78 38.35 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 -1.84 2.14 -0.28 3.10 -0.12 0.89 -4.57 117.98 117.31 1n0x s PHE 139 Ca 0.18 -0.70 -0.22 0.00 -0.05 0.00 0.00 56.93 56.14 1n0x s PHE 139 Cb -0.02 -1.31 0.09 0.00 -0.63 0.00 0.00 43.02 41.16 1n0x s PHE 139 CO 0.70 0.32 0.82 -0.47 -0.05 0.00 0.00 175.22 176.54 1n0x s TYR 140 N -2.93 -0.76 1.16 3.49 6.14 -0.32 -0.52 117.35 123.61 1n0x s TYR 140 Ca 0.32 1.71 -0.20 0.00 0.64 0.00 0.00 57.07 59.54 1n0x s TYR 140 Cb 0.05 0.39 0.28 0.00 0.42 0.00 0.00 41.96 43.11 1n0x s TYR 140 CO 0.14 -0.37 1.15 -0.35 0.64 0.00 0.00 175.55 176.77 1n0x n PRO 141 N 3.09 -2.68 -0.04 4.97 -0.04 -1.26 -0.74 135.00 138.29 1n0x n PRO 141 Ca -0.16 -1.82 0.02 0.00 -0.04 0.00 0.00 63.50 61.50 1n0x n PRO 141 Cb 0.56 -1.57 0.35 0.00 -0.04 0.00 0.00 33.50 32.81 1n0x n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1n0x h ARG 142 N 0.00 0.62 -6.35 0.54 2.43 -1.97 -3.44 114.38 106.22 1n0x h ARG 142 Ca -0.42 -0.07 -0.57 0.00 -0.81 0.00 0.00 59.98 58.12 1n0x h ARG 142 Cb 1.24 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1n0x h ARG 142 CO 0.28 0.48 1.13 -1.91 -1.51 0.00 0.00 179.97 178.44 1n0x n GLU 143 N -4.40 2.51 -3.64 0.20 4.07 -1.26 -4.96 120.64 113.16 1n0x n GLU 143 Ca 0.04 0.92 -0.15 0.00 -0.06 0.00 0.00 57.16 57.90 1n0x n GLU 143 Cb 0.11 -2.80 -0.07 0.00 -0.06 0.00 0.00 31.44 28.61 1n0x n GLU 143 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1n0x s ALA 144 N 3.82 -1.35 -0.07 4.31 0.00 -1.26 -4.59 121.76 122.61 1n0x s ALA 144 Ca 0.89 1.05 0.04 0.00 0.00 0.00 0.00 51.96 53.94 1n0x s ALA 144 Cb -0.57 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.36 1n0x s ALA 144 CO 0.45 -0.31 -0.18 0.21 0.00 0.00 0.00 175.76 175.94 1n0x s LYS 145 N -0.89 2.20 -0.12 0.00 2.20 -0.41 -4.99 119.74 117.74 1n0x s LYS 145 Ca -0.09 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 54.89 1n0x s LYS 145 Cb -0.03 -1.77 -0.01 0.00 -1.51 0.00 0.00 37.83 34.51 1n0x s LYS 145 CO 0.06 0.15 -0.16 0.08 -0.36 0.00 0.00 175.35 175.12 1n0x s VAL 146 N 0.35 2.76 -0.12 4.02 1.01 -1.26 -0.66 120.40 126.50 1n0x s VAL 146 Ca -0.13 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1n0x s VAL 146 Cb -0.15 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.11 1n0x s VAL 146 CO 0.05 0.54 -0.17 -1.58 0.00 0.00 0.00 175.10 173.94 1n0x s GLN 147 N 0.27 2.40 -0.05 2.72 2.00 0.76 -4.96 119.66 122.80 1n0x s GLN 147 Ca -0.12 -0.62 -0.12 0.00 -2.00 0.00 0.00 55.36 52.50 1n0x s GLN 147 Cb -0.16 -2.03 -0.05 0.00 0.80 0.00 0.00 33.01 31.57 1n0x s GLN 147 CO 0.06 -0.07 0.31 -1.58 -0.50 0.00 0.00 175.29 173.51 1n0x s TRP 148 N 1.01 3.68 -0.02 1.67 0.52 -1.26 -0.28 118.94 124.26 1n0x s TRP 148 Ca -0.05 0.82 0.01 0.00 0.02 0.00 0.00 56.10 56.90 1n0x s TRP 148 Cb -0.15 -2.17 0.01 0.00 -1.15 0.00 0.00 33.47 30.01 1n0x s TRP 148 CO -0.03 0.67 -0.04 0.15 0.02 0.00 0.00 176.95 177.72 1n0x s LYS 149 N -1.03 0.49 -0.18 4.98 1.02 -0.62 -0.69 119.74 123.71 1n0x s LYS 149 Ca 0.21 -0.13 0.01 0.00 0.02 0.00 0.00 55.97 56.07 1n0x s LYS 149 Cb -0.15 -0.51 0.04 0.00 -0.52 0.00 0.00 37.83 36.69 1n0x s LYS 149 CO 0.10 0.04 -0.12 0.08 -0.92 0.00 0.00 175.35 174.53 1n0x s VAL 150 N 0.26 1.64 -1.56 3.17 1.01 -0.40 -0.98 120.40 123.53 1n0x s VAL 150 Ca -0.03 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 1n0x s VAL 150 Cb -0.06 -1.65 0.09 0.00 0.00 0.00 0.00 36.38 34.75 1n0x s VAL 150 CO -0.00 0.27 0.75 0.47 0.00 0.00 0.00 175.10 176.59 1n0x n ASP 151 N 4.71 -2.89 0.00 3.32 8.00 0.89 -0.53 116.55 130.05 1n0x n ASP 151 Ca -0.16 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.41 1n0x n ASP 151 Cb 0.48 -3.22 0.00 0.00 -0.02 0.00 0.00 41.12 38.35 1n0x n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1n0x n ASN 152 N -2.81 0.00 -4.64 -2.24 5.15 -1.26 -5.00 115.26 104.46 1n0x n ASN 152 Ca -0.05 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.52 1n0x n ASN 152 Cb 0.56 -0.62 -0.05 0.00 -0.53 0.00 0.00 39.78 39.13 1n0x n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n0x s ALA 153 N -3.21 3.61 0.07 5.20 0.00 0.31 -5.01 121.76 122.73 1n0x s ALA 153 Ca 0.00 -0.27 -0.31 0.00 0.00 0.00 0.00 51.96 51.39 1n0x s ALA 153 Cb 0.00 -3.14 -0.07 0.00 0.00 0.00 0.00 23.12 19.90 1n0x s ALA 153 CO 0.00 -0.82 1.51 -1.17 0.00 0.00 0.00 175.76 175.29 1n0x s LEU 154 N 2.55 4.35 -0.04 0.00 0.20 -1.26 -1.28 118.68 123.21 1n0x s LEU 154 Ca 0.31 2.35 -0.20 0.00 0.69 0.00 0.00 54.13 57.27 1n0x s LEU 154 Cb -0.15 -3.57 -0.05 0.00 -0.43 0.00 0.00 46.19 41.99 1n0x s LEU 154 CO 0.08 -0.78 0.58 -1.10 -0.29 0.00 0.00 176.35 174.84 1n0x s GLN 155 N 2.13 4.33 -0.07 1.98 -1.52 0.14 -4.97 119.66 121.67 1n0x s GLN 155 Ca 0.69 0.69 -0.03 0.00 -1.95 0.00 0.00 55.36 54.75 1n0x s GLN 155 Cb -0.37 -3.38 0.04 0.00 -0.22 0.00 0.00 33.01 29.09 1n0x s GLN 155 CO 0.30 0.28 0.13 0.45 -0.25 0.00 0.00 175.29 176.20 1n0x s SER 156 N 0.12 0.86 0.00 5.90 0.15 -1.26 -4.58 113.70 114.89 1n0x s SER 156 Ca 0.31 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.21 1n0x s SER 156 Cb -0.17 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1n0x s SER 156 CO 0.16 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1n0x n GLY 157 N 5.30 0.22 1.20 9.45 0.00 -1.26 -4.97 105.19 115.13 1n0x n GLY 157 Ca -0.04 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.91 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 3.04 -4.07 1.61 2.04 -1.26 -5.02 115.26 111.60 1n0x n ASN 158 Ca 0.00 -3.84 -0.07 0.00 -0.44 0.00 0.00 54.58 50.23 1n0x n ASN 158 Cb 0.00 -0.51 -0.10 0.00 -2.53 0.00 0.00 39.78 36.64 1n0x n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.44 0.00 0.00 177.26 175.88 1n0x s SER 159 N -3.17 0.45 0.02 0.53 1.04 -1.26 -1.52 113.70 109.78 1n0x s SER 159 Ca 0.44 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.94 1n0x s SER 159 Cb 0.39 0.20 -0.01 0.00 0.10 0.00 0.00 66.02 66.70 1n0x s SER 159 CO -0.02 -0.57 -0.03 -1.10 0.98 0.00 0.00 173.24 172.50 1n0x s GLN 160 N -3.67 0.25 0.10 4.02 -0.21 -0.70 -4.96 119.66 114.49 1n0x s GLN 160 Ca 0.05 -0.43 0.02 0.00 0.02 0.00 0.00 55.36 55.02 1n0x s GLN 160 Cb 0.06 0.01 -0.04 0.00 1.00 0.00 0.00 33.01 34.04 1n0x s GLN 160 CO -0.09 -0.02 -0.08 -1.83 -2.12 0.00 0.00 175.29 171.16 1n0x s GLU 161 N -0.98 0.85 0.02 2.91 -1.05 -1.26 -0.15 118.70 119.04 1n0x s GLU 161 Ca -0.10 -1.30 0.01 0.00 -0.15 0.00 0.00 54.97 53.43 1n0x s GLU 161 Cb -0.07 -0.32 -0.02 0.00 -0.44 0.00 0.00 34.13 33.29 1n0x s GLU 161 CO -0.01 0.01 -0.04 0.45 0.95 0.00 0.00 175.26 176.63 1n0x s SER 162 N -2.90 0.41 -0.02 0.83 0.15 -0.17 -4.99 113.70 107.01 1n0x s SER 162 Ca 0.10 -0.38 0.04 0.00 0.70 0.00 0.00 55.95 56.41 1n0x s SER 162 Cb 0.03 0.05 -0.01 0.00 -1.71 0.00 0.00 66.02 64.38 1n0x s SER 162 CO -0.03 -0.18 -0.15 -0.69 1.20 0.00 0.00 173.24 173.38 1n0x s VAL 163 N -1.04 1.23 0.76 4.45 1.01 -1.26 -1.35 120.40 124.20 1n0x s VAL 163 Ca -0.10 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.13 1n0x s VAL 163 Cb -0.07 -1.05 0.05 0.00 0.00 0.00 0.00 36.38 35.30 1n0x s VAL 163 CO -0.00 0.36 1.08 0.42 0.00 0.00 0.00 175.10 176.95 1n0x s THR 164 N -0.14 3.49 0.72 3.92 -4.23 -0.69 -5.00 115.64 113.71 1n0x s THR 164 Ca 0.01 0.48 -0.11 0.00 -1.18 0.00 0.00 61.69 60.90 1n0x s THR 164 Cb -0.08 -3.15 0.02 0.00 1.34 0.00 0.00 72.50 70.63 1n0x s THR 164 CO 0.00 -0.63 1.07 -1.61 -0.54 0.00 0.00 174.62 172.91 1n0x s GLU 165 N -5.03 2.72 0.22 3.99 0.41 -1.26 -4.60 118.70 115.14 1n0x s GLU 165 Ca 0.60 1.02 -0.32 0.00 -0.41 0.00 0.00 54.97 55.86 1n0x s GLU 165 Cb -0.15 -1.96 -0.12 0.00 -1.78 0.00 0.00 34.13 30.11 1n0x s GLU 165 CO 0.55 -1.27 1.66 0.94 -0.49 0.00 0.00 175.26 176.64 1n0x n GLN 166 N -3.26 2.60 -1.89 1.61 7.27 -1.26 -4.81 117.38 117.64 1n0x n GLN 166 Ca 0.08 0.93 -0.42 0.00 0.07 0.00 0.00 57.00 57.66 1n0x n GLN 166 Cb 0.53 -2.74 -0.03 0.00 2.41 0.00 0.00 30.24 30.41 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 0.95 6.56 0.35 1.69 -1.08 -0.11 -4.88 116.67 120.15 1n0x s ASP 167 Ca 0.74 2.61 0.27 0.00 -0.52 0.00 0.00 52.55 55.64 1n0x s ASP 167 Cb -0.55 -2.58 1.15 0.00 -1.46 0.00 0.00 42.92 39.48 1n0x s ASP 167 CO 0.37 -0.88 1.80 0.77 0.52 0.00 0.00 175.17 177.75 1n0x h SER 168 N 7.50 0.00 0.03 -0.34 4.64 -1.91 0.40 113.55 123.87 1n0x h SER 168 Ca -0.43 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.50 1n0x h SER 168 Cb 1.20 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.24 1n0x h SER 168 CO 0.93 0.00 -2.32 0.29 -0.87 0.00 0.00 176.83 174.85 1n0x n LYS 169 N -2.48 0.66 -0.00 4.77 4.01 -1.26 -4.69 118.16 119.16 1n0x n LYS 169 Ca 0.01 0.22 0.00 0.00 -0.51 0.00 0.00 58.31 58.03 1n0x n LYS 169 Cb 0.23 -1.57 0.00 0.00 -0.51 0.00 0.00 35.03 33.18 1n0x n LYS 169 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 1n0x n ASP 170 N -3.55 1.58 -2.01 4.39 3.85 -1.24 -5.01 116.55 114.56 1n0x n ASP 170 Ca -0.44 -1.56 -0.19 0.00 -0.71 0.00 0.00 54.79 51.90 1n0x n ASP 170 Cb 0.97 -0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 40.69 1n0x n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1n0x n SER 171 N -0.25 -5.16 -4.94 -1.12 7.64 0.13 -4.96 113.62 104.96 1n0x n SER 171 Ca 0.00 0.23 -0.19 0.00 1.01 0.00 0.00 58.87 59.92 1n0x n SER 171 Cb 0.14 -4.45 -0.01 0.00 -1.01 0.00 0.00 64.21 58.89 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 -2.77 2.77 0.29 0.44 -4.23 -1.26 -4.68 115.64 106.21 1n0x s THR 172 Ca 0.00 -1.19 0.11 0.00 -1.18 0.00 0.00 61.69 59.43 1n0x s THR 172 Cb 0.00 -2.96 -0.05 0.00 1.34 0.00 0.00 72.50 70.83 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 -2.43 2.26 0.03 3.99 1.51 0.32 -0.94 117.35 122.09 1n0x s TYR 173 Ca 0.51 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 56.19 1n0x s TYR 173 Cb -0.06 -1.05 -0.02 0.00 -0.11 0.00 0.00 41.96 40.71 1n0x s TYR 173 CO 0.30 0.66 -0.05 -1.12 -1.11 0.00 0.00 175.55 174.23 1n0x s SER 174 N -3.51 0.47 0.02 2.29 0.01 -1.26 -0.08 113.70 111.64 1n0x s SER 174 Ca 0.30 -0.54 0.01 0.00 1.31 0.00 0.00 55.95 57.02 1n0x s SER 174 Cb -0.03 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 1n0x s SER 174 CO 0.15 -0.28 -0.04 -0.22 0.41 0.00 0.00 173.24 173.25 1n0x s LEU 175 N -1.58 2.16 -0.06 2.44 0.20 0.24 -1.70 118.68 120.39 1n0x s LEU 175 Ca -0.13 -0.35 0.02 0.00 0.69 0.00 0.00 54.13 54.37 1n0x s LEU 175 Cb -0.09 -0.05 0.01 0.00 -0.43 0.00 0.00 46.19 45.63 1n0x s LEU 175 CO -0.01 -0.16 -0.12 -0.55 -0.29 0.00 0.00 176.35 175.23 1n0x s SER 176 N -0.99 1.70 -0.07 3.68 0.15 -0.46 -1.02 113.70 116.70 1n0x s SER 176 Ca -0.08 -0.28 0.05 0.00 0.70 0.00 0.00 55.95 56.33 1n0x s SER 176 Cb -0.07 -0.78 -0.00 0.00 -1.71 0.00 0.00 66.02 63.45 1n0x s SER 176 CO -0.00 0.03 -0.23 -0.55 1.20 0.00 0.00 173.24 173.69 1n0x s SER 177 N 0.66 2.85 -0.16 5.45 0.15 -0.40 -1.00 113.70 121.25 1n0x s SER 177 Ca -0.14 -0.49 0.01 0.00 0.70 0.00 0.00 55.95 56.03 1n0x s SER 177 Cb -0.16 -0.98 0.01 0.00 -1.71 0.00 0.00 66.02 63.18 1n0x s SER 177 CO 0.03 0.19 -0.19 -0.89 1.20 0.00 0.00 173.24 173.58 1n0x s THR 178 N 0.08 2.23 -0.19 6.45 2.01 0.78 -0.84 115.64 126.16 1n0x s THR 178 Ca -0.09 -0.90 -0.14 0.00 0.31 0.00 0.00 61.69 60.87 1n0x s THR 178 Cb -0.15 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 1n0x s THR 178 CO 0.05 0.53 0.29 -0.22 -0.69 0.00 0.00 174.62 174.58 1n0x s LEU 179 N 1.04 4.18 -0.15 4.42 2.96 0.13 -1.72 118.68 129.54 1n0x s LEU 179 Ca -0.01 0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 54.27 1n0x s LEU 179 Cb -0.14 -2.35 -0.03 0.00 0.50 0.00 0.00 46.19 44.17 1n0x s LEU 179 CO -0.06 0.04 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.07 1n0x s THR 180 N 0.87 3.79 0.05 3.68 2.01 -0.58 -0.54 115.64 124.92 1n0x s THR 180 Ca 0.15 -0.39 -0.00 0.00 0.31 0.00 0.00 61.69 61.75 1n0x s THR 180 Cb -0.14 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 1n0x s THR 180 CO 0.05 0.50 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.68 1n0x s LEU 181 N 0.35 2.45 0.63 4.42 1.02 -0.36 -4.90 118.68 122.29 1n0x s LEU 181 Ca -0.05 -0.92 -0.12 0.00 0.02 0.00 0.00 54.13 53.07 1n0x s LEU 181 Cb -0.14 0.13 -0.03 0.00 0.02 0.00 0.00 46.19 46.17 1n0x s LEU 181 CO 0.03 -0.52 1.04 -0.94 0.02 0.00 0.00 176.35 175.98 1n0x s SER 182 N -2.69 5.98 0.22 2.29 1.04 -1.26 0.06 113.70 119.33 1n0x s SER 182 Ca 0.04 1.51 -0.09 0.00 0.48 0.00 0.00 55.95 57.89 1n0x s SER 182 Cb 0.04 -2.48 0.18 0.00 0.10 0.00 0.00 66.02 63.87 1n0x s SER 182 CO -0.08 -1.04 1.88 0.50 0.98 0.00 0.00 173.24 175.48 1n0x h LYS 183 N -0.30 0.99 -0.32 4.02 3.64 -0.30 -2.09 116.57 122.22 1n0x h LYS 183 Ca -0.44 -0.06 0.04 0.00 -1.27 0.00 0.00 60.65 58.92 1n0x h LYS 183 Cb 1.20 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.76 1n0x h LYS 183 CO 0.60 0.66 0.10 0.00 -2.27 0.00 0.00 179.45 178.53 1n0x h ALA 184 N 1.30 0.35 -0.55 5.00 0.00 -1.92 -2.42 119.26 121.02 1n0x h ALA 184 Ca 0.29 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 1n0x h ALA 184 Cb -0.08 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1n0x h ALA 184 CO -0.08 -0.31 -0.01 -0.44 0.00 0.00 0.00 179.25 178.42 1n0x h ASP 185 N 0.23 0.96 -0.50 0.00 3.32 -1.88 -3.02 116.42 115.53 1n0x h ASP 185 Ca 0.14 -0.31 0.05 0.00 0.02 0.00 0.00 57.03 56.93 1n0x h ASP 185 Cb 0.13 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 1n0x h ASP 185 CO -0.16 1.04 0.23 0.22 -1.72 0.00 0.00 179.24 178.85 1n0x h TYR 186 N 0.85 0.42 0.00 4.55 3.20 -1.15 -1.18 116.97 123.66 1n0x h TYR 186 Ca 0.15 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1n0x h TYR 186 Cb 0.55 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.70 1n0x h TYR 186 CO 0.04 0.19 0.00 0.39 -1.64 0.00 0.00 178.16 177.14 1n0x n GLU 187 N -4.92 0.17 0.00 1.82 1.02 -0.93 -2.51 120.64 115.29 1n0x n GLU 187 Ca 0.04 0.43 0.13 0.00 -0.02 0.00 0.00 57.16 57.74 1n0x n GLU 187 Cb 0.15 -1.84 0.44 0.00 -0.02 0.00 0.00 31.44 30.18 1n0x n GLU 187 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1n0x n LYS 188 N -2.15 0.11 -4.35 3.49 5.02 -0.45 -4.91 118.16 114.93 1n0x n LYS 188 Ca 0.02 -0.04 -0.19 0.00 -2.02 0.00 0.00 58.31 56.07 1n0x n LYS 188 Cb 0.20 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.61 1n0x n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1n0x s HIS 189 N -2.92 1.76 -0.16 2.13 3.76 -1.04 -5.09 115.29 113.73 1n0x s HIS 189 Ca 0.15 -0.54 -0.14 0.00 -0.15 0.00 0.00 55.06 54.38 1n0x s HIS 189 Cb 0.18 -0.83 -0.06 0.00 1.11 0.00 0.00 32.58 32.99 1n0x s HIS 189 CO 0.60 0.37 -0.30 1.17 -0.85 0.00 0.00 174.74 175.74 1n0x n LYS 190 N -0.25 0.46 -3.34 1.40 4.81 -1.26 -4.68 118.16 115.29 1n0x n LYS 190 Ca -0.09 0.19 -0.39 0.00 -0.87 0.00 0.00 58.31 57.14 1n0x n LYS 190 Cb 0.60 -1.30 -0.09 0.00 0.02 0.00 0.00 35.03 34.26 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 -2.68 5.14 -0.23 3.15 1.01 -1.26 -0.34 120.40 125.18 1n0x s VAL 191 Ca -0.26 0.62 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 1n0x s VAL 191 Cb 0.06 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1n0x s VAL 191 CO 0.37 0.11 -0.04 -0.31 0.00 0.00 0.00 175.10 175.24 1n0x s TYR 192 N 2.15 2.99 0.10 5.22 2.02 -0.61 -0.07 117.35 129.15 1n0x s TYR 192 Ca 0.17 -1.09 0.06 0.00 -0.37 0.00 0.00 57.07 55.83 1n0x s TYR 192 Cb -0.16 -2.11 -0.03 0.00 -0.40 0.00 0.00 41.96 39.26 1n0x s TYR 192 CO 0.10 -0.60 -0.14 0.00 -1.57 0.00 0.00 175.55 173.34 1n0x s ALA 193 N 1.44 1.37 -0.21 3.71 0.00 -0.15 -1.30 121.76 126.62 1n0x s ALA 193 Ca 0.04 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1n0x s ALA 193 Cb -0.15 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 22.94 1n0x s ALA 193 CO -0.03 0.12 -0.06 0.00 0.00 0.00 0.00 175.76 175.79 1n0x s GLU 195 N 1.49 3.93 -0.11 0.00 2.12 0.61 -1.41 118.70 125.34 1n0x s GLU 195 Ca -0.03 -0.35 0.01 0.00 0.36 0.00 0.00 54.97 54.96 1n0x s GLU 195 Cb -0.17 -3.35 -0.02 0.00 0.26 0.00 0.00 34.13 30.85 1n0x s GLU 195 CO -0.07 0.09 -0.12 0.08 -0.54 0.00 0.00 175.26 174.70 1n0x s VAL 196 N 0.90 3.15 -0.14 3.70 1.01 0.11 -0.17 120.40 128.96 1n0x s VAL 196 Ca 0.05 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.38 1n0x s VAL 196 Cb -0.13 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1n0x s VAL 196 CO 0.03 0.54 -0.13 -0.89 0.00 0.00 0.00 175.10 174.65 1n0x s THR 197 N 0.04 2.98 -0.03 3.92 2.01 0.16 -1.19 115.64 123.53 1n0x s THR 197 Ca -0.04 -0.68 -0.23 0.00 0.31 0.00 0.00 61.69 61.05 1n0x s THR 197 Cb -0.14 -2.25 0.05 0.00 0.01 0.00 0.00 72.50 70.16 1n0x s THR 197 CO 0.04 0.52 0.50 -2.28 -0.69 0.00 0.00 174.62 172.71 1n0x s HIS 198 N 0.51 -0.42 0.61 4.92 2.46 -1.26 -1.29 115.29 120.82 1n0x s HIS 198 Ca -0.09 0.70 0.32 0.00 0.47 0.00 0.00 55.06 56.46 1n0x s HIS 198 Cb -0.16 0.26 1.83 0.00 -0.13 0.00 0.00 32.58 34.38 1n0x s HIS 198 CO 0.04 -0.50 2.16 0.37 -2.47 0.00 0.00 174.74 174.34 1n0x h GLN 199 N 3.42 0.00 -0.03 2.88 4.15 -1.93 0.06 115.11 123.67 1n0x h GLN 199 Ca -0.28 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.14 1n0x h GLN 199 Cb 1.16 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.85 1n0x h GLN 199 CO 0.40 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.71 1n0x n GLY 200 N -1.31 -0.58 3.01 2.39 0.00 -1.26 -4.65 105.19 102.79 1n0x n GLY 200 Ca -0.01 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.85 2.62 0.00 0.99 1.43 0.01 -4.51 118.68 117.37 1n0x s LEU 201 Ca 0.39 -1.06 0.13 0.00 -1.03 0.00 0.00 54.13 52.56 1n0x s LEU 201 Cb 0.19 -1.32 0.69 0.00 0.03 0.00 0.00 46.19 45.78 1n0x s LEU 201 CO 0.31 -0.16 1.29 -2.11 0.23 0.00 0.00 176.35 175.91 1n0x n ARG 202 N 4.61 0.25 -3.66 1.70 1.85 -1.26 -4.55 116.66 115.59 1n0x n ARG 202 Ca -0.14 0.12 -0.10 0.00 -1.00 0.00 0.00 57.85 56.73 1n0x n ARG 202 Cb 0.45 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.28 1n0x n ARG 202 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1n0x s SER 203 N -2.41 -0.74 0.14 2.89 0.01 -1.26 -5.14 113.70 107.19 1n0x s SER 203 Ca 0.14 1.27 -0.34 0.00 1.31 0.00 0.00 55.95 58.33 1n0x s SER 203 Cb 0.09 1.19 -0.16 0.00 0.21 0.00 0.00 66.02 67.35 1n0x s SER 203 CO 0.18 -0.22 1.18 -2.65 0.41 0.00 0.00 173.24 172.14 1n0x n PRO 204 N 3.80 1.04 -3.57 12.44 -0.02 -1.26 -4.94 135.00 142.49 1n0x n PRO 204 Ca -0.19 0.37 -0.36 0.00 -2.02 0.00 0.00 63.50 61.30 1n0x n PRO 204 Cb 0.57 -1.89 -0.08 0.00 -0.02 0.00 0.00 33.50 32.08 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 -0.04 5.32 -0.10 -1.45 1.01 -0.33 -4.89 120.40 119.91 1n0x s VAL 205 Ca 0.77 0.45 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1n0x s VAL 205 Cb -0.91 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 31.86 1n0x s VAL 205 CO 0.51 0.37 -0.15 -0.89 0.00 0.00 0.00 175.10 174.95 1n0x s THR 206 N 0.65 2.94 -0.02 3.92 2.01 -1.26 0.07 115.64 123.94 1n0x s THR 206 Ca 0.14 -0.72 0.06 0.00 0.31 0.00 0.00 61.69 61.48 1n0x s THR 206 Cb -0.13 -2.20 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 1n0x s THR 206 CO 0.03 0.55 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.76 1n0x s LYS 207 N 0.04 1.76 0.30 4.92 -0.14 -0.50 -4.98 119.74 121.15 1n0x s LYS 207 Ca -0.05 -0.74 -0.19 0.00 -1.36 0.00 0.00 55.97 53.63 1n0x s LYS 207 Cb -0.15 -1.66 0.02 0.00 -1.68 0.00 0.00 37.83 34.37 1n0x s LYS 207 CO 0.04 0.42 0.70 -1.54 -0.76 0.00 0.00 175.35 174.22 1n0x s SER 208 N -0.41 -0.16 0.03 2.83 1.04 -1.26 -0.11 113.70 115.66 1n0x s SER 208 Ca 0.06 -0.78 -0.12 0.00 0.48 0.00 0.00 55.95 55.59 1n0x s SER 208 Cb -0.09 0.74 0.02 0.00 0.10 0.00 0.00 66.02 66.79 1n0x s SER 208 CO -0.00 -1.40 0.27 0.72 0.98 0.00 0.00 173.24 173.81 1n0x s PHE 209 N -3.57 -0.07 -0.24 5.02 -0.71 -0.42 -5.00 117.98 112.98 1n0x s PHE 209 Ca 0.14 -0.05 -0.11 0.00 -1.04 0.00 0.00 56.93 55.86 1n0x s PHE 209 Cb -0.05 0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.76 1n0x s PHE 209 CO 0.08 -0.46 0.17 -0.80 -1.34 0.00 0.00 175.22 172.88 1n0x s ASN 210 N -1.92 6.12 0.59 1.98 -0.87 -1.25 -1.57 114.94 118.02 1n0x s ASN 210 Ca -0.07 0.12 -0.19 0.00 -1.57 0.00 0.00 52.86 51.15 1n0x s ASN 210 Cb -0.02 -2.11 -0.06 0.00 -0.02 0.00 0.00 41.25 39.04 1n0x s ASN 210 CO -0.02 0.05 0.89 -1.14 -2.57 0.00 0.00 177.10 174.31 1n0x n ARG 211 N 4.34 0.85 0.00 -0.60 0.63 0.53 -3.93 116.66 118.48 1n0x n ARG 211 Ca -0.15 0.33 0.00 0.00 -0.92 0.00 0.00 57.85 57.11 1n0x n ARG 211 Cb 0.52 -2.08 0.00 0.00 0.45 0.00 0.00 32.46 31.35 1n0x n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1n0x n GLY 212 N 1.37 2.00 3.56 5.14 0.00 -1.26 -4.76 105.19 111.24 1n0x n GLY 212 Ca 0.13 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 1n0x n GLY 212 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1n0x s GLU 213 N 0.00 1.62 0.00 1.61 1.03 -1.25 -5.26 118.70 116.44 1n0x s GLU 213 Ca 0.00 0.49 0.00 0.00 0.03 0.00 0.00 54.97 55.49 1n0x s GLU 213 Cb 0.00 -4.79 0.00 0.00 -0.80 0.00 0.00 34.13 28.54 1n0x s GLU 213 CO 0.00 -4.42 0.00 0.00 -1.33 0.00 0.00 175.26 169.51