#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e5x s LYS 2 N 0.00 3.54 -0.05 3.17 2.20 -1.26 -0.90 119.74 126.44 2e5x s LYS 2 Ca 0.00 -0.44 0.03 0.00 -0.36 0.00 0.00 55.97 55.20 2e5x s LYS 2 Cb 0.00 -2.95 0.00 0.00 -1.51 0.00 0.00 37.83 33.37 2e5x s LYS 2 CO 0.00 0.39 -0.14 0.42 -0.36 0.00 0.00 175.35 175.66 2e5x s ILE 3 N -0.01 1.22 -0.22 5.43 1.01 0.13 -4.30 121.20 124.46 2e5x s ILE 3 Ca 0.03 -0.57 -0.18 0.00 0.00 0.00 0.00 60.65 59.93 2e5x s ILE 3 Cb -0.13 -1.08 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 2e5x s ILE 3 CO 0.02 0.37 0.51 -0.36 0.00 0.00 0.00 174.94 175.48 2e5x s PHE 4 N 0.33 3.33 -0.46 3.97 0.08 -0.56 -1.65 117.98 123.02 2e5x s PHE 4 Ca -0.09 0.71 -0.16 0.00 0.12 0.00 0.00 56.93 57.51 2e5x s PHE 4 Cb -0.13 -2.68 0.05 0.00 -0.57 0.00 0.00 43.02 39.69 2e5x s PHE 4 CO 0.03 -0.17 0.43 0.12 -0.10 0.00 0.00 175.22 175.53 2e5x s PHE 5 N 1.88 3.19 -0.72 0.36 5.36 -0.20 -0.62 117.98 127.25 2e5x s PHE 5 Ca 0.23 -0.72 -0.25 0.00 -0.96 0.00 0.00 56.93 55.23 2e5x s PHE 5 Cb -0.15 -3.12 0.05 0.00 -0.34 0.00 0.00 43.02 39.46 2e5x s PHE 5 CO 0.09 -0.80 1.15 0.42 -1.46 0.00 0.00 175.22 174.62 2e5x s ILE 6 N 1.92 4.00 0.09 3.12 -1.09 -0.16 -1.27 121.20 127.82 2e5x s ILE 6 Ca 0.08 0.01 -0.25 0.00 -2.23 0.00 0.00 60.65 58.25 2e5x s ILE 6 Cb -0.21 -4.82 0.08 0.00 -1.58 0.00 0.00 42.46 35.92 2e5x s ILE 6 CO 0.09 -1.69 0.66 0.28 -1.23 0.00 0.00 174.94 173.05 2e5x s THR 7 N 4.95 0.00 -2.18 2.92 -1.32 -1.12 -4.57 115.64 114.32 2e5x s THR 7 Ca 0.30 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.96 2e5x s THR 7 Cb -0.11 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 70.04 2e5x s THR 7 CO 0.12 0.00 1.09 -1.54 -2.21 0.00 0.00 174.62 172.08 2e5x n SER 8 N -0.09 2.56 -4.43 8.08 3.41 -1.26 -4.03 113.62 117.85 2e5x n SER 8 Ca -0.16 -1.76 -0.44 0.00 -0.26 0.00 0.00 58.87 56.25 2e5x n SER 8 Cb 0.63 -0.03 -0.08 0.00 -0.26 0.00 0.00 64.21 64.47 2e5x n SER 8 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2e5x s ASN 9 N -1.45 6.16 0.38 4.04 3.84 -1.26 -4.95 114.94 121.70 2e5x s ASN 9 Ca 0.22 -1.04 0.08 0.00 0.21 0.00 0.00 52.86 52.33 2e5x s ASN 9 Cb 0.15 -2.20 0.77 0.00 -0.55 0.00 0.00 41.25 39.42 2e5x s ASN 9 CO 0.23 -0.62 1.93 1.55 -2.79 0.00 0.00 177.10 177.40 2e5x h PRO 10 N 8.75 0.33 -0.37 0.43 0.13 -2.00 -2.64 132.00 136.63 2e5x h PRO 10 Ca -0.28 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 2e5x h PRO 10 Cb 1.11 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 2e5x h PRO 10 CO 0.84 0.40 0.13 0.78 -0.23 0.00 0.00 178.00 179.92 2e5x h GLY 11 N 0.70 0.60 1.01 1.56 0.00 -1.95 -1.82 103.07 103.18 2e5x h GLY 11 Ca 0.07 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.06 2e5x h GLY 11 CO 0.01 0.32 0.62 0.50 0.00 0.00 0.00 176.54 177.99 2e5x h LYS 12 N 0.45 1.27 -0.18 4.80 1.57 -1.93 -2.07 116.57 120.48 2e5x h LYS 12 Ca 0.12 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2e5x h LYS 12 Cb 0.22 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2e5x h LYS 12 CO -0.01 0.85 0.10 0.28 -0.57 0.00 0.00 179.45 180.11 2e5x h VAL 13 N 1.30 1.09 -0.55 0.50 2.07 -1.16 -0.74 116.25 118.76 2e5x h VAL 13 Ca 0.35 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.66 2e5x h VAL 13 Cb -0.13 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 2e5x h VAL 13 CO -0.07 0.09 0.32 0.03 0.02 0.00 0.00 177.57 177.95 2e5x h ARG 14 N 0.20 0.60 -0.46 1.57 3.08 -1.04 0.76 114.38 119.09 2e5x h ARG 14 Ca 0.06 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 2e5x h ARG 14 Cb 0.05 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2e5x h ARG 14 CO -0.01 0.40 0.10 0.93 -1.07 0.00 0.00 179.97 180.31 2e5x h GLU 15 N 0.62 0.75 -0.14 0.04 5.08 -1.18 -0.34 114.58 119.41 2e5x h GLU 15 Ca 0.23 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2e5x h GLU 15 Cb 0.07 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 2e5x h GLU 15 CO -0.12 0.75 -0.03 0.28 -1.00 0.00 0.00 179.01 178.89 2e5x h VAL 16 N 0.62 1.29 -0.65 3.13 2.07 -0.86 -2.13 116.25 119.71 2e5x h VAL 16 Ca 0.14 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 2e5x h VAL 16 Cb 0.35 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2e5x h VAL 16 CO 0.00 0.28 0.37 0.00 0.02 0.00 0.00 177.57 178.25 2e5x h ALA 17 N 0.71 0.83 -0.12 1.67 0.00 -0.83 -0.43 119.26 121.09 2e5x h ALA 17 Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2e5x h ALA 17 Cb 0.45 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2e5x h ALA 17 CO 0.01 0.33 0.07 -0.97 0.00 0.00 0.00 179.25 178.70 2e5x h ASN 18 N 0.88 0.14 0.86 0.00 -0.73 -1.04 0.38 115.58 116.08 2e5x h ASN 18 Ca 0.23 -0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.33 2e5x h ASN 18 Cb 0.02 -0.03 0.01 0.00 0.27 0.00 0.00 38.32 38.58 2e5x h ASN 18 CO -0.04 0.12 -0.41 0.15 -0.37 0.00 0.00 177.43 176.88 2e5x h PHE 19 N 0.14 -1.08 0.00 0.67 3.04 -1.12 -3.24 116.94 115.36 2e5x h PHE 19 Ca 0.04 -0.03 -0.06 0.00 3.98 0.00 0.00 57.97 61.90 2e5x h PHE 19 Cb 0.01 0.36 -0.01 0.00 2.56 0.00 0.00 35.95 38.86 2e5x h PHE 19 CO -0.06 -0.67 -0.31 -0.07 -2.02 0.00 0.00 178.31 175.18 2e5x h LEU 20 N -1.25 0.00 -1.39 0.59 3.38 -1.14 -3.18 115.31 112.33 2e5x h LEU 20 Ca -0.12 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.86 2e5x h LEU 20 Cb 0.89 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2e5x h LEU 20 CO 0.19 0.31 0.42 1.23 0.09 0.00 0.00 178.44 180.69 2e5x h GLY 21 N 2.31 0.89 2.00 0.83 0.00 -0.28 -0.62 103.07 108.20 2e5x h GLY 21 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2e5x h GLY 21 CO 0.04 0.31 0.00 -1.30 0.00 0.00 0.00 176.54 175.59 2e5x n THR 22 N -4.45 0.97 -0.76 4.70 -2.24 -1.20 -0.91 114.28 110.39 2e5x n THR 22 Ca 0.07 0.64 0.08 0.00 -2.27 0.00 0.00 64.05 62.56 2e5x n THR 22 Cb 0.06 -1.63 0.26 0.00 -2.10 0.00 0.00 70.33 66.93 2e5x n THR 22 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2e5x n PHE 23 N -2.28 1.00 -1.00 4.78 3.72 -0.27 -4.95 117.46 118.45 2e5x n PHE 23 Ca -0.01 -0.75 0.00 0.00 -0.05 0.00 0.00 57.45 56.65 2e5x n PHE 23 Cb 0.08 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.36 2e5x n PHE 23 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2e5x n GLY 24 N 0.01 0.51 3.72 1.37 0.00 -0.09 -4.94 105.19 105.77 2e5x n GLY 24 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 2e5x n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2e5x s ILE 25 N -2.04 5.08 -0.17 -0.61 1.01 -1.00 -3.91 121.20 119.56 2e5x s ILE 25 Ca 0.00 1.34 -0.17 0.00 0.00 0.00 0.00 60.65 61.82 2e5x s ILE 25 Cb 0.00 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 2e5x s ILE 25 CO 0.00 0.27 0.42 -0.70 0.00 0.00 0.00 174.94 174.93 2e5x s GLU 26 N 0.76 4.24 -0.19 2.79 2.12 -0.08 -3.82 118.70 124.51 2e5x s GLU 26 Ca 0.35 0.29 -0.03 0.00 0.36 0.00 0.00 54.97 55.94 2e5x s GLU 26 Cb -0.17 -3.49 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 2e5x s GLU 26 CO 0.16 0.05 -0.07 0.42 -0.54 0.00 0.00 175.26 175.29 2e5x s ILE 27 N 1.01 3.31 -0.22 -3.70 -1.09 -1.26 -0.69 121.20 118.55 2e5x s ILE 27 Ca 0.21 -0.53 0.01 0.00 -2.23 0.00 0.00 60.65 58.11 2e5x s ILE 27 Cb -0.15 -2.47 0.03 0.00 -1.58 0.00 0.00 42.46 38.29 2e5x s ILE 27 CO 0.08 0.45 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.43 2e5x s VAL 28 N 1.14 2.36 0.26 2.92 1.01 -0.66 -4.98 120.40 122.45 2e5x s VAL 28 Ca 0.02 -1.15 -0.30 0.00 0.00 0.00 0.00 61.98 60.55 2e5x s VAL 28 Cb -0.14 -2.17 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 2e5x s VAL 28 CO -0.01 0.28 1.12 -1.58 0.00 0.00 0.00 175.10 174.91 2e5x s GLN 29 N 1.25 4.60 -0.14 2.72 0.74 -1.26 -1.03 119.66 126.54 2e5x s GLN 29 Ca -0.00 1.83 -0.03 0.00 0.05 0.00 0.00 55.36 57.20 2e5x s GLN 29 Cb -0.16 -3.20 0.05 0.00 1.10 0.00 0.00 33.01 30.80 2e5x s GLN 29 CO -0.08 0.14 0.05 -1.17 -0.55 0.00 0.00 175.29 173.67 2e5x s LEU 30 N -1.18 0.67 -1.04 3.68 2.96 -0.40 -4.88 118.68 118.50 2e5x s LEU 30 Ca 0.46 -0.49 -0.20 0.00 -0.22 0.00 0.00 54.13 53.68 2e5x s LEU 30 Cb -0.32 -0.40 0.09 0.00 0.50 0.00 0.00 46.19 46.06 2e5x s LEU 30 CO 0.40 -0.29 1.36 -0.54 -1.32 0.00 0.00 176.35 175.97 2e5x s LYS 31 N 2.01 3.69 -0.26 1.98 1.02 -1.26 -2.79 119.74 124.13 2e5x s LYS 31 Ca 0.02 -1.61 0.03 0.00 0.02 0.00 0.00 55.97 54.42 2e5x s LYS 31 Cb -0.15 -5.19 0.06 0.00 -0.52 0.00 0.00 37.83 32.03 2e5x s LYS 31 CO -0.07 -2.01 -0.10 -1.58 -0.92 0.00 0.00 175.35 170.67 2e5x s HIS 32 N 3.69 3.28 0.28 3.18 2.46 -1.26 -5.03 115.29 121.89 2e5x s HIS 32 Ca 0.42 -2.32 -0.30 0.00 0.47 0.00 0.00 55.06 53.33 2e5x s HIS 32 Cb -0.02 -1.96 -0.11 0.00 -0.13 0.00 0.00 32.58 30.36 2e5x s HIS 32 CO -0.07 -0.88 1.60 -1.21 -2.47 0.00 0.00 174.74 171.72 2e5x s GLU 33 N 1.11 4.13 0.02 2.88 0.41 -1.26 -4.85 118.70 121.14 2e5x s GLU 33 Ca -0.08 2.56 0.00 0.00 -0.41 0.00 0.00 54.97 57.04 2e5x s GLU 33 Cb -0.20 -3.04 -0.02 0.00 -1.78 0.00 0.00 34.13 29.09 2e5x s GLU 33 CO -0.05 -0.63 -0.03 1.52 -0.49 0.00 0.00 175.26 175.58 2e5x s TYR 34 N 0.17 0.26 0.25 1.61 -0.85 -1.26 -5.09 117.35 112.44 2e5x s TYR 34 Ca 0.65 -0.50 -0.31 0.00 -0.52 0.00 0.00 57.07 56.38 2e5x s TYR 34 Cb -0.48 -0.19 -0.12 0.00 0.38 0.00 0.00 41.96 41.56 2e5x s TYR 34 CO 0.45 -0.18 1.66 -2.30 -1.52 0.00 0.00 175.55 173.66 2e5x n PRO 35 N 1.67 2.73 -4.08 -3.49 -0.02 -1.26 -5.01 135.00 125.54 2e5x n PRO 35 Ca -0.23 0.98 -0.32 0.00 -2.02 0.00 0.00 63.50 61.90 2e5x n PRO 35 Cb 0.55 -2.79 -0.15 0.00 -0.02 0.00 0.00 33.50 31.09 2e5x n PRO 35 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2e5x s GLU 36 N 0.33 2.49 0.55 -0.52 2.02 -1.26 -4.27 118.70 118.04 2e5x s GLU 36 Ca 0.70 -1.13 -0.15 0.00 0.02 0.00 0.00 54.97 54.41 2e5x s GLU 36 Cb -0.50 -2.74 -0.06 0.00 0.10 0.00 0.00 34.13 30.92 2e5x s GLU 36 CO 0.40 -0.43 1.00 0.96 0.02 0.00 0.00 175.26 177.22 2e5x s ILE 37 N 1.19 4.54 0.08 -1.63 -4.36 -1.26 -5.01 121.20 114.74 2e5x s ILE 37 Ca -0.03 1.09 -0.30 0.00 -0.26 0.00 0.00 60.65 61.14 2e5x s ILE 37 Cb -0.17 -3.74 -0.05 0.00 1.25 0.00 0.00 42.46 39.75 2e5x s ILE 37 CO -0.08 -0.82 0.99 -1.10 0.24 0.00 0.00 174.94 174.17 2e5x s GLN 38 N -4.42 4.64 0.27 0.37 -0.21 -1.26 -4.78 119.66 114.28 2e5x s GLN 38 Ca 0.58 1.48 -0.21 0.00 0.02 0.00 0.00 55.36 57.22 2e5x s GLN 38 Cb -0.11 -3.39 0.03 0.00 1.00 0.00 0.00 33.01 30.54 2e5x s GLN 38 CO 0.39 0.11 0.75 0.00 -2.12 0.00 0.00 175.29 174.42 2e5x s ALA 39 N 0.30 -1.26 -0.08 6.09 0.00 -1.26 -5.03 121.76 120.52 2e5x s ALA 39 Ca 0.49 -0.28 0.15 0.00 0.00 0.00 0.00 51.96 52.32 2e5x s ALA 39 Cb -0.23 0.82 -0.17 0.00 0.00 0.00 0.00 23.12 23.53 2e5x s ALA 39 CO 0.30 -1.04 0.80 0.93 0.00 0.00 0.00 175.76 176.74 2e5x h GLU 40 N 2.00 0.00 -5.47 0.00 4.39 -2.01 -3.46 114.58 110.02 2e5x h GLU 40 Ca -0.20 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 58.84 2e5x h GLU 40 Cb 1.25 0.00 -0.26 0.00 -0.10 0.00 0.00 28.75 29.64 2e5x h GLU 40 CO 0.24 0.41 -0.76 0.15 -1.16 0.00 0.00 179.01 177.89 2e5x s LYS 41 N -2.78 3.27 0.42 2.33 1.02 -1.26 -4.88 119.74 117.87 2e5x s LYS 41 Ca -0.03 -0.67 0.11 0.00 0.02 0.00 0.00 55.97 55.40 2e5x s LYS 41 Cb 0.08 -2.62 0.95 0.00 -0.52 0.00 0.00 37.83 35.73 2e5x s LYS 41 CO 0.82 0.28 1.99 -0.07 -0.92 0.00 0.00 175.35 177.45 2e5x h LEU 42 N 6.49 0.43 -1.01 3.17 3.38 -1.93 -1.05 115.31 124.78 2e5x h LEU 42 Ca -0.29 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.76 2e5x h LEU 42 Cb 1.20 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 2e5x h LEU 42 CO 0.55 0.28 0.65 -0.33 0.09 0.00 0.00 178.44 179.68 2e5x h GLU 43 N 0.49 1.10 -0.29 1.13 3.07 -1.94 -1.27 114.58 116.88 2e5x h GLU 43 Ca 0.26 -0.07 -0.12 0.00 -0.50 0.00 0.00 59.36 58.93 2e5x h GLU 43 Cb 0.37 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 2e5x h GLU 43 CO -0.07 0.73 -0.32 -0.44 -1.40 0.00 0.00 179.01 177.50 2e5x h ASP 44 N 1.14 0.64 -0.60 1.42 3.32 -1.61 -1.24 116.42 119.48 2e5x h ASP 44 Ca 0.45 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 2e5x h ASP 44 Cb 0.24 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2e5x h ASP 44 CO -0.19 0.92 0.16 0.58 -1.72 0.00 0.00 179.24 178.99 2e5x h VAL 45 N 0.53 1.25 -0.25 -1.35 2.07 -1.19 -2.31 116.25 115.01 2e5x h VAL 45 Ca 0.06 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 2e5x h VAL 45 Cb 0.81 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2e5x h VAL 45 CO 0.07 0.33 -0.01 0.58 0.02 0.00 0.00 177.57 178.55 2e5x h VAL 46 N 0.87 1.26 -0.38 2.57 2.07 -1.06 -1.66 116.25 119.92 2e5x h VAL 46 Ca 0.19 -0.94 0.06 0.00 0.82 0.00 0.00 66.70 66.83 2e5x h VAL 46 Cb 0.33 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.44 2e5x h VAL 46 CO -0.00 0.29 0.04 0.44 0.02 0.00 0.00 177.57 178.36 2e5x h ASP 47 N 0.21 -0.07 -0.56 0.57 3.32 -1.13 -0.85 116.42 117.90 2e5x h ASP 47 Ca 0.07 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2e5x h ASP 47 Cb 0.44 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 2e5x h ASP 47 CO 0.02 0.00 0.22 0.15 -1.72 0.00 0.00 179.24 177.91 2e5x h PHE 48 N 0.15 0.86 -0.27 4.55 3.57 -1.36 -2.19 116.94 122.26 2e5x h PHE 48 Ca 0.19 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2e5x h PHE 48 Cb 0.24 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 2e5x h PHE 48 CO -0.23 0.70 0.13 0.78 -2.23 0.00 0.00 178.31 177.46 2e5x h GLY 49 N 0.77 0.35 0.97 2.40 0.00 -0.67 -2.05 103.07 104.84 2e5x h GLY 49 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 2e5x h GLY 49 CO -0.02 0.07 0.23 -2.22 0.00 0.00 0.00 176.54 174.61 2e5x h ILE 50 N 0.27 1.18 -0.33 2.60 2.04 -1.07 -0.61 117.51 121.58 2e5x h ILE 50 Ca 0.11 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.48 2e5x h ILE 50 Cb 0.03 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2e5x h ILE 50 CO -0.08 0.19 0.22 0.28 0.00 0.00 0.00 178.15 178.77 2e5x h SER 51 N 0.59 0.38 0.26 1.72 0.02 -1.19 -1.46 113.55 113.88 2e5x h SER 51 Ca 0.16 -0.01 -0.34 0.00 -0.84 0.00 0.00 61.79 60.76 2e5x h SER 51 Cb 0.10 -0.10 0.04 0.00 0.14 0.00 0.00 62.40 62.58 2e5x h SER 51 CO -0.02 0.28 -1.50 -0.25 -1.14 0.00 0.00 176.83 174.19 2e5x h TRP 52 N 0.45 0.97 -0.03 3.45 7.01 -1.05 -3.35 115.95 123.40 2e5x h TRP 52 Ca 0.12 -0.71 -0.12 0.00 2.11 0.00 0.00 58.89 60.29 2e5x h TRP 52 Cb -0.05 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 2e5x h TRP 52 CO 0.00 1.57 -0.53 -0.07 -2.79 0.00 0.00 178.44 176.62 2e5x h LEU 53 N 0.15 0.10 -9.54 0.65 3.38 -0.75 -3.44 115.31 105.84 2e5x h LEU 53 Ca -0.26 -0.05 -0.58 0.00 0.09 0.00 0.00 57.88 57.08 2e5x h LEU 53 Cb 2.17 -0.03 0.06 0.00 0.09 0.00 0.00 40.66 42.96 2e5x h LEU 53 CO 0.27 0.61 0.77 2.29 0.09 0.00 0.00 178.44 182.48 2e5x n LYS 54 N -3.91 2.18 -0.29 1.13 2.85 -0.58 -0.64 118.16 118.89 2e5x n LYS 54 Ca -0.02 0.78 0.00 0.00 -1.05 0.00 0.00 58.31 58.03 2e5x n LYS 54 Cb 0.55 -2.53 0.00 0.00 -0.65 0.00 0.00 35.03 32.40 2e5x n LYS 54 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2e5x n GLY 55 N 3.11 1.17 0.00 2.58 0.00 -1.26 -4.85 105.19 105.94 2e5x n GLY 55 Ca 0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.20 2e5x n GLY 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e5x n LYS 56 N -2.00 2.65 -4.19 1.61 5.02 0.18 -5.05 118.16 116.39 2e5x n LYS 56 Ca 0.00 -0.03 -0.12 0.00 -2.02 0.00 0.00 58.31 56.14 2e5x n LYS 56 Cb 0.00 -0.94 -0.10 0.00 -0.02 0.00 0.00 35.03 33.97 2e5x n LYS 56 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2e5x s VAL 57 N -1.94 0.85 0.82 -0.18 -7.23 -1.20 -5.13 120.40 106.39 2e5x s VAL 57 Ca -0.00 -1.90 -0.11 0.00 -1.81 0.00 0.00 61.98 58.16 2e5x s VAL 57 Cb 0.04 -1.64 0.09 0.00 0.56 0.00 0.00 36.38 35.42 2e5x s VAL 57 CO 0.22 -0.78 1.12 -2.16 -0.31 0.00 0.00 175.10 173.19 2e5x s PRO 58 N -3.58 1.81 0.19 4.82 0.04 -1.26 -4.97 135.00 132.05 2e5x s PRO 58 Ca 0.11 1.37 0.11 0.00 0.04 0.00 0.00 61.00 62.64 2e5x s PRO 58 Cb 0.03 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.69 2e5x s PRO 58 CO -0.02 -2.01 -0.23 -1.21 0.04 0.00 0.00 177.00 173.57 2e5x s GLU 59 N -4.68 1.57 0.59 4.56 2.02 -1.26 -4.16 118.70 117.34 2e5x s GLU 59 Ca 0.65 -1.50 -0.10 0.00 0.02 0.00 0.00 54.97 54.04 2e5x s GLU 59 Cb -0.20 -1.88 -0.03 0.00 0.10 0.00 0.00 34.13 32.11 2e5x s GLU 59 CO 0.55 0.40 0.98 -1.25 0.02 0.00 0.00 175.26 175.96 2e5x s PRO 60 N -2.67 3.51 0.10 0.39 0.04 -1.26 -4.93 135.00 130.18 2e5x s PRO 60 Ca 0.21 0.58 0.02 0.00 0.04 0.00 0.00 61.00 61.85 2e5x s PRO 60 Cb -0.08 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 2e5x s PRO 60 CO 0.10 -0.53 -0.07 -0.59 0.04 0.00 0.00 177.00 175.96 2e5x s PHE 61 N -3.09 0.93 0.05 0.56 -0.12 -1.03 -1.50 117.98 113.79 2e5x s PHE 61 Ca 0.54 -0.91 0.01 0.00 -0.05 0.00 0.00 56.93 56.52 2e5x s PHE 61 Cb -0.11 -0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 41.72 2e5x s PHE 61 CO 0.52 -0.13 -0.06 0.00 -0.05 0.00 0.00 175.22 175.50 2e5x s MET 62 N -3.83 0.57 0.17 1.99 0.23 0.21 -0.77 119.30 117.87 2e5x s MET 62 Ca 0.13 -0.94 -0.00 0.00 -1.03 0.00 0.00 55.69 53.84 2e5x s MET 62 Cb 0.05 -0.10 -0.04 0.00 -1.53 0.00 0.00 34.83 33.21 2e5x s MET 62 CO -0.04 -0.01 0.07 0.96 -2.03 0.00 0.00 175.02 173.97 2e5x s ILE 63 N -2.36 0.18 -0.10 3.16 -4.36 -0.39 -0.98 121.20 116.35 2e5x s ILE 63 Ca -0.03 -1.95 -0.09 0.00 -0.26 0.00 0.00 60.65 58.32 2e5x s ILE 63 Cb -0.03 -2.23 0.03 0.00 1.25 0.00 0.00 42.46 41.47 2e5x s ILE 63 CO -0.03 -0.30 0.26 -0.70 0.24 0.00 0.00 174.94 174.41 2e5x s GLU 64 N -4.06 0.30 -0.05 0.37 -6.30 -1.26 -0.94 118.70 106.75 2e5x s GLU 64 Ca 0.29 0.37 0.02 0.00 -2.50 0.00 0.00 54.97 53.14 2e5x s GLU 64 Cb 0.07 0.14 0.02 0.00 0.00 0.00 0.00 34.13 34.36 2e5x s GLU 64 CO 0.06 -0.04 -0.07 0.34 0.02 0.00 0.00 175.26 175.57 2e5x s ASP 65 N 0.17 1.24 0.18 -1.70 2.15 -0.65 -5.00 116.67 113.06 2e5x s ASP 65 Ca -0.00 -0.19 -0.07 0.00 0.43 0.00 0.00 52.55 52.71 2e5x s ASP 65 Cb -0.02 -0.59 -0.02 0.00 -0.30 0.00 0.00 42.92 42.00 2e5x s ASP 65 CO 0.00 -0.02 0.27 -0.94 -0.17 0.00 0.00 175.17 174.31 2e5x s SER 66 N 0.81 0.07 0.16 -0.34 1.04 -1.26 -1.43 113.70 112.75 2e5x s SER 66 Ca -0.13 -0.99 -0.24 0.00 0.48 0.00 0.00 55.95 55.07 2e5x s SER 66 Cb -0.15 0.43 0.06 0.00 0.10 0.00 0.00 66.02 66.46 2e5x s SER 66 CO 0.01 -0.90 0.88 -0.83 0.98 0.00 0.00 173.24 173.38 2e5x s GLY 67 N -3.01 -0.25 -0.21 7.32 0.00 -0.84 -4.77 107.32 105.55 2e5x s GLY 67 Ca 0.22 0.15 -0.05 0.00 0.00 0.00 0.00 44.72 45.04 2e5x s GLY 67 CO 0.03 0.03 -0.01 -2.27 0.00 0.00 0.00 173.10 170.88 2e5x s LEU 68 N -2.88 3.12 -0.29 0.66 2.96 -1.26 -1.87 118.68 119.13 2e5x s LEU 68 Ca 0.11 -0.28 -0.05 0.00 -0.22 0.00 0.00 54.13 53.69 2e5x s LEU 68 Cb -0.02 -1.80 0.03 0.00 0.50 0.00 0.00 46.19 44.90 2e5x s LEU 68 CO 0.01 0.02 0.04 -0.36 -1.32 0.00 0.00 176.35 174.74 2e5x s PHE 69 N 1.25 3.17 -0.27 5.38 0.40 0.04 -0.52 117.98 127.43 2e5x s PHE 69 Ca 0.03 -1.38 -0.12 0.00 -0.60 0.00 0.00 56.93 54.87 2e5x s PHE 69 Cb -0.15 -2.19 -0.05 0.00 0.51 0.00 0.00 43.02 41.15 2e5x s PHE 69 CO 0.00 -0.69 0.21 0.42 0.70 0.00 0.00 175.22 175.87 2e5x s ILE 70 N 1.39 5.30 0.15 0.64 1.01 -0.69 -1.40 121.20 127.59 2e5x s ILE 70 Ca -0.00 0.23 -0.24 0.00 0.00 0.00 0.00 60.65 60.64 2e5x s ILE 70 Cb -0.18 -3.55 0.01 0.00 0.01 0.00 0.00 42.46 38.75 2e5x s ILE 70 CO 0.00 0.25 1.62 -0.08 0.00 0.00 0.00 174.94 176.73 2e5x h GLU 71 N 8.18 -0.30 0.00 2.79 4.81 -1.71 0.42 114.58 128.77 2e5x h GLU 71 Ca -0.35 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 2e5x h GLU 71 Cb 1.18 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2e5x h GLU 71 CO 0.58 -0.20 0.00 -1.13 -0.73 0.00 0.00 179.01 177.53 2e5x n SER 72 N -5.40 0.50 -1.29 1.04 3.41 -1.26 -1.17 113.62 109.45 2e5x n SER 72 Ca -0.01 0.66 0.08 0.00 -0.26 0.00 0.00 58.87 59.33 2e5x n SER 72 Cb 0.31 -0.75 0.31 0.00 -0.26 0.00 0.00 64.21 63.83 2e5x n SER 72 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2e5x n LEU 73 N -2.09 4.53 -3.10 1.04 4.77 -0.49 -4.96 117.00 116.70 2e5x n LEU 73 Ca 0.01 -2.83 -0.23 0.00 -0.03 0.00 0.00 56.01 52.93 2e5x n LEU 73 Cb 0.15 -0.57 0.04 0.00 -2.33 0.00 0.00 43.42 40.72 2e5x n LEU 73 CO 0.15 0.68 0.05 0.29 -1.33 0.00 0.00 177.39 177.23 2e5x n LYS 74 N 0.16 -5.49 0.00 3.23 5.02 -0.32 -2.23 118.16 118.53 2e5x n LYS 74 Ca 0.23 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 57.41 2e5x n LYS 74 Cb 0.96 -5.78 0.00 0.00 -0.02 0.00 0.00 35.03 30.19 2e5x n LYS 74 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2e5x n GLY 75 N -1.62 2.50 3.75 0.72 0.00 0.02 -4.96 105.19 105.60 2e5x n GLY 75 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 2e5x n GLY 75 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2e5x s PHE 76 N -2.48 2.43 -0.45 1.61 2.19 -0.95 -1.91 117.98 118.42 2e5x s PHE 76 Ca 0.00 1.43 0.23 0.00 0.33 0.00 0.00 56.93 58.92 2e5x s PHE 76 Cb 0.00 -3.67 0.35 0.00 -1.31 0.00 0.00 43.02 38.39 2e5x s PHE 76 CO 0.00 -2.51 1.61 -1.00 1.83 0.00 0.00 175.22 175.14 2e5x h PRO 77 N 1.52 0.00 0.00 10.12 0.13 -1.88 -1.84 132.00 140.05 2e5x h PRO 77 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2e5x h PRO 77 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2e5x h PRO 77 CO 0.58 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.76 2e5x n GLY 78 N 1.11 3.19 0.33 1.56 0.00 0.32 -1.46 105.19 110.25 2e5x n GLY 78 Ca 0.04 0.14 0.20 0.00 0.00 0.00 0.00 46.02 46.40 2e5x n GLY 78 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2e5x h VAL 79 N 0.00 0.11 -0.63 1.61 2.07 -1.87 -1.15 116.25 116.38 2e5x h VAL 79 Ca 0.00 0.00 -0.31 0.00 0.82 0.00 0.00 66.70 67.21 2e5x h VAL 79 Cb 0.00 0.92 -0.19 0.00 -1.52 0.00 0.00 31.29 30.50 2e5x h VAL 79 CO 0.00 0.00 0.23 -1.22 0.02 0.00 0.00 177.57 176.60 2e5x n TYR 80 N -3.20 1.95 -0.35 1.57 4.01 -0.53 -4.67 117.16 115.94 2e5x n TYR 80 Ca -0.02 -1.66 0.07 0.00 -0.16 0.00 0.00 57.90 56.13 2e5x n TYR 80 Cb 0.16 -0.68 0.23 0.00 -0.31 0.00 0.00 39.34 38.74 2e5x n TYR 80 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2e5x h SER 81 N 1.13 0.87 0.15 7.72 0.02 -1.26 -1.80 113.55 120.38 2e5x h SER 81 Ca 0.38 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.38 2e5x h SER 81 Cb 2.18 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 64.60 2e5x h SER 81 CO 0.69 0.46 -0.07 -1.28 -1.14 0.00 0.00 176.83 175.49 2e5x h SER 82 N 0.94 -0.17 -0.50 3.07 0.87 -1.85 -0.77 113.55 115.14 2e5x h SER 82 Ca 0.49 -0.15 0.05 0.00 -1.23 0.00 0.00 61.79 60.94 2e5x h SER 82 Cb 0.49 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.45 2e5x h SER 82 CO -0.27 0.05 0.25 0.22 -0.53 0.00 0.00 176.83 176.55 2e5x h TYR 83 N -0.40 0.45 -0.81 2.24 3.20 -1.86 -1.42 116.97 118.37 2e5x h TYR 83 Ca -0.02 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 2e5x h TYR 83 Cb 0.32 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2e5x h TYR 83 CO -0.01 0.21 0.40 0.28 -1.64 0.00 0.00 178.16 177.40 2e5x h VAL 84 N 0.48 1.25 -0.83 1.81 2.07 -1.30 -1.93 116.25 117.81 2e5x h VAL 84 Ca 0.22 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2e5x h VAL 84 Cb 0.15 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 2e5x h VAL 84 CO -0.17 0.30 0.47 0.22 0.02 0.00 0.00 177.57 178.41 2e5x h TYR 85 N 1.14 1.12 0.00 1.57 3.20 -0.52 -1.81 116.97 121.68 2e5x h TYR 85 Ca 0.28 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.13 2e5x h TYR 85 Cb 0.10 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.01 2e5x h TYR 85 CO 0.01 0.77 0.00 0.00 -1.64 0.00 0.00 178.16 177.30 2e5x h ARG 86 N 1.15 0.00 0.00 1.82 3.08 -0.84 -2.97 114.38 116.62 2e5x h ARG 86 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2e5x h ARG 86 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2e5x h ARG 86 CO -0.05 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.10 2e5x n THR 87 N -2.97 0.00 0.45 2.04 -2.24 -0.76 -4.78 114.28 106.02 2e5x n THR 87 Ca 0.02 0.37 0.12 0.00 -2.27 0.00 0.00 64.05 62.29 2e5x n THR 87 Cb 0.39 -1.36 0.19 0.00 -2.10 0.00 0.00 70.33 67.45 2e5x n THR 87 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 2e5x h ILE 88 N 0.00 0.00 -1.87 2.28 3.07 -1.57 -3.50 117.51 115.92 2e5x h ILE 88 Ca 0.00 -0.65 0.02 0.00 1.55 0.00 0.00 64.86 65.78 2e5x h ILE 88 Cb 0.00 1.37 -0.01 0.00 -0.27 0.00 0.00 36.82 37.91 2e5x h ILE 88 CO 0.00 0.00 -0.03 0.61 -1.05 0.00 0.00 178.15 177.68 2e5x n GLY 89 N 1.27 -1.10 0.24 0.16 0.00 -0.82 -1.14 105.19 103.81 2e5x n GLY 89 Ca 0.03 -1.04 0.02 0.00 0.00 0.00 0.00 46.02 45.03 2e5x n GLY 89 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2e5x h LEU 90 N 0.00 0.26 -0.95 0.99 3.38 -1.90 -2.08 115.31 115.02 2e5x h LEU 90 Ca 0.00 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2e5x h LEU 90 Cb 0.08 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 2e5x h LEU 90 CO 0.00 0.41 0.37 -0.33 0.09 0.00 0.00 178.44 178.98 2e5x h GLU 91 N 0.27 1.12 -0.29 1.13 3.07 -1.99 -1.15 114.58 116.74 2e5x h GLU 91 Ca 0.06 -0.16 -0.02 0.00 -0.50 0.00 0.00 59.36 58.74 2e5x h GLU 91 Cb 0.37 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 2e5x h GLU 91 CO 0.02 0.87 0.12 0.78 -1.40 0.00 0.00 179.01 179.40 2e5x h GLY 92 N 1.14 0.47 0.96 -3.84 0.00 -0.42 0.68 103.07 102.07 2e5x h GLY 92 Ca 0.27 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.36 2e5x h GLY 92 CO -0.03 0.24 0.13 -2.22 0.00 0.00 0.00 176.54 174.65 2e5x h ILE 93 N 0.33 1.03 -0.81 2.60 1.08 -1.23 -0.22 117.51 120.29 2e5x h ILE 93 Ca 0.10 -0.09 -0.02 0.00 -0.39 0.00 0.00 64.86 64.45 2e5x h ILE 93 Cb 0.17 0.75 -0.04 0.00 -3.07 0.00 0.00 36.82 34.63 2e5x h ILE 93 CO -0.01 0.05 0.41 -0.07 -0.69 0.00 0.00 178.15 177.84 2e5x h LEU 94 N 0.26 1.04 -0.37 1.44 3.38 -1.06 -0.39 115.31 119.61 2e5x h LEU 94 Ca 0.08 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2e5x h LEU 94 Cb -0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2e5x h LEU 94 CO -0.03 0.86 0.12 0.50 0.09 0.00 0.00 178.44 179.98 2e5x h LYS 95 N 1.15 0.57 -0.38 1.13 1.63 -0.45 -1.63 116.57 118.59 2e5x h LYS 95 Ca 0.28 -0.12 -0.03 0.00 -0.85 0.00 0.00 60.65 59.93 2e5x h LYS 95 Cb 0.08 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 2e5x h LYS 95 CO -0.04 0.58 0.09 -0.07 -3.45 0.00 0.00 179.45 176.56 2e5x h LEU 96 N 0.45 0.51 -1.00 5.20 3.38 -0.65 -2.27 115.31 120.93 2e5x h LEU 96 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2e5x h LEU 96 Cb 0.24 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2e5x h LEU 96 CO -0.00 0.51 0.00 0.23 0.09 0.00 0.00 178.44 179.27 2e5x n MET 97 N -4.34 1.64 -1.68 1.13 2.81 -0.19 -4.91 117.12 111.59 2e5x n MET 97 Ca 0.02 -0.98 -0.47 0.00 -1.81 0.00 0.00 57.70 54.46 2e5x n MET 97 Cb 0.19 -1.31 -0.04 0.00 -0.71 0.00 0.00 33.22 31.34 2e5x n MET 97 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2e5x n GLU 98 N 0.24 2.29 0.00 0.03 2.13 -0.65 -1.76 120.64 122.93 2e5x n GLU 98 Ca 0.13 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.79 2e5x n GLU 98 Cb 0.27 -2.69 0.00 0.00 0.27 0.00 0.00 31.44 29.29 2e5x n GLU 98 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2e5x n GLY 99 N 4.28 3.01 3.76 8.31 0.00 -1.26 -5.01 105.19 118.29 2e5x n GLY 99 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2e5x n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e5x s ALA 100 N -1.32 3.59 -0.20 4.61 0.00 -0.72 -4.93 121.76 122.79 2e5x s ALA 100 Ca 0.00 1.44 0.18 0.00 0.00 0.00 0.00 51.96 53.58 2e5x s ALA 100 Cb 0.00 -3.57 -0.25 0.00 0.00 0.00 0.00 23.12 19.30 2e5x s ALA 100 CO 0.00 -0.87 0.07 -1.91 0.00 0.00 0.00 175.76 173.05 2e5x n GLU 101 N 1.24 0.71 -2.85 0.00 4.07 -1.26 -4.71 120.64 117.85 2e5x n GLU 101 Ca 0.03 -0.01 -0.43 0.00 -0.06 0.00 0.00 57.16 56.69 2e5x n GLU 101 Cb 0.40 -1.52 -0.03 0.00 -0.06 0.00 0.00 31.44 30.23 2e5x n GLU 101 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2e5x s ASP 102 N -5.47 6.34 -0.26 4.31 2.15 -1.26 -4.81 116.67 117.66 2e5x s ASP 102 Ca -0.10 -1.35 0.12 0.00 0.43 0.00 0.00 52.55 51.66 2e5x s ASP 102 Cb 0.06 -2.43 0.60 0.00 -0.30 0.00 0.00 42.92 40.85 2e5x s ASP 102 CO 0.82 -1.34 1.58 0.54 -0.17 0.00 0.00 175.17 176.60 2e5x n ARG 103 N 7.49 2.93 -2.04 4.34 1.74 -1.26 -4.46 116.66 125.40 2e5x n ARG 103 Ca 0.08 -3.02 -0.37 0.00 -0.77 0.00 0.00 57.85 53.77 2e5x n ARG 103 Cb 0.47 -1.98 0.02 0.00 -1.02 0.00 0.00 32.46 29.96 2e5x n ARG 103 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2e5x s ARG 104 N -3.00 3.30 0.13 5.56 3.52 -1.26 -0.48 118.95 126.72 2e5x s ARG 104 Ca 0.48 1.92 -0.25 0.00 -0.13 0.00 0.00 55.73 57.74 2e5x s ARG 104 Cb 0.39 -2.19 0.07 0.00 -1.56 0.00 0.00 34.95 31.66 2e5x s ARG 104 CO 0.08 -0.96 0.95 0.00 -0.81 0.00 0.00 175.30 174.56 2e5x s ALA 105 N -1.50 -1.68 0.02 6.12 0.00 -0.55 -1.95 121.76 122.22 2e5x s ALA 105 Ca 0.71 0.24 -0.06 0.00 0.00 0.00 0.00 51.96 52.85 2e5x s ALA 105 Cb -0.32 0.61 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 2e5x s ALA 105 CO 0.37 -1.00 0.11 1.52 0.00 0.00 0.00 175.76 176.76 2e5x s TYR 106 N -3.26 0.12 -0.09 0.00 -0.85 -0.49 0.16 117.35 112.93 2e5x s TYR 106 Ca 0.11 -0.31 -0.02 0.00 -0.52 0.00 0.00 57.07 56.34 2e5x s TYR 106 Cb -0.01 -0.10 -0.03 0.00 0.38 0.00 0.00 41.96 42.20 2e5x s TYR 106 CO 0.01 -0.31 0.00 -0.06 -1.52 0.00 0.00 175.55 173.67 2e5x s PHE 107 N -1.83 3.15 -0.01 -3.49 0.08 -0.11 -0.78 117.98 114.99 2e5x s PHE 107 Ca -0.11 0.16 0.03 0.00 0.12 0.00 0.00 56.93 57.12 2e5x s PHE 107 Cb -0.06 -1.81 -0.01 0.00 -0.57 0.00 0.00 43.02 40.58 2e5x s PHE 107 CO -0.01 0.42 -0.10 0.21 -0.10 0.00 0.00 175.22 175.64 2e5x s LYS 108 N -0.75 0.89 -0.05 0.44 2.20 -0.78 -1.33 119.74 120.35 2e5x s LYS 108 Ca 0.12 -0.36 0.04 0.00 -0.36 0.00 0.00 55.97 55.40 2e5x s LYS 108 Cb -0.12 -0.85 -0.00 0.00 -1.51 0.00 0.00 37.83 35.36 2e5x s LYS 108 CO 0.02 0.20 -0.16 0.45 -0.36 0.00 0.00 175.35 175.50 2e5x s SER 109 N -0.14 2.07 -0.13 1.43 0.15 -0.43 -2.00 113.70 114.66 2e5x s SER 109 Ca 0.02 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2e5x s SER 109 Cb -0.05 -0.63 0.02 0.00 -1.71 0.00 0.00 66.02 63.65 2e5x s SER 109 CO -0.00 0.13 -0.11 -0.69 1.20 0.00 0.00 173.24 173.77 2e5x s VAL 110 N 0.14 1.31 -0.14 4.45 1.01 -0.52 -1.41 120.40 125.24 2e5x s VAL 110 Ca -0.06 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 2e5x s VAL 110 Cb -0.12 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2e5x s VAL 110 CO 0.02 0.41 0.04 -0.63 0.00 0.00 0.00 175.10 174.95 2e5x s ILE 111 N 1.56 4.60 -0.10 2.22 1.01 0.16 -1.63 121.20 129.02 2e5x s ILE 111 Ca 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 60.65 60.57 2e5x s ILE 111 Cb -0.13 -3.01 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 2e5x s ILE 111 CO -0.09 0.53 -0.08 -0.83 0.00 0.00 0.00 174.94 174.47 2e5x s GLY 112 N -0.23 1.64 -0.04 6.18 0.00 -0.12 -0.74 107.32 114.02 2e5x s GLY 112 Ca 0.07 -0.88 0.04 0.00 0.00 0.00 0.00 44.72 43.94 2e5x s GLY 112 CO 0.02 -0.43 -0.14 -0.12 0.00 0.00 0.00 173.10 172.42 2e5x s PHE 113 N -0.27 1.42 -0.12 1.90 5.36 0.11 -1.26 117.98 125.13 2e5x s PHE 113 Ca 0.03 -0.39 0.02 0.00 -0.96 0.00 0.00 56.93 55.62 2e5x s PHE 113 Cb -0.13 -0.97 0.02 0.00 -0.34 0.00 0.00 43.02 41.59 2e5x s PHE 113 CO 0.03 -0.14 -0.16 -0.47 -1.46 0.00 0.00 175.22 173.02 2e5x s TYR 114 N 0.11 2.05 -0.21 10.12 5.04 0.05 -0.16 117.35 134.35 2e5x s TYR 114 Ca -0.04 -1.00 -0.22 0.00 -2.44 0.00 0.00 57.07 53.38 2e5x s TYR 114 Cb -0.10 -1.48 0.06 0.00 0.35 0.00 0.00 41.96 40.79 2e5x s TYR 114 CO 0.02 -0.51 0.61 -1.50 -1.34 0.00 0.00 175.55 172.83 2e5x s ILE 115 N 1.03 0.00 -1.44 3.14 2.07 -0.52 -2.45 121.20 123.03 2e5x s ILE 115 Ca -0.05 -0.01 -0.04 0.00 -1.41 0.00 0.00 60.65 59.13 2e5x s ILE 115 Cb -0.15 -0.86 0.03 0.00 0.13 0.00 0.00 42.46 41.61 2e5x s ILE 115 CO -0.03 -0.01 0.59 0.47 -1.91 0.00 0.00 174.94 174.06 2e5x n ASP 116 N 2.58 -1.38 0.00 4.50 8.00 -1.26 -1.56 116.55 127.43 2e5x n ASP 116 Ca -0.14 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.42 2e5x n ASP 116 Cb 0.56 -3.33 0.00 0.00 -0.02 0.00 0.00 41.12 38.33 2e5x n ASP 116 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2e5x n GLY 117 N -1.79 0.41 3.22 0.44 0.00 -1.26 -5.00 105.19 101.21 2e5x n GLY 117 Ca -0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 2e5x n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e5x s LYS 118 N -0.66 1.18 -0.02 1.61 1.02 -0.60 -5.14 119.74 117.13 2e5x s LYS 118 Ca 0.00 -0.92 -0.01 0.00 0.02 0.00 0.00 55.97 55.06 2e5x s LYS 118 Cb 0.00 -1.29 -0.04 0.00 -0.52 0.00 0.00 37.83 35.99 2e5x s LYS 118 CO 0.00 0.32 0.06 0.00 -0.92 0.00 0.00 175.35 174.81 2e5x s ALA 119 N -0.89 3.52 0.02 5.17 0.00 -1.26 -1.44 121.76 126.86 2e5x s ALA 119 Ca 0.05 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.16 2e5x s ALA 119 Cb -0.09 -1.55 -0.01 0.00 0.00 0.00 0.00 23.12 21.47 2e5x s ALA 119 CO 0.02 0.67 -0.05 0.71 0.00 0.00 0.00 175.76 177.11 2e5x s TYR 120 N -1.13 0.41 0.08 0.00 2.02 0.78 -4.98 117.35 114.53 2e5x s TYR 120 Ca 0.21 -0.28 0.08 0.00 -0.37 0.00 0.00 57.07 56.71 2e5x s TYR 120 Cb -0.12 -0.26 -0.03 0.00 -0.40 0.00 0.00 41.96 41.15 2e5x s TYR 120 CO 0.11 -0.06 -0.22 0.15 -1.57 0.00 0.00 175.55 173.96 2e5x s LYS 121 N -0.79 1.32 0.00 -0.62 1.02 -1.26 0.09 119.74 119.50 2e5x s LYS 121 Ca -0.05 -1.10 0.00 0.00 0.02 0.00 0.00 55.97 54.84 2e5x s LYS 121 Cb -0.06 -1.55 -0.00 0.00 -0.52 0.00 0.00 37.83 35.70 2e5x s LYS 121 CO -0.00 0.38 -0.01 -0.06 -0.92 0.00 0.00 175.35 174.73 2e5x s PHE 122 N -0.98 0.11 0.14 3.18 0.08 0.08 -4.98 117.98 115.61 2e5x s PHE 122 Ca 0.08 -0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.02 2e5x s PHE 122 Cb -0.10 -0.07 -0.04 0.00 -0.57 0.00 0.00 43.02 42.24 2e5x s PHE 122 CO 0.03 -0.04 0.02 -1.54 -0.10 0.00 0.00 175.22 173.60 2e5x s SER 123 N -0.31 0.73 -0.11 1.36 1.04 -1.26 0.38 113.70 115.54 2e5x s SER 123 Ca -0.03 -1.18 -0.17 0.00 0.48 0.00 0.00 55.95 55.06 2e5x s SER 123 Cb -0.02 0.21 0.04 0.00 0.10 0.00 0.00 66.02 66.35 2e5x s SER 123 CO -0.00 -0.65 0.43 -0.83 0.98 0.00 0.00 173.24 173.17 2e5x s GLY 124 N -3.09 -0.31 -0.03 7.32 0.00 -0.50 -3.97 107.32 106.74 2e5x s GLY 124 Ca 0.23 1.00 0.03 0.00 0.00 0.00 0.00 44.72 45.98 2e5x s GLY 124 CO 0.02 0.80 -0.11 0.14 0.00 0.00 0.00 173.10 173.95 2e5x s VAL 125 N -0.33 0.92 -0.15 1.40 1.01 -1.26 -1.31 120.40 120.67 2e5x s VAL 125 Ca -0.05 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 2e5x s VAL 125 Cb -0.03 -0.80 0.04 0.00 0.00 0.00 0.00 36.38 35.59 2e5x s VAL 125 CO 0.02 0.28 -0.01 -0.89 0.00 0.00 0.00 175.10 174.50 2e5x s THR 126 N 0.13 0.74 0.48 3.92 2.01 -0.44 -4.79 115.64 117.69 2e5x s THR 126 Ca -0.03 -0.43 -0.14 0.00 0.31 0.00 0.00 61.69 61.40 2e5x s THR 126 Cb -0.09 -1.02 -0.07 0.00 0.01 0.00 0.00 72.50 71.33 2e5x s THR 126 CO 0.01 0.04 0.92 0.26 -0.69 0.00 0.00 174.62 175.16 2e5x s TRP 127 N 1.79 3.46 0.00 4.92 0.52 -1.26 -0.93 118.94 127.44 2e5x s TRP 127 Ca 0.01 1.32 0.00 0.00 0.02 0.00 0.00 56.10 57.46 2e5x s TRP 127 Cb -0.15 -2.68 0.00 0.00 -1.15 0.00 0.00 33.47 29.49 2e5x s TRP 127 CO -0.07 -0.29 0.00 0.41 0.02 0.00 0.00 176.95 177.02 2e5x n GLY 128 N -1.52 2.07 3.19 0.98 0.00 0.12 -1.19 105.19 108.85 2e5x n GLY 128 Ca 0.05 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 2e5x n GLY 128 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2e5x s ARG 129 N 1.78 0.67 -0.05 1.61 1.70 -0.64 -1.49 118.95 122.55 2e5x s ARG 129 Ca 0.00 -0.48 -0.28 0.00 -0.47 0.00 0.00 55.73 54.50 2e5x s ARG 129 Cb 0.00 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.64 2e5x s ARG 129 CO 0.00 -0.19 0.92 0.42 -1.08 0.00 0.00 175.30 175.36 2e5x s ILE 130 N -2.12 4.89 0.98 4.99 -1.09 0.37 -1.48 121.20 127.74 2e5x s ILE 130 Ca -0.08 1.90 -0.13 0.00 -2.23 0.00 0.00 60.65 60.10 2e5x s ILE 130 Cb -0.03 -4.25 0.18 0.00 -1.58 0.00 0.00 42.46 36.78 2e5x s ILE 130 CO -0.01 0.13 1.12 -0.94 -1.23 0.00 0.00 174.94 174.01 2e5x s SER 131 N 1.00 2.81 0.38 3.58 1.04 -0.50 -4.88 113.70 117.12 2e5x s SER 131 Ca 0.47 1.00 0.23 0.00 0.48 0.00 0.00 55.95 58.13 2e5x s SER 131 Cb -0.19 -1.57 0.29 0.00 0.10 0.00 0.00 66.02 64.65 2e5x s SER 131 CO 0.23 -2.99 1.50 0.78 0.98 0.00 0.00 173.24 173.73 2e5x h ASN 132 N -1.80 0.00 -5.13 7.02 4.21 -1.96 -3.47 115.58 114.44 2e5x h ASN 132 Ca -0.52 -0.00 -0.04 0.00 1.21 0.00 0.00 56.30 56.95 2e5x h ASN 132 Cb 1.33 0.00 -0.10 0.00 -1.12 0.00 0.00 38.32 38.42 2e5x h ASN 132 CO 0.57 0.00 -0.04 -1.83 -1.29 0.00 0.00 177.43 174.84 2e5x s GLU 133 N -3.24 1.37 0.34 0.81 1.03 -1.26 -5.06 118.70 112.69 2e5x s GLU 133 Ca 0.06 -0.96 -0.28 0.00 0.03 0.00 0.00 54.97 53.82 2e5x s GLU 133 Cb 0.06 0.49 -0.10 0.00 -0.80 0.00 0.00 34.13 33.78 2e5x s GLU 133 CO 0.69 -0.57 1.32 0.15 -1.33 0.00 0.00 175.26 175.53 2e5x s LYS 134 N -3.90 4.29 -0.14 -4.83 1.02 -1.26 -4.71 119.74 110.21 2e5x s LYS 134 Ca 0.12 2.25 -0.06 0.00 0.02 0.00 0.00 55.97 58.29 2e5x s LYS 134 Cb -0.00 -3.03 0.06 0.00 -0.52 0.00 0.00 37.83 34.34 2e5x s LYS 134 CO -0.01 -0.25 0.31 1.03 -0.92 0.00 0.00 175.35 175.51 2e5x s ARG 135 N -1.87 0.24 0.00 1.68 0.52 -0.15 -5.02 118.95 114.36 2e5x s ARG 135 Ca 0.50 0.73 0.00 0.00 -0.52 0.00 0.00 55.73 56.44 2e5x s ARG 135 Cb -0.40 -0.00 0.00 0.00 0.52 0.00 0.00 34.95 35.06 2e5x s ARG 135 CO 0.54 -0.21 0.00 0.41 0.02 0.00 0.00 175.30 176.05 2e5x n GLY 136 N 4.78 1.30 0.00 -3.53 0.00 -1.26 -4.25 105.19 102.23 2e5x n GLY 136 Ca -0.16 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.10 2e5x n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2e5x n THR 137 N 1.28 0.31 -2.28 2.61 -2.24 -1.06 -4.78 114.28 108.12 2e5x n THR 137 Ca 0.00 -0.49 -0.25 0.00 -2.27 0.00 0.00 64.05 61.04 2e5x n THR 137 Cb 0.00 1.02 0.08 0.00 -2.10 0.00 0.00 70.33 69.33 2e5x n THR 137 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2e5x s HIS 138 N -0.31 2.59 0.00 4.78 3.76 -0.17 -4.94 115.29 121.00 2e5x s HIS 138 Ca 0.00 0.27 0.00 0.00 -0.15 0.00 0.00 55.06 55.18 2e5x s HIS 138 Cb 0.00 -3.21 0.00 0.00 1.11 0.00 0.00 32.58 30.48 2e5x s HIS 138 CO 0.00 -1.51 0.00 0.41 -0.85 0.00 0.00 174.74 172.79 2e5x n GLY 139 N -2.93 0.64 3.79 -2.22 0.00 -1.26 -4.35 105.19 98.86 2e5x n GLY 139 Ca 0.10 -0.80 -0.09 0.00 0.00 0.00 0.00 46.02 45.23 2e5x n GLY 139 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2e5x s PHE 140 N 0.00 0.09 0.00 1.61 -0.12 -1.26 -5.03 117.98 113.27 2e5x s PHE 140 Ca 0.00 -0.63 0.00 0.00 -0.05 0.00 0.00 56.93 56.25 2e5x s PHE 140 Cb 0.00 0.69 0.00 0.00 -0.63 0.00 0.00 43.02 43.08 2e5x s PHE 140 CO 0.00 -1.38 0.00 0.41 -0.05 0.00 0.00 175.22 174.20 2e5x n GLY 141 N -0.50 3.15 0.00 1.99 0.00 -1.26 -1.58 105.19 106.99 2e5x n GLY 141 Ca -0.06 0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.16 2e5x n GLY 141 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2e5x n TYR 142 N 14.00 0.00 -0.34 1.61 4.01 -1.26 -4.27 117.16 130.91 2e5x n TYR 142 Ca 0.00 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 57.90 2e5x n TYR 142 Cb 0.00 0.00 0.37 0.00 -0.31 0.00 0.00 39.34 39.40 2e5x n TYR 142 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2e5x h ASP 143 N 0.00 0.69 0.21 7.72 3.32 -1.65 -1.06 116.42 125.65 2e5x h ASP 143 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2e5x h ASP 143 Cb 0.00 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2e5x h ASP 143 CO 0.00 0.17 0.00 -0.65 -1.72 0.00 0.00 179.24 177.04 2e5x h PRO 144 N 0.63 0.00 0.00 3.56 0.11 -1.76 -2.32 132.00 132.22 2e5x h PRO 144 Ca 0.61 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.72 2e5x h PRO 144 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2e5x h PRO 144 CO -0.42 0.00 -0.03 0.44 -0.21 0.00 0.00 178.00 177.78 2e5x n ILE 145 N -2.70 1.30 -4.54 4.15 -5.35 -0.42 -0.98 119.36 110.82 2e5x n ILE 145 Ca -0.01 -1.48 -0.33 0.00 -0.27 0.00 0.00 62.75 60.66 2e5x n ILE 145 Cb 0.11 0.17 -0.16 0.00 -1.74 0.00 0.00 39.64 38.02 2e5x n ILE 145 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 2e5x s PHE 146 N -1.77 2.74 -0.31 4.28 5.36 -1.13 -1.41 117.98 125.74 2e5x s PHE 146 Ca 0.15 -1.21 -0.02 0.00 -0.96 0.00 0.00 56.93 54.89 2e5x s PHE 146 Cb 0.13 -1.87 0.05 0.00 -0.34 0.00 0.00 43.02 41.00 2e5x s PHE 146 CO 0.01 -0.56 0.01 0.42 -1.46 0.00 0.00 175.22 173.65 2e5x s ILE 147 N 0.87 3.09 0.56 3.12 1.01 -0.55 -1.30 121.20 128.00 2e5x s ILE 147 Ca -0.05 -1.35 -0.21 0.00 0.00 0.00 0.00 60.65 59.04 2e5x s ILE 147 Cb -0.15 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 2e5x s ILE 147 CO -0.02 -0.12 1.29 -2.16 0.00 0.00 0.00 174.94 173.93 2e5x s PRO 148 N 1.27 3.10 0.30 2.79 0.04 -1.26 -1.62 135.00 139.62 2e5x s PRO 148 Ca -0.05 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.75 2e5x s PRO 148 Cb -0.20 -2.14 -0.12 0.00 0.04 0.00 0.00 34.50 32.08 2e5x s PRO 148 CO -0.01 -1.17 1.41 -1.91 0.04 0.00 0.00 177.00 175.37 2e5x n GLU 149 N -1.22 2.27 -0.73 4.56 4.07 -0.33 -1.97 120.64 127.29 2e5x n GLU 149 Ca 0.12 0.80 0.00 0.00 -0.06 0.00 0.00 57.16 58.02 2e5x n GLU 149 Cb 0.47 -2.46 0.00 0.00 -0.06 0.00 0.00 31.44 29.38 2e5x n GLU 149 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2e5x n GLY 150 N 1.49 0.63 3.12 8.31 0.00 -1.26 -5.02 105.19 112.46 2e5x n GLY 150 Ca 0.07 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2e5x n GLY 150 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2e5x s SER 151 N -2.01 1.07 -0.05 1.61 0.15 -0.83 -5.04 113.70 108.60 2e5x s SER 151 Ca 0.00 -0.73 0.20 0.00 0.70 0.00 0.00 55.95 56.13 2e5x s SER 151 Cb 0.00 0.04 -0.26 0.00 -1.71 0.00 0.00 66.02 64.09 2e5x s SER 151 CO 0.00 -0.28 0.45 0.00 1.20 0.00 0.00 173.24 174.61 2e5x n GLN 152 N 0.87 0.66 -3.42 5.44 1.13 -1.26 -4.74 117.38 116.05 2e5x n GLN 152 Ca -0.19 -0.07 -0.33 0.00 -1.94 0.00 0.00 57.00 54.47 2e5x n GLN 152 Cb 0.57 -1.58 -0.05 0.00 0.11 0.00 0.00 30.24 29.28 2e5x n GLN 152 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2e5x s LYS 153 N -3.15 3.84 0.74 -1.09 1.02 -1.26 -5.02 119.74 114.81 2e5x s LYS 153 Ca -0.07 0.31 -0.12 0.00 0.02 0.00 0.00 55.97 56.11 2e5x s LYS 153 Cb 0.11 -2.76 0.03 0.00 -0.52 0.00 0.00 37.83 34.69 2e5x s LYS 153 CO 0.87 0.39 1.11 0.95 -0.92 0.00 0.00 175.35 177.74 2e5x s THR 154 N -1.68 3.19 0.49 2.17 -4.23 -1.26 -4.27 115.64 110.05 2e5x s THR 154 Ca 0.43 0.39 0.16 0.00 -1.18 0.00 0.00 61.69 61.49 2e5x s THR 154 Cb -0.12 -3.34 0.31 0.00 1.34 0.00 0.00 72.50 70.68 2e5x s THR 154 CO 0.20 -0.50 2.07 -0.26 -0.54 0.00 0.00 174.62 175.59 2e5x h PHE 155 N -0.79 0.15 0.00 3.99 0.04 -0.97 -0.63 116.94 118.74 2e5x h PHE 155 Ca -0.45 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.32 2e5x h PHE 155 Cb 1.27 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 39.37 2e5x h PHE 155 CO 0.47 0.09 0.00 0.00 -0.60 0.00 0.00 178.31 178.26 2e5x n ALA 156 N -2.55 1.61 -0.40 2.45 0.00 -0.89 -2.15 120.51 118.58 2e5x n ALA 156 Ca 0.03 0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.67 2e5x n ALA 156 Cb 0.24 -1.37 0.33 0.00 0.00 0.00 0.00 19.45 18.66 2e5x n ALA 156 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2e5x n GLU 157 N -2.18 2.83 -4.34 0.00 1.02 -0.24 -1.00 120.64 116.72 2e5x n GLU 157 Ca 0.02 -2.71 -0.24 0.00 -0.02 0.00 0.00 57.16 54.22 2e5x n GLU 157 Cb 0.21 -1.61 -0.08 0.00 -0.02 0.00 0.00 31.44 29.94 2e5x n GLU 157 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2e5x s MET 158 N -1.08 2.10 0.69 3.49 -1.94 -0.91 -4.92 119.30 116.72 2e5x s MET 158 Ca 0.50 -1.58 -0.09 0.00 -1.71 0.00 0.00 55.69 52.81 2e5x s MET 158 Cb 0.27 -2.02 0.03 0.00 2.01 0.00 0.00 34.83 35.12 2e5x s MET 158 CO 0.33 0.30 1.04 0.95 -0.01 0.00 0.00 175.02 177.63 2e5x s THR 159 N -2.41 3.09 0.24 2.05 -4.23 -1.26 -4.69 115.64 108.43 2e5x s THR 159 Ca 0.32 0.14 -0.05 0.00 -1.18 0.00 0.00 61.69 60.92 2e5x s THR 159 Cb -0.05 -3.31 0.21 0.00 1.34 0.00 0.00 72.50 70.69 2e5x s THR 159 CO 0.19 -0.37 1.81 0.40 -0.54 0.00 0.00 174.62 176.11 2e5x h ILE 160 N -0.57 0.92 -0.45 2.99 2.04 -1.99 -0.88 117.51 119.57 2e5x h ILE 160 Ca -0.45 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 2e5x h ILE 160 Cb 1.28 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2e5x h ILE 160 CO 0.63 0.15 0.28 -0.33 0.00 0.00 0.00 178.15 178.87 2e5x h GLU 161 N 0.80 0.60 -0.41 2.37 3.07 -1.99 -0.58 114.58 118.44 2e5x h GLU 161 Ca 0.39 -0.05 -0.09 0.00 -0.50 0.00 0.00 59.36 59.11 2e5x h GLU 161 Cb 0.33 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 2e5x h GLU 161 CO -0.24 0.43 -0.11 0.93 -1.40 0.00 0.00 179.01 178.63 2e5x h GLU 162 N 0.60 0.73 -0.15 2.33 5.08 -1.77 -2.57 114.58 118.81 2e5x h GLU 162 Ca 0.16 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2e5x h GLU 162 Cb -0.02 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 2e5x h GLU 162 CO -0.03 0.81 -0.09 -0.22 -1.00 0.00 0.00 179.01 178.47 2e5x h LYS 163 N 0.66 0.34 -0.27 2.33 3.64 -0.89 -3.04 116.57 119.33 2e5x h LYS 163 Ca 0.11 -0.16 0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2e5x h LYS 163 Cb 0.57 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2e5x h LYS 163 CO 0.04 0.67 0.18 -0.91 -2.27 0.00 0.00 179.45 177.16 2e5x h ASN 164 N -0.00 0.15 1.14 4.20 2.35 -1.03 0.49 115.58 122.88 2e5x h ASN 164 Ca 0.03 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2e5x h ASN 164 Cb 0.58 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2e5x h ASN 164 CO 0.03 0.10 0.00 0.00 -1.65 0.00 0.00 177.43 175.91 2e5x h ALA 165 N 1.85 1.00 0.00 -0.83 0.00 -1.35 -3.35 119.26 116.59 2e5x h ALA 165 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2e5x h ALA 165 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2e5x h ALA 165 CO -0.02 0.00 -0.86 1.28 0.00 0.00 0.00 179.25 179.65 2e5x n LEU 166 N -2.96 0.00 -4.79 0.00 4.77 -0.43 -4.98 117.00 108.62 2e5x n LEU 166 Ca 0.01 -0.02 -0.29 0.00 -0.03 0.00 0.00 56.01 55.68 2e5x n LEU 166 Cb 0.33 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.53 2e5x n LEU 166 CO 0.27 0.00 0.71 -0.94 -1.33 0.00 0.00 177.39 176.10 2e5x s SER 167 N -1.77 4.06 0.19 -1.43 1.04 0.16 -4.85 113.70 111.10 2e5x s SER 167 Ca 0.00 1.19 -0.09 0.00 0.48 0.00 0.00 55.95 57.53 2e5x s SER 167 Cb 0.00 -1.86 0.11 0.00 0.10 0.00 0.00 66.02 64.37 2e5x s SER 167 CO 0.00 -2.23 1.73 1.12 0.98 0.00 0.00 173.24 174.84 2e5x h HIS 168 N -1.27 1.13 -0.60 5.02 2.07 -1.84 -2.12 115.15 117.54 2e5x h HIS 168 Ca -0.49 -0.11 -0.09 0.00 -2.85 0.00 0.00 60.37 56.83 2e5x h HIS 168 Cb 1.29 -0.33 -0.02 0.00 2.57 0.00 0.00 27.41 30.93 2e5x h HIS 168 CO 0.40 0.90 0.02 -0.09 -3.07 0.00 0.00 177.93 176.08 2e5x h ARG 169 N 1.02 1.03 -0.80 5.12 2.43 -1.91 -1.46 114.38 119.81 2e5x h ARG 169 Ca 0.22 -0.31 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 2e5x h ARG 169 Cb 0.30 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 2e5x h ARG 169 CO -0.01 1.00 0.39 0.78 -1.51 0.00 0.00 179.97 180.63 2e5x h GLY 170 N 1.00 1.23 1.07 2.80 0.00 -1.62 0.32 103.07 107.87 2e5x h GLY 170 Ca 0.17 -0.59 -0.14 0.00 0.00 0.00 0.00 47.33 46.77 2e5x h GLY 170 CO 0.03 0.57 -0.29 0.50 0.00 0.00 0.00 176.54 177.34 2e5x h LYS 171 N 1.14 0.88 -0.72 4.80 1.57 -1.12 -0.55 116.57 122.57 2e5x h LYS 171 Ca 0.28 -0.43 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 2e5x h LYS 171 Cb 0.10 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 2e5x h LYS 171 CO -0.04 1.08 0.25 0.00 -0.57 0.00 0.00 179.45 180.17 2e5x h ALA 172 N 0.79 0.94 -0.50 3.86 0.00 -0.93 -1.70 119.26 121.71 2e5x h ALA 172 Ca 0.07 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2e5x h ALA 172 Cb 0.87 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2e5x h ALA 172 CO 0.08 0.61 -0.04 -0.07 0.00 0.00 0.00 179.25 179.83 2e5x h LEU 173 N 1.06 0.85 -0.45 0.00 3.38 -0.78 -0.36 115.31 119.00 2e5x h LEU 173 Ca 0.24 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2e5x h LEU 173 Cb 0.27 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2e5x h LEU 173 CO -0.01 0.94 0.21 0.50 0.09 0.00 0.00 178.44 180.17 2e5x h LYS 174 N 0.80 0.66 -0.64 1.13 3.64 -0.64 0.23 116.57 121.74 2e5x h LYS 174 Ca 0.15 -0.10 -0.07 0.00 -1.27 0.00 0.00 60.65 59.36 2e5x h LYS 174 Cb 0.53 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 2e5x h LYS 174 CO 0.03 0.56 0.15 0.00 -2.27 0.00 0.00 179.45 177.92 2e5x h ALA 175 N 1.06 0.85 -0.37 5.00 0.00 -1.10 -1.17 119.26 123.53 2e5x h ALA 175 Ca 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2e5x h ALA 175 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2e5x h ALA 175 CO -0.02 0.57 0.17 0.35 0.00 0.00 0.00 179.25 180.32 2e5x h PHE 176 N 0.95 0.53 -0.63 0.00 3.57 -0.65 -1.99 116.94 118.73 2e5x h PHE 176 Ca 0.20 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 2e5x h PHE 176 Cb 0.37 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 2e5x h PHE 176 CO 0.03 0.46 0.06 0.35 -2.23 0.00 0.00 178.31 176.97 2e5x h PHE 177 N 0.45 1.13 -0.48 0.41 3.57 -0.35 -1.46 116.94 120.22 2e5x h PHE 177 Ca 0.13 -0.17 -0.04 0.00 3.53 0.00 0.00 57.97 61.42 2e5x h PHE 177 Cb 0.13 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 2e5x h PHE 177 CO -0.01 0.97 0.12 0.93 -2.23 0.00 0.00 178.31 178.09 2e5x h GLU 178 N 0.98 0.71 -0.37 1.11 4.39 -1.08 -1.21 114.58 119.11 2e5x h GLU 178 Ca 0.19 -0.13 -0.13 0.00 0.34 0.00 0.00 59.36 59.62 2e5x h GLU 178 Cb 0.48 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2e5x h GLU 178 CO 0.02 0.64 -0.30 2.35 -1.16 0.00 0.00 179.01 180.56 2e5x h TRP 179 N 0.70 0.94 -0.49 4.33 7.01 -0.96 -3.04 115.95 124.43 2e5x h TRP 179 Ca 0.16 -0.25 -0.06 0.00 2.11 0.00 0.00 58.89 60.85 2e5x h TRP 179 Cb 0.25 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.08 2e5x h TRP 179 CO 0.01 1.01 0.06 -0.07 -2.79 0.00 0.00 178.44 176.66 2e5x h LEU 180 N 0.68 0.79 -0.85 0.65 3.38 -0.66 -1.82 115.31 117.48 2e5x h LEU 180 Ca 0.08 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.86 2e5x h LEU 180 Cb 0.85 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.32 2e5x h LEU 180 CO 0.07 0.87 0.51 0.11 0.09 0.00 0.00 178.44 180.09 2e5x h LYS 181 N 0.70 0.86 -0.00 1.13 1.57 -1.15 0.30 116.57 119.97 2e5x h LYS 181 Ca 0.15 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2e5x h LYS 181 Cb 0.42 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2e5x h LYS 181 CO 0.01 0.57 -0.42 0.28 -0.57 0.00 0.00 179.45 179.33 2e5x n VAL 182 N -4.68 0.00 0.00 0.50 0.31 -1.16 -4.35 118.33 108.96 2e5x n VAL 182 Ca 0.13 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 2e5x n VAL 182 Cb 0.23 0.35 0.00 0.00 -0.91 0.00 0.00 33.84 33.51 2e5x n VAL 182 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2e5x n ASN 183 N -1.13 1.07 -2.89 4.52 3.02 -0.69 -4.86 115.26 114.29 2e5x n ASN 183 Ca 0.08 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.28 2e5x n ASN 183 Cb 0.34 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.53 2e5x n ASN 183 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2e5x n LEU 184 N -2.77 6.38 0.00 3.41 4.77 0.10 -5.05 117.00 123.83 2e5x n LEU 184 Ca 0.00 -5.11 0.00 0.00 -0.03 0.00 0.00 56.01 50.87 2e5x n LEU 184 Cb 0.44 -0.85 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 2e5x n LEU 184 CO 0.00 2.00 0.16 0.29 -1.33 0.00 0.00 177.39 178.52