#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m1g n VAL 6 N 0.00 -3.02 -1.11 1.69 0.31 -1.26 -4.49 118.33 110.44 1m1g n VAL 6 Ca 0.00 0.25 -0.32 0.00 -0.01 0.00 0.00 64.34 64.26 1m1g n VAL 6 Cb 0.00 -3.26 -0.11 0.00 -0.91 0.00 0.00 33.84 29.57 1m1g n VAL 6 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1m1g n GLN 7 N 0.44 0.33 0.00 5.55 7.27 -1.26 -4.85 117.38 124.87 1m1g n GLN 7 Ca -0.05 -1.49 0.00 0.00 0.07 0.00 0.00 57.00 55.53 1m1g n GLN 7 Cb 0.60 -3.20 0.00 0.00 2.41 0.00 0.00 30.24 30.05 1m1g n GLN 7 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1m1g n GLU 8 N 7.98 1.11 -2.74 3.69 1.02 -1.26 -4.80 120.64 125.63 1m1g n GLU 8 Ca 0.45 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.56 1m1g n GLU 8 Cb 0.44 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.84 1m1g n GLU 8 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1m1g n LEU 9 N 0.00 -6.48 -4.84 -4.62 4.77 -1.26 -4.97 117.00 99.59 1m1g n LEU 9 Ca 0.00 1.73 -0.34 0.00 -0.03 0.00 0.00 56.01 57.38 1m1g n LEU 9 Cb 0.00 -3.01 -0.06 0.00 -2.33 0.00 0.00 43.42 38.02 1m1g n LEU 9 CO 0.00 -3.46 0.39 -1.83 -1.33 0.00 0.00 177.39 171.16 1m1g s GLU 10 N -0.97 4.06 0.08 3.23 -1.05 -1.26 -5.04 118.70 117.74 1m1g s GLU 10 Ca -0.14 0.68 -0.00 0.00 -0.15 0.00 0.00 54.97 55.36 1m1g s GLU 10 Cb 0.01 -2.62 -0.04 0.00 -0.44 0.00 0.00 34.13 31.04 1m1g s GLU 10 CO 0.65 0.26 0.24 0.15 0.95 0.00 0.00 175.26 177.51 1m1g s LYS 11 N -2.60 3.46 0.25 -4.83 1.02 -1.26 -4.65 119.74 111.13 1m1g s LYS 11 Ca 0.49 -0.41 0.11 0.00 0.02 0.00 0.00 55.97 56.18 1m1g s LYS 11 Cb -0.12 -3.01 -0.05 0.00 -0.52 0.00 0.00 37.83 34.13 1m1g s LYS 11 CO 0.19 0.58 -0.19 0.15 -0.92 0.00 0.00 175.35 175.16 1m1g s LYS 12 N -2.60 1.57 0.21 1.68 1.02 0.12 -4.74 119.74 117.00 1m1g s LYS 12 Ca 0.36 -1.69 -0.26 0.00 0.02 0.00 0.00 55.97 54.40 1m1g s LYS 12 Cb -0.13 -1.60 -0.08 0.00 -0.52 0.00 0.00 37.83 35.50 1m1g s LYS 12 CO 0.28 0.30 0.83 -1.58 -0.92 0.00 0.00 175.35 174.25 1m1g s TRP 13 N -2.54 3.87 -0.00 3.18 0.52 -1.25 -0.80 118.94 121.92 1m1g s TRP 13 Ca 0.27 1.69 -0.03 0.00 0.02 0.00 0.00 56.10 58.05 1m1g s TRP 13 Cb -0.04 -2.82 -0.00 0.00 -1.15 0.00 0.00 33.47 29.45 1m1g s TRP 13 CO 0.12 0.45 0.05 0.71 0.02 0.00 0.00 176.95 178.30 1m1g s TYR 14 N -1.26 0.08 -0.11 -1.98 1.51 0.54 -0.04 117.35 116.09 1m1g s TYR 14 Ca 0.40 -0.16 -0.13 0.00 -1.01 0.00 0.00 57.07 56.17 1m1g s TYR 14 Cb -0.22 -0.07 -0.05 0.00 -0.11 0.00 0.00 41.96 41.51 1m1g s TYR 14 CO 0.27 -0.16 0.30 0.00 -1.11 0.00 0.00 175.55 174.85 1m1g s ALA 15 N -0.90 3.66 -0.18 3.71 0.00 -1.26 -1.15 121.76 125.63 1m1g s ALA 15 Ca -0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 51.42 1m1g s ALA 15 Cb -0.06 -2.34 -0.01 0.00 0.00 0.00 0.00 23.12 20.71 1m1g s ALA 15 CO 0.00 0.27 -0.07 -0.51 0.00 0.00 0.00 175.76 175.45 1m1g s LEU 16 N -0.14 2.92 -0.21 0.00 1.43 1.00 0.37 118.68 124.05 1m1g s LEU 16 Ca 0.18 -0.31 -0.29 0.00 -1.03 0.00 0.00 54.13 52.69 1m1g s LEU 16 Cb -0.14 -1.71 0.01 0.00 0.03 0.00 0.00 46.19 44.38 1m1g s LEU 16 CO 0.06 0.09 1.01 -1.58 0.23 0.00 0.00 176.35 176.16 1m1g s GLN 17 N 0.84 4.28 0.32 1.70 2.00 -0.68 -1.82 119.66 126.29 1m1g s GLN 17 Ca -0.02 1.32 0.05 0.00 -2.00 0.00 0.00 55.36 54.71 1m1g s GLN 17 Cb -0.15 -3.62 -0.06 0.00 0.80 0.00 0.00 33.01 29.97 1m1g s GLN 17 CO 0.01 -0.57 0.02 0.14 -0.50 0.00 0.00 175.29 174.39 1m1g s VAL 18 N 2.98 1.37 -0.16 1.34 -7.23 -0.72 -0.48 120.40 117.50 1m1g s VAL 18 Ca 0.44 -2.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.27 1m1g s VAL 18 Cb -0.16 -2.71 -0.08 0.00 0.56 0.00 0.00 36.38 34.00 1m1g s VAL 18 CO 0.08 -0.09 2.12 1.21 -0.31 0.00 0.00 175.10 178.10 1m1g n GLU 19 N -0.68 2.07 -1.82 4.82 4.07 0.11 -4.45 120.64 124.76 1m1g n GLU 19 Ca -0.03 0.65 -0.42 0.00 -0.06 0.00 0.00 57.16 57.30 1m1g n GLU 19 Cb 0.66 -2.99 -0.03 0.00 -0.06 0.00 0.00 31.44 29.02 1m1g n GLU 19 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1m1g s PRO 20 N 5.59 4.17 0.00 5.31 0.04 -1.26 -1.89 135.00 146.95 1m1g s PRO 20 Ca 0.98 2.46 0.00 0.00 0.04 0.00 0.00 61.00 64.48 1m1g s PRO 20 Cb -0.49 -3.72 0.00 0.00 0.04 0.00 0.00 34.50 30.33 1m1g s PRO 20 CO 0.41 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 177.04 1m1g n GLY 21 N 4.18 1.38 2.45 0.56 0.00 -1.26 -4.94 105.19 107.57 1m1g n GLY 21 Ca 0.17 -0.29 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 1m1g n GLY 21 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1m1g n LYS 22 N 0.00 2.38 0.05 1.61 2.85 -0.79 -4.85 118.16 119.41 1m1g n LYS 22 Ca 0.00 -4.51 -0.22 0.00 -1.05 0.00 0.00 58.31 52.53 1m1g n LYS 22 Cb 0.00 -2.13 -0.15 0.00 -0.65 0.00 0.00 35.03 32.11 1m1g n LYS 22 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1m1g h GLU 23 N 3.99 0.32 -0.32 -1.58 3.07 -1.93 -3.21 114.58 114.92 1m1g h GLU 23 Ca 0.18 -0.55 -0.09 0.00 -0.50 0.00 0.00 59.36 58.40 1m1g h GLU 23 Cb 0.67 0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.77 1m1g h GLU 23 CO 0.79 1.26 -0.16 -0.91 -1.40 0.00 0.00 179.01 178.59 1m1g h ASN 24 N -0.21 0.56 -0.38 1.42 4.21 -1.95 -1.68 115.58 117.56 1m1g h ASN 24 Ca -0.25 -0.17 -0.10 0.00 1.21 0.00 0.00 56.30 56.99 1m1g h ASN 24 Cb 1.82 -0.15 -0.02 0.00 -1.12 0.00 0.00 38.32 38.86 1m1g h ASN 24 CO 0.13 0.74 -0.13 -0.33 -1.29 0.00 0.00 177.43 176.56 1m1g h GLU 25 N 0.52 0.83 -0.58 0.81 5.08 -1.95 -1.84 114.58 117.45 1m1g h GLU 25 Ca 0.09 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1m1g h GLU 25 Cb 0.58 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1m1g h GLU 25 CO 0.04 0.91 0.19 0.00 -1.00 0.00 0.00 179.01 179.15 1m1g h ALA 26 N 1.11 0.76 -0.48 3.43 0.00 -1.45 0.22 119.26 122.84 1m1g h ALA 26 Ca 0.12 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1m1g h ALA 26 Cb 0.63 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1m1g h ALA 26 CO 0.04 0.41 -0.12 -0.22 0.00 0.00 0.00 179.25 179.37 1m1g h LYS 27 N 0.81 0.90 -0.32 0.00 3.64 -1.16 0.14 116.57 120.57 1m1g h LYS 27 Ca 0.19 -0.32 -0.16 0.00 -1.27 0.00 0.00 60.65 59.09 1m1g h LYS 27 Cb 0.27 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1m1g h LYS 27 CO -0.01 0.96 -0.41 0.93 -2.27 0.00 0.00 179.45 178.66 1m1g h GLU 28 N 0.80 0.85 0.00 1.90 4.39 -1.04 0.23 114.58 121.71 1m1g h GLU 28 Ca 0.13 -0.48 -0.07 0.00 0.34 0.00 0.00 59.36 59.28 1m1g h GLU 28 Cb 0.64 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 1m1g h GLU 28 CO 0.04 1.12 -0.31 -0.91 -1.16 0.00 0.00 179.01 177.79 1m1g h ASN 29 N 0.63 0.00 0.07 1.42 2.35 -0.47 -1.94 115.58 117.64 1m1g h ASN 29 Ca 0.04 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1m1g h ASN 29 Cb 1.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.37 1m1g h ASN 29 CO 0.10 0.31 -0.03 0.25 -1.65 0.00 0.00 177.43 176.41 1m1g h LEU 30 N 0.00 -0.08 -0.84 1.61 5.85 -0.38 -2.51 115.31 118.96 1m1g h LEU 30 Ca -0.00 -0.49 0.07 0.00 0.84 0.00 0.00 57.88 58.30 1m1g h LEU 30 Cb 0.82 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.81 1m1g h LEU 30 CO 0.04 0.48 0.51 -0.07 -0.34 0.00 0.00 178.44 179.06 1m1g h LEU 31 N -0.67 0.77 -1.00 2.25 3.38 -0.85 -1.39 115.31 117.79 1m1g h LEU 31 Ca -0.01 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1m1g h LEU 31 Cb 0.56 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1m1g h LEU 31 CO 0.02 0.47 0.15 0.11 0.09 0.00 0.00 178.44 179.27 1m1g h LYS 32 N 0.89 0.87 -0.45 1.13 6.56 -1.38 -2.06 116.57 122.13 1m1g h LYS 32 Ca 0.38 -0.18 -0.09 0.00 -1.06 0.00 0.00 60.65 59.71 1m1g h LYS 32 Cb 0.25 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 31.76 1m1g h LYS 32 CO -0.20 0.77 -0.07 0.28 -2.06 0.00 0.00 179.45 178.17 1m1g h VAL 33 N 0.84 1.27 -0.90 0.50 2.07 -0.85 -1.79 116.25 117.39 1m1g h VAL 33 Ca 0.18 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.58 1m1g h VAL 33 Cb 0.29 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 31.11 1m1g h VAL 33 CO -0.00 0.40 0.57 -0.07 0.02 0.00 0.00 177.57 178.49 1m1g h LEU 34 N 0.68 0.94 0.76 2.57 3.38 -1.05 0.52 115.31 123.11 1m1g h LEU 34 Ca 0.12 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1m1g h LEU 34 Cb 0.60 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1m1g h LEU 34 CO 0.04 0.63 -0.40 -0.08 0.09 0.00 0.00 178.44 178.72 1m1g h GLU 35 N 1.09 -1.03 -0.63 1.13 4.57 -1.16 0.12 114.58 118.68 1m1g h GLU 35 Ca 0.37 0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.59 1m1g h GLU 35 Cb 0.06 0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 28.85 1m1g h GLU 35 CO -0.14 -0.68 0.30 -0.07 -1.18 0.00 0.00 179.01 177.24 1m1g h LEU 36 N -1.07 0.82 -1.15 1.64 -0.00 -1.14 -2.62 115.31 111.80 1m1g h LEU 36 Ca -0.10 -0.13 -0.04 0.00 -0.00 0.00 0.00 57.88 57.61 1m1g h LEU 36 Cb 0.83 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.27 1m1g h LEU 36 CO 0.15 0.72 -0.18 -0.08 -0.00 0.00 0.00 178.44 179.04 1m1g h GLU 37 N 0.87 0.00 -0.85 1.13 4.57 0.02 -3.47 114.58 116.84 1m1g h GLU 37 Ca 0.22 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.39 1m1g h GLU 37 Cb 0.12 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1m1g h GLU 37 CO -0.03 0.18 -0.00 0.41 -1.18 0.00 0.00 179.01 178.39 1m1g n GLY 38 N 0.14 0.84 0.47 1.92 0.00 -0.02 -4.98 105.19 103.57 1m1g n GLY 38 Ca 0.00 -0.71 0.09 0.00 0.00 0.00 0.00 46.02 45.40 1m1g n GLY 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1m1g n LEU 39 N -0.44 3.05 0.25 0.99 4.77 0.22 -4.72 117.00 121.13 1m1g n LEU 39 Ca -0.00 -2.93 0.10 0.00 -0.03 0.00 0.00 56.01 53.14 1m1g n LEU 39 Cb 0.50 -0.45 0.66 0.00 -2.33 0.00 0.00 43.42 41.81 1m1g n LEU 39 CO 0.00 0.68 0.99 0.11 -1.33 0.00 0.00 177.39 177.84 1m1g h LYS 40 N 0.92 0.00 0.00 3.23 1.57 -1.90 -2.52 116.57 117.88 1m1g h LYS 40 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1m1g h LYS 40 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1m1g h LYS 40 CO 0.10 0.11 -0.24 0.22 -0.57 0.00 0.00 179.45 179.06 1m1g h ASP 41 N 0.00 0.00 1.47 0.86 3.58 -1.93 -2.90 116.42 117.50 1m1g h ASP 41 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1m1g h ASP 41 Cb 0.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.28 1m1g h ASP 41 CO 0.01 0.24 -0.12 -0.07 -2.88 0.00 0.00 179.24 176.43 1m1g h LEU 42 N 0.00 0.00 -8.25 2.28 4.07 -1.81 -3.45 115.31 108.15 1m1g h LEU 42 Ca -0.00 -0.03 -0.67 0.00 0.08 0.00 0.00 57.88 57.25 1m1g h LEU 42 Cb 0.65 0.00 -0.33 0.00 1.08 0.00 0.00 40.66 42.06 1m1g h LEU 42 CO 0.03 0.02 -0.86 -0.69 -1.08 0.00 0.00 178.44 175.86 1m1g s VAL 43 N -3.14 2.16 -0.19 1.22 1.01 -1.10 -0.98 120.40 119.39 1m1g s VAL 43 Ca 0.09 -0.95 -0.16 0.00 0.00 0.00 0.00 61.98 60.96 1m1g s VAL 43 Cb 0.11 -1.87 -0.11 0.00 0.00 0.00 0.00 36.38 34.51 1m1g s VAL 43 CO 0.63 0.55 -0.05 0.47 0.00 0.00 0.00 175.10 176.70 1m1g n ASP 44 N 4.00 1.86 -4.38 3.32 10.43 -0.57 -4.93 116.55 126.28 1m1g n ASP 44 Ca -0.20 0.48 -0.29 0.00 2.57 0.00 0.00 54.79 57.35 1m1g n ASP 44 Cb 0.52 -0.89 -0.13 0.00 1.84 0.00 0.00 41.12 42.45 1m1g n ASP 44 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 1m1g s GLU 45 N -2.39 1.47 -0.27 -1.24 2.56 -1.16 -4.97 118.70 112.71 1m1g s GLU 45 Ca -0.25 -1.31 -0.02 0.00 0.00 0.00 0.00 54.97 53.39 1m1g s GLU 45 Cb 0.05 -1.92 0.11 0.00 2.00 0.00 0.00 34.13 34.38 1m1g s GLU 45 CO 0.43 0.46 0.22 0.08 -0.56 0.00 0.00 175.26 175.89 1m1g s VAL 46 N -1.02 -0.27 0.11 3.70 1.01 -1.26 -0.91 120.40 121.76 1m1g s VAL 46 Ca 0.14 -0.50 0.07 0.00 0.00 0.00 0.00 61.98 61.69 1m1g s VAL 46 Cb -0.10 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 1m1g s VAL 46 CO 0.05 -0.50 -0.09 -0.63 0.00 0.00 0.00 175.10 173.93 1m1g s ILE 47 N 2.26 3.39 -0.29 2.22 -1.09 0.48 -4.98 121.20 123.20 1m1g s ILE 47 Ca 0.09 -1.30 -0.04 0.00 -2.23 0.00 0.00 60.65 57.16 1m1g s ILE 47 Cb -0.15 -2.60 0.03 0.00 -1.58 0.00 0.00 42.46 38.16 1m1g s ILE 47 CO -0.30 0.08 0.02 -0.69 -1.23 0.00 0.00 174.94 172.82 1m1g s VAL 48 N -1.29 3.34 -0.71 2.92 1.01 -1.26 -0.79 120.40 123.62 1m1g s VAL 48 Ca 0.22 -1.03 -0.24 0.00 0.00 0.00 0.00 61.98 60.92 1m1g s VAL 48 Cb -0.11 -2.79 -0.20 0.00 0.00 0.00 0.00 36.38 33.29 1m1g s VAL 48 CO 0.14 0.04 1.87 -0.81 0.00 0.00 0.00 175.10 176.34 1m1g n PRO 49 N 4.73 1.13 -4.35 2.72 -0.04 -1.26 -4.82 135.00 133.11 1m1g n PRO 49 Ca -0.15 -1.78 -0.18 0.00 -0.04 0.00 0.00 63.50 61.36 1m1g n PRO 49 Cb 0.46 -3.04 -0.10 0.00 -0.04 0.00 0.00 33.50 30.77 1m1g n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1m1g s ALA 50 N 7.27 1.91 0.07 0.55 0.00 -1.26 -4.00 121.76 126.30 1m1g s ALA 50 Ca 0.63 -1.90 0.05 0.00 0.00 0.00 0.00 51.96 50.74 1m1g s ALA 50 Cb 0.11 0.95 -0.04 0.00 0.00 0.00 0.00 23.12 24.14 1m1g s ALA 50 CO 0.17 -0.42 -0.04 -2.00 0.00 0.00 0.00 175.76 173.47 1m1g s GLU 51 N -3.99 2.44 -0.31 0.00 2.12 -1.23 -4.71 118.70 113.02 1m1g s GLU 51 Ca 0.37 -0.86 -0.24 0.00 0.36 0.00 0.00 54.97 54.60 1m1g s GLU 51 Cb 0.08 -2.47 0.00 0.00 0.26 0.00 0.00 34.13 32.00 1m1g s GLU 51 CO 0.14 0.55 0.82 -1.21 -0.54 0.00 0.00 175.26 175.02 1m1g s GLU 52 N -2.08 3.96 0.26 4.30 8.01 -1.26 -1.73 118.70 130.16 1m1g s GLU 52 Ca 0.23 0.62 0.07 0.00 0.01 0.00 0.00 54.97 55.89 1m1g s GLU 52 Cb -0.11 -3.73 -0.03 0.00 -4.31 0.00 0.00 34.13 25.94 1m1g s GLU 52 CO 0.15 -0.72 0.25 0.15 0.01 0.00 0.00 175.26 175.10 1m1g s LYS 53 N 3.04 3.01 -0.16 1.61 -0.14 0.27 -1.58 119.74 125.80 1m1g s LYS 53 Ca 0.34 -1.02 0.02 0.00 -1.36 0.00 0.00 55.97 53.94 1m1g s LYS 53 Cb -0.14 -2.63 0.02 0.00 -1.68 0.00 0.00 37.83 33.40 1m1g s LYS 53 CO 0.13 0.36 -0.21 0.08 -0.76 0.00 0.00 175.35 174.95 1m1g s VAL 54 N -2.12 2.06 -0.23 3.17 1.01 0.13 -0.93 120.40 123.48 1m1g s VAL 54 Ca 0.34 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 1m1g s VAL 54 Cb -0.08 -1.84 -0.00 0.00 0.00 0.00 0.00 36.38 34.46 1m1g s VAL 54 CO 0.26 0.54 -0.03 -0.69 0.00 0.00 0.00 175.10 175.19 1m1g s VAL 55 N 1.09 3.42 -0.16 2.92 1.01 0.14 -0.58 120.40 128.24 1m1g s VAL 55 Ca -0.00 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 1m1g s VAL 55 Cb -0.14 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1m1g s VAL 55 CO -0.08 0.36 0.04 -0.63 0.00 0.00 0.00 175.10 174.79 1m1g s ILE 56 N 1.47 4.64 0.22 2.22 1.09 -0.63 -0.25 121.20 129.97 1m1g s ILE 56 Ca 0.05 -0.10 0.11 0.00 -1.10 0.00 0.00 60.65 59.62 1m1g s ILE 56 Cb -0.15 -3.05 -0.05 0.00 -1.06 0.00 0.00 42.46 38.15 1m1g s ILE 56 CO -0.03 0.51 -0.22 -0.13 -0.10 0.00 0.00 174.94 174.97 1m1g s ARG 57 N 0.02 1.60 -0.50 2.79 0.52 -0.44 0.95 118.95 123.89 1m1g s ARG 57 Ca 0.05 -1.59 0.07 0.00 -0.52 0.00 0.00 55.73 53.73 1m1g s ARG 57 Cb -0.12 -1.84 0.24 0.00 0.52 0.00 0.00 34.95 33.75 1m1g s ARG 57 CO 0.01 0.38 0.58 0.00 0.02 0.00 0.00 175.30 176.29 1m1g n ALA 58 N -0.03 3.09 -1.30 2.13 0.00 0.31 -2.59 120.51 122.11 1m1g n ALA 58 Ca -0.10 -3.90 0.00 0.00 0.00 0.00 0.00 53.44 49.44 1m1g n ALA 58 Cb 0.57 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1m1g n ALA 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1m1g n GLN 59 N 1.40 0.00 0.00 0.00 6.02 0.18 -4.27 117.38 120.72 1m1g n GLN 59 Ca 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.24 1m1g n GLN 59 Cb 0.47 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.28 1m1g n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1m1g n GLY 60 N -1.00 2.06 3.70 1.08 0.00 -1.26 -4.98 105.19 104.79 1m1g n GLY 60 Ca 0.00 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 1m1g n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m1g s LYS 61 N 0.00 4.18 0.12 1.61 1.02 -1.26 -4.94 119.74 120.47 1m1g s LYS 61 Ca 0.00 2.44 -0.30 0.00 0.02 0.00 0.00 55.97 58.13 1m1g s LYS 61 Cb 0.00 -3.37 -0.06 0.00 -0.52 0.00 0.00 37.83 33.88 1m1g s LYS 61 CO 0.00 -0.72 1.13 -2.00 -0.92 0.00 0.00 175.35 172.84 1m1g s GLU 62 N 1.93 4.53 -0.05 1.68 2.12 -1.26 -0.53 118.70 127.12 1m1g s GLU 62 Ca 0.74 1.71 0.06 0.00 0.36 0.00 0.00 54.97 57.84 1m1g s GLU 62 Cb -0.44 -3.32 -0.09 0.00 0.26 0.00 0.00 34.13 30.54 1m1g s GLU 62 CO 0.33 -0.06 0.06 1.63 -0.54 0.00 0.00 175.26 176.67 1m1g n LYS 63 N 3.10 2.14 -3.67 4.30 4.76 0.27 -4.91 118.16 124.14 1m1g n LYS 63 Ca 0.05 -0.02 -0.10 0.00 -2.87 0.00 0.00 58.31 55.37 1m1g n LYS 63 Cb 0.47 -1.16 -0.05 0.00 -1.84 0.00 0.00 35.03 32.44 1m1g n LYS 63 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1m1g s TYR 64 N -2.25 -0.14 -0.32 2.13 1.51 -1.06 -4.96 117.35 112.25 1m1g s TYR 64 Ca -0.03 -0.20 0.02 0.00 -1.01 0.00 0.00 57.07 55.86 1m1g s TYR 64 Cb 0.03 0.21 0.16 0.00 -0.11 0.00 0.00 41.96 42.25 1m1g s TYR 64 CO 0.27 -0.69 0.40 0.50 -1.11 0.00 0.00 175.55 174.92 1m1g s ARG 65 N -3.82 0.49 0.09 -0.62 3.52 -1.23 -1.61 118.95 115.77 1m1g s ARG 65 Ca 0.04 -0.20 0.10 0.00 -0.13 0.00 0.00 55.73 55.54 1m1g s ARG 65 Cb 0.02 -0.43 -0.03 0.00 -1.56 0.00 0.00 34.95 32.94 1m1g s ARG 65 CO -0.11 -1.09 -0.26 -0.51 -0.81 0.00 0.00 175.30 172.51 1m1g s LEU 66 N 2.17 2.25 0.55 -0.88 1.43 0.26 -4.85 118.68 119.61 1m1g s LEU 66 Ca 0.12 -0.67 -0.20 0.00 -1.03 0.00 0.00 54.13 52.34 1m1g s LEU 66 Cb -0.13 -1.24 -0.06 0.00 0.03 0.00 0.00 46.19 44.80 1m1g s LEU 66 CO -0.22 0.21 1.09 -1.20 0.23 0.00 0.00 176.35 176.46 1m1g n SER 67 N 1.33 1.41 0.01 2.29 7.64 -1.26 0.22 113.62 125.26 1m1g n SER 67 Ca -0.17 0.89 -0.13 0.00 1.01 0.00 0.00 58.87 60.47 1m1g n SER 67 Cb 0.52 -1.44 -0.01 0.00 -1.01 0.00 0.00 64.21 62.28 1m1g n SER 67 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1m1g h LEU 68 N 0.94 0.69 -9.79 -3.43 6.46 -1.61 -3.44 115.31 105.13 1m1g h LEU 68 Ca -0.48 -0.44 -0.59 0.00 -0.12 0.00 0.00 57.88 56.25 1m1g h LEU 68 Cb 1.34 -0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 41.02 1m1g h LEU 68 CO 0.54 1.20 -0.20 -0.75 -0.62 0.00 0.00 178.44 178.61 1m1g s LYS 69 N -3.74 3.84 0.00 1.25 2.36 -1.26 -3.83 119.74 118.37 1m1g s LYS 69 Ca -0.08 0.30 0.00 0.00 -2.55 0.00 0.00 55.97 53.64 1m1g s LYS 69 Cb 0.10 -3.03 0.00 0.00 -1.05 0.00 0.00 37.83 33.85 1m1g s LYS 69 CO 0.87 0.57 0.00 0.41 1.55 0.00 0.00 175.35 178.74 1m1g n GLY 70 N 1.07 -1.32 3.74 5.54 0.00 -1.26 -4.94 105.19 108.02 1m1g n GLY 70 Ca -0.09 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.06 1m1g n GLY 70 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m1g s ASN 71 N -0.97 4.60 0.12 1.61 0.01 -1.26 -4.57 114.94 114.47 1m1g s ASN 71 Ca 0.00 2.38 -0.31 0.00 -0.71 0.00 0.00 52.86 54.22 1m1g s ASN 71 Cb 0.00 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 38.96 1m1g s ASN 71 CO 0.00 -1.99 1.84 0.00 -1.51 0.00 0.00 177.10 175.44 1m1g s ALA 72 N -1.81 3.76 -0.08 0.60 0.00 -1.26 -4.90 121.76 118.06 1m1g s ALA 72 Ca 0.76 1.45 -0.04 0.00 0.00 0.00 0.00 51.96 54.13 1m1g s ALA 72 Cb -0.30 -3.77 0.04 0.00 0.00 0.00 0.00 23.12 19.09 1m1g s ALA 72 CO 0.41 -1.25 0.17 -0.98 0.00 0.00 0.00 175.76 174.11 1m1g s ARG 73 N 2.85 0.13 0.03 0.00 1.70 -1.02 -5.04 118.95 117.60 1m1g s ARG 73 Ca 0.82 0.41 -0.08 0.00 -0.47 0.00 0.00 55.73 56.41 1m1g s ARG 73 Cb -0.46 -0.15 -0.05 0.00 -0.57 0.00 0.00 34.95 33.72 1m1g s ARG 73 CO 0.37 -0.16 0.32 -0.51 -1.08 0.00 0.00 175.30 174.24 1m1g s ASP 74 N 1.15 6.55 -0.14 -2.89 1.11 -1.26 -2.38 116.67 118.82 1m1g s ASP 74 Ca -0.09 0.65 0.00 0.00 0.18 0.00 0.00 52.55 53.29 1m1g s ASP 74 Cb -0.11 -2.12 0.02 0.00 1.07 0.00 0.00 42.92 41.78 1m1g s ASP 74 CO -0.06 0.23 -0.12 -0.63 1.18 0.00 0.00 175.17 175.76 1m1g s ILE 75 N -1.33 1.42 -0.15 0.77 1.09 0.37 -4.98 121.20 118.39 1m1g s ILE 75 Ca 0.29 -0.54 -0.05 0.00 -1.10 0.00 0.00 60.65 59.25 1m1g s ILE 75 Cb -0.14 -1.36 -0.03 0.00 -1.06 0.00 0.00 42.46 39.87 1m1g s ILE 75 CO 0.17 0.43 0.01 -0.44 -0.10 0.00 0.00 174.94 175.01 1m1g s SER 76 N 1.53 5.21 -0.00 3.58 0.01 -1.26 -0.13 113.70 122.63 1m1g s SER 76 Ca 0.05 0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.32 1m1g s SER 76 Cb -0.13 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.31 1m1g s SER 76 CO -0.10 0.22 -0.02 0.68 0.41 0.00 0.00 173.24 174.43 1m1g s VAL 77 N 0.10 0.16 0.18 3.43 -7.23 -0.90 -4.98 120.40 111.17 1m1g s VAL 77 Ca 0.02 -0.08 -0.27 0.00 -1.81 0.00 0.00 61.98 59.84 1m1g s VAL 77 Cb -0.13 -0.15 -0.08 0.00 0.56 0.00 0.00 36.38 36.58 1m1g s VAL 77 CO 0.02 0.05 0.85 -0.76 -0.31 0.00 0.00 175.10 174.94 1m1g s LEU 78 N 0.02 4.60 0.00 1.32 1.43 -1.26 -1.92 118.68 122.87 1m1g s LEU 78 Ca 0.00 1.75 0.00 0.00 -1.03 0.00 0.00 54.13 54.85 1m1g s LEU 78 Cb -0.02 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1m1g s LEU 78 CO -0.00 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.35 1m1g n GLY 79 N 1.64 4.70 0.07 -3.19 0.00 0.14 -4.78 105.19 103.77 1m1g n GLY 79 Ca -0.04 -0.88 -0.03 0.00 0.00 0.00 0.00 46.02 45.08 1m1g n GLY 79 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1m1g h LYS 80 N 0.00 -0.16 0.02 1.61 1.63 -0.82 -3.38 116.57 115.46 1m1g h LYS 80 Ca 0.00 0.01 -0.25 0.00 -0.85 0.00 0.00 60.65 59.56 1m1g h LYS 80 Cb 0.00 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1m1g h LYS 80 CO 0.00 -0.11 -1.32 0.87 -3.45 0.00 0.00 179.45 175.45 1m1g h LYS 81 N -0.26 0.04 0.00 1.90 1.57 -1.77 -3.51 116.57 114.54 1m1g h LYS 81 Ca -0.02 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1m1g h LYS 81 Cb 0.13 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1m1g h LYS 81 CO 0.03 0.86 0.00 0.41 -0.57 0.00 0.00 179.45 180.17 1m1g n GLY 82 N 1.47 -0.89 3.73 3.86 0.00 -1.26 -5.09 105.19 107.01 1m1g n GLY 82 Ca -0.08 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 1m1g n GLY 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m1g s VAL 83 N -3.88 5.21 -0.19 1.61 1.01 -1.26 -0.68 120.40 122.22 1m1g s VAL 83 Ca 0.00 0.82 0.01 0.00 0.00 0.00 0.00 61.98 62.81 1m1g s VAL 83 Cb 0.00 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1m1g s VAL 83 CO 0.00 0.36 -0.14 -0.89 0.00 0.00 0.00 175.10 174.44 1m1g s THR 84 N 0.46 1.79 -0.32 3.92 2.01 -0.81 -3.50 115.64 119.21 1m1g s THR 84 Ca 0.23 -0.99 -0.10 0.00 0.31 0.00 0.00 61.69 61.14 1m1g s THR 84 Cb -0.15 -1.77 -0.01 0.00 0.01 0.00 0.00 72.50 70.59 1m1g s THR 84 CO 0.08 0.30 0.17 -0.89 -0.69 0.00 0.00 174.62 173.59 1m1g s THR 85 N 1.35 4.71 0.29 -0.82 2.01 -0.39 -2.12 115.64 120.68 1m1g s THR 85 Ca 0.01 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.62 1m1g s THR 85 Cb -0.15 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.91 1m1g s THR 85 CO -0.10 0.05 0.48 -0.36 -0.69 0.00 0.00 174.62 174.01 1m1g s PHE 86 N 1.63 3.49 -0.04 4.92 0.40 0.81 -1.09 117.98 128.09 1m1g s PHE 86 Ca 0.05 0.32 -0.00 0.00 -0.60 0.00 0.00 56.93 56.69 1m1g s PHE 86 Cb -0.17 -1.86 0.03 0.00 0.51 0.00 0.00 43.02 41.53 1m1g s PHE 86 CO 0.07 0.24 0.01 0.50 0.70 0.00 0.00 175.22 176.73 1m1g s ARG 87 N -3.94 0.36 -0.34 0.44 3.52 0.12 -0.48 118.95 118.63 1m1g s ARG 87 Ca 0.39 0.12 -0.09 0.00 -0.13 0.00 0.00 55.73 56.02 1m1g s ARG 87 Cb -0.10 -0.64 0.02 0.00 -1.56 0.00 0.00 34.95 32.67 1m1g s ARG 87 CO 0.33 -0.20 0.14 0.42 -0.81 0.00 0.00 175.30 175.17 1m1g s ILE 88 N 1.44 4.24 -0.03 4.11 1.01 -1.00 -1.86 121.20 129.11 1m1g s ILE 88 Ca -0.04 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.82 1m1g s ILE 88 Cb -0.13 -3.30 0.02 0.00 0.01 0.00 0.00 42.46 39.06 1m1g s ILE 88 CO -0.03 -0.09 -0.03 -1.61 0.00 0.00 0.00 174.94 173.18 1m1g s GLU 89 N 1.52 0.55 -1.73 2.79 2.02 -0.43 -2.45 118.70 120.96 1m1g s GLU 89 Ca 0.02 -0.06 -0.20 0.00 0.02 0.00 0.00 54.97 54.75 1m1g s GLU 89 Cb -0.18 -0.61 0.17 0.00 0.10 0.00 0.00 34.13 33.61 1m1g s GLU 89 CO 0.05 -0.06 0.77 0.09 0.02 0.00 0.00 175.26 176.12 1m1g n ASN 90 N 3.83 -3.15 -0.23 -0.19 5.03 -1.26 -1.79 115.26 117.50 1m1g n ASN 90 Ca -0.24 -1.03 0.00 0.00 0.87 0.00 0.00 54.58 54.18 1m1g n ASN 90 Cb 0.52 -2.59 0.00 0.00 -1.02 0.00 0.00 39.78 36.69 1m1g n ASN 90 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1m1g n GLY 91 N -1.33 0.66 3.16 7.41 0.00 -1.25 -5.07 105.19 108.77 1m1g n GLY 91 Ca 0.09 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.22 1m1g n GLY 91 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1m1g s GLU 92 N -4.44 0.64 -0.02 1.61 2.02 -0.74 -4.73 118.70 113.05 1m1g s GLU 92 Ca 0.00 -0.58 0.07 0.00 0.02 0.00 0.00 54.97 54.48 1m1g s GLU 92 Cb 0.00 0.27 -0.02 0.00 0.10 0.00 0.00 34.13 34.47 1m1g s GLU 92 CO 0.00 -0.18 -0.22 0.08 0.02 0.00 0.00 175.26 174.96 1m1g s VAL 93 N -2.29 2.40 0.25 2.63 1.01 -0.72 -1.32 120.40 122.36 1m1g s VAL 93 Ca -0.07 -1.04 -0.22 0.00 0.00 0.00 0.00 61.98 60.65 1m1g s VAL 93 Cb -0.02 -1.89 0.04 0.00 0.00 0.00 0.00 36.38 34.50 1m1g s VAL 93 CO -0.02 0.54 0.81 -1.59 0.00 0.00 0.00 175.10 174.83 1m1g s LYS 94 N -0.78 1.65 -0.27 2.72 -2.85 -0.78 -1.21 119.74 118.21 1m1g s LYS 94 Ca 0.11 -0.94 -0.10 0.00 -1.00 0.00 0.00 55.97 54.04 1m1g s LYS 94 Cb -0.10 0.55 -0.05 0.00 -2.06 0.00 0.00 37.83 36.17 1m1g s LYS 94 CO 0.00 -0.76 0.17 0.08 0.10 0.00 0.00 175.35 174.94 1m1g s VAL 95 N -3.51 5.12 0.06 1.79 1.01 -1.26 0.11 120.40 123.72 1m1g s VAL 95 Ca 0.12 0.11 -0.15 0.00 0.00 0.00 0.00 61.98 62.06 1m1g s VAL 95 Cb -0.04 -3.43 -0.26 0.00 0.00 0.00 0.00 36.38 32.65 1m1g s VAL 95 CO 0.06 0.27 1.15 0.58 0.00 0.00 0.00 175.10 177.16 1m1g h VAL 96 N 5.38 1.29 -1.49 2.92 2.07 -1.42 -3.45 116.25 121.56 1m1g h VAL 96 Ca -0.36 -2.31 0.12 0.00 0.82 0.00 0.00 66.70 64.97 1m1g h VAL 96 Cb 1.19 2.52 -0.23 0.00 -1.52 0.00 0.00 31.29 33.24 1m1g h VAL 96 CO 0.56 0.71 0.63 -1.83 0.02 0.00 0.00 177.57 177.65 1m1g s GLU 97 N -3.18 0.50 0.28 1.57 -1.05 -1.21 -5.05 118.70 110.56 1m1g s GLU 97 Ca -0.10 0.10 0.01 0.00 -0.15 0.00 0.00 54.97 54.83 1m1g s GLU 97 Cb 0.06 0.23 -0.00 0.00 -0.44 0.00 0.00 34.13 33.98 1m1g s GLU 97 CO 0.92 -0.16 0.34 0.45 0.95 0.00 0.00 175.26 177.76 1m1g n SER 98 N 0.64 -0.92 -4.73 0.83 2.88 -1.26 -1.26 113.62 109.80 1m1g n SER 98 Ca -0.08 -2.62 -0.34 0.00 -1.33 0.00 0.00 58.87 54.50 1m1g n SER 98 Cb 0.58 1.82 0.09 0.00 -0.75 0.00 0.00 64.21 65.95 1m1g n SER 98 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1m1g s VAL 99 N -2.86 2.49 0.25 2.46 -7.23 -1.23 -4.89 120.40 109.40 1m1g s VAL 99 Ca 0.27 0.23 -0.30 0.00 -1.81 0.00 0.00 61.98 60.37 1m1g s VAL 99 Cb 0.00 -2.76 -0.11 0.00 0.56 0.00 0.00 36.38 34.07 1m1g s VAL 99 CO 0.19 -0.14 1.55 -1.83 -0.31 0.00 0.00 175.10 174.56 1m1g s GLU 100 N -4.01 4.18 0.00 4.82 -1.05 -1.26 -1.42 118.70 119.96 1m1g s GLU 100 Ca 0.72 2.46 0.00 0.00 -0.15 0.00 0.00 54.97 58.00 1m1g s GLU 100 Cb -0.27 -3.07 0.00 0.00 -0.44 0.00 0.00 34.13 30.35 1m1g s GLU 100 CO 0.45 -0.57 0.00 0.41 0.95 0.00 0.00 175.26 176.51 1m1g n GLY 101 N 2.52 2.67 3.64 -3.83 0.00 -1.26 -5.01 105.19 103.92 1m1g n GLY 101 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1m1g n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m1g s ASP 102 N -1.42 6.83 0.07 1.61 -0.00 -0.51 -4.81 116.67 118.43 1m1g s ASP 102 Ca 0.00 0.97 0.22 0.00 -0.00 0.00 0.00 52.55 53.75 1m1g s ASP 102 Cb 0.00 -2.46 -0.07 0.00 -0.00 0.00 0.00 42.92 40.39 1m1g s ASP 102 CO 0.00 -0.61 0.89 0.35 -0.00 0.00 0.00 175.17 175.79 1m1g n THR 103 N 5.43 0.23 0.20 -1.27 -2.24 -1.26 -4.18 114.28 111.18 1m1g n THR 103 Ca 0.07 -0.37 0.13 0.00 -2.27 0.00 0.00 64.05 61.60 1m1g n THR 103 Cb 0.47 0.05 0.43 0.00 -2.10 0.00 0.00 70.33 69.19 1m1g n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1m1g h VAL 105 N 0.00 0.00 -0.03 0.00 -1.51 -1.86 -2.45 116.25 110.40 1m1g h VAL 105 Ca 0.12 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 65.26 1m1g h VAL 105 Cb 1.65 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 1m1g h VAL 105 CO -0.00 0.00 -0.14 0.59 -1.23 0.00 0.00 177.57 176.79 1m1g n ASN 106 N -3.09 2.71 -4.77 4.19 5.03 0.28 -4.77 115.26 114.85 1m1g n ASN 106 Ca -0.01 -1.85 -0.39 0.00 0.87 0.00 0.00 54.58 53.20 1m1g n ASN 106 Cb 0.22 0.14 -0.02 0.00 -1.02 0.00 0.00 39.78 39.10 1m1g n ASN 106 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1m1g s ALA 107 N -2.14 3.23 0.44 5.41 0.00 -0.92 -5.00 121.76 122.78 1m1g s ALA 107 Ca 0.25 0.98 -0.24 0.00 0.00 0.00 0.00 51.96 52.95 1m1g s ALA 107 Cb 0.19 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.86 1m1g s ALA 107 CO 0.38 -0.47 1.19 -1.25 0.00 0.00 0.00 175.76 175.61 1m1g s PRO 108 N -2.11 3.86 0.02 0.00 0.04 -1.26 -4.76 135.00 130.78 1m1g s PRO 108 Ca 0.54 1.85 -0.31 0.00 0.04 0.00 0.00 61.00 63.12 1m1g s PRO 108 Cb -0.32 -2.53 -0.10 0.00 0.04 0.00 0.00 34.50 31.60 1m1g s PRO 108 CO 0.40 -0.49 1.93 -0.35 0.04 0.00 0.00 177.00 178.53 1m1g n PRO 109 N -0.25 2.68 -2.01 0.56 -0.04 -1.26 -4.94 135.00 129.73 1m1g n PRO 109 Ca 0.06 0.98 -0.31 0.00 -0.04 0.00 0.00 63.50 64.20 1m1g n PRO 109 Cb 0.47 -2.90 0.01 0.00 -0.04 0.00 0.00 33.50 31.04 1m1g n PRO 109 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1m1g s ILE 110 N 4.04 4.73 0.00 0.52 -4.36 -0.35 -4.80 121.20 120.98 1m1g s ILE 110 Ca 0.89 0.80 0.00 0.00 -0.26 0.00 0.00 60.65 62.07 1m1g s ILE 110 Cb -0.51 -3.86 0.00 0.00 1.25 0.00 0.00 42.46 39.34 1m1g s ILE 110 CO 0.44 -1.08 0.00 -1.20 0.24 0.00 0.00 174.94 173.34 1m1g n SER 111 N -2.61 0.00 -4.40 4.36 7.64 -1.26 -1.75 113.62 115.59 1m1g n SER 111 Ca 0.05 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.53 1m1g n SER 111 Cb 0.54 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.76 1m1g n SER 111 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1m1g n LYS 112 N -0.46 0.39 -0.58 1.43 4.01 -1.26 -4.91 118.16 116.78 1m1g n LYS 112 Ca 0.00 0.15 -0.30 0.00 -0.51 0.00 0.00 58.31 57.65 1m1g n LYS 112 Cb 0.00 -1.41 0.21 0.00 -0.51 0.00 0.00 35.03 33.32 1m1g n LYS 112 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1m1g n PRO 113 N 0.66 -1.73 0.00 1.97 -0.04 -1.26 -3.34 135.00 131.25 1m1g n PRO 113 Ca 0.11 -0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.10 1m1g n PRO 113 Cb 0.43 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 1m1g n PRO 113 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1m1g n GLY 114 N 1.07 2.12 3.62 0.55 0.00 -0.29 -4.99 105.19 107.27 1m1g n GLY 114 Ca 0.05 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 1m1g n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1m1g s GLN 115 N 0.00 -0.00 -0.28 1.61 -0.21 -1.21 -4.85 119.66 114.71 1m1g s GLN 115 Ca 0.00 0.61 -0.36 0.00 0.02 0.00 0.00 55.36 55.63 1m1g s GLN 115 Cb 0.00 -1.68 0.17 0.00 1.00 0.00 0.00 33.01 32.50 1m1g s GLN 115 CO 0.00 -3.05 1.36 -1.59 -2.12 0.00 0.00 175.29 169.89 1m1g s LYS 116 N -4.81 0.06 -0.07 2.91 -2.85 -1.26 -2.28 119.74 111.44 1m1g s LYS 116 Ca 0.66 -0.01 0.05 0.00 -1.00 0.00 0.00 55.97 55.67 1m1g s LYS 116 Cb -0.20 0.03 -0.00 0.00 -2.06 0.00 0.00 37.83 35.59 1m1g s LYS 116 CO 0.60 -0.03 -0.23 0.42 0.10 0.00 0.00 175.35 176.22 1m1g s ILE 117 N -1.81 1.89 -0.05 3.79 1.01 -0.82 -5.01 121.20 120.20 1m1g s ILE 117 Ca 0.11 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 59.85 1m1g s ILE 117 Cb -0.01 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 1m1g s ILE 117 CO -0.04 0.53 -0.21 -0.89 0.00 0.00 0.00 174.94 174.33 1m1g s THR 118 N 0.08 1.73 -0.70 2.92 2.01 -1.26 -2.41 115.64 118.01 1m1g s THR 118 Ca -0.09 -0.88 -0.06 0.00 0.31 0.00 0.00 61.69 60.97 1m1g s THR 118 Cb -0.15 -1.47 0.18 0.00 0.01 0.00 0.00 72.50 71.07 1m1g s THR 118 CO 0.05 0.49 0.55 0.00 -0.69 0.00 0.00 174.62 175.02 1m1g h LYS 120 N 7.19 0.00 0.18 0.00 3.64 -1.96 -1.09 116.57 124.54 1m1g h LYS 120 Ca 0.03 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.10 1m1g h LYS 120 Cb 0.97 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.81 1m1g h LYS 120 CO 0.73 0.00 -1.50 0.93 -2.27 0.00 0.00 179.45 177.34 1m1g h GLU 121 N 0.00 0.38 0.00 1.90 4.39 -1.92 -3.36 114.58 115.98 1m1g h GLU 121 Ca 0.00 -0.65 0.00 0.00 0.34 0.00 0.00 59.36 59.05 1m1g h GLU 121 Cb 0.10 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1m1g h GLU 121 CO 0.00 1.31 -0.80 -0.97 -1.16 0.00 0.00 179.01 177.40 1m1g h ASN 122 N -0.04 0.00 -2.86 1.42 -1.24 -1.91 -3.40 115.58 107.55 1m1g h ASN 122 Ca -0.29 -0.17 -0.12 0.00 0.71 0.00 0.00 56.30 56.42 1m1g h ASN 122 Cb 1.98 0.00 0.05 0.00 0.73 0.00 0.00 38.32 41.08 1m1g h ASN 122 CO 0.17 0.09 -0.24 0.29 -1.29 0.00 0.00 177.43 176.44 1m1g n LYS 123 N -2.27 -2.50 -4.44 6.67 4.01 -0.43 -0.13 118.16 119.08 1m1g n LYS 123 Ca 0.02 0.28 -0.22 0.00 -0.51 0.00 0.00 58.31 57.88 1m1g n LYS 123 Cb 0.47 -3.63 -0.10 0.00 -0.51 0.00 0.00 35.03 31.26 1m1g n LYS 123 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1m1g s THR 124 N -3.11 0.81 0.00 -0.18 -4.23 -1.09 0.52 115.64 108.36 1m1g s THR 124 Ca 0.12 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 1m1g s THR 124 Cb -0.05 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1m1g s THR 124 CO 0.24 0.00 0.00 -1.84 -0.54 0.00 0.00 174.62 172.48 1m1g n GLU 125 N -0.71 0.00 -4.72 3.99 0.28 -1.07 -2.03 120.64 116.38 1m1g n GLU 125 Ca -0.03 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.69 1m1g n GLU 125 Cb 0.66 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 33.36 1m1g n GLU 125 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1m1g s ALA 126 N -2.00 1.73 -0.05 -1.84 0.00 -1.01 -1.32 121.76 117.27 1m1g s ALA 126 Ca 0.00 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.27 1m1g s ALA 126 Cb 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.36 1m1g s ALA 126 CO 0.00 0.09 -0.16 0.21 0.00 0.00 0.00 175.76 175.89 1m1g s LYS 127 N 0.70 1.82 -0.27 0.00 2.20 0.66 -1.94 119.74 122.91 1m1g s LYS 127 Ca -0.13 -0.58 -0.13 0.00 -0.36 0.00 0.00 55.97 54.78 1m1g s LYS 127 Cb -0.16 -1.54 -0.04 0.00 -1.51 0.00 0.00 37.83 34.57 1m1g s LYS 127 CO 0.03 0.19 0.27 0.42 -0.36 0.00 0.00 175.35 175.90 1m1g s ILE 128 N 0.19 5.26 0.21 5.43 1.01 -0.96 0.26 121.20 132.59 1m1g s ILE 128 Ca -0.07 0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.96 1m1g s ILE 128 Cb -0.13 -3.60 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 1m1g s ILE 128 CO 0.03 0.22 0.00 0.68 0.00 0.00 0.00 174.94 175.88 1m1g s VAL 129 N 1.79 0.87 -0.06 2.92 -7.23 -0.11 -1.13 120.40 117.45 1m1g s VAL 129 Ca 0.11 -2.01 -0.04 0.00 -1.81 0.00 0.00 61.98 58.23 1m1g s VAL 129 Cb -0.16 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 1m1g s VAL 129 CO 0.10 -0.37 0.12 -0.76 -0.31 0.00 0.00 175.10 173.89 1m1g s LEU 130 N -3.25 4.18 -0.20 1.32 1.43 -1.26 0.95 118.68 121.85 1m1g s LEU 130 Ca 0.27 0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 53.67 1m1g s LEU 130 Cb 0.06 -2.25 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 1m1g s LEU 130 CO 0.07 0.33 -0.08 -1.81 0.23 0.00 0.00 176.35 175.09 1m1g s ASP 131 N -1.44 4.11 -0.20 2.29 -0.00 -0.70 -4.93 116.67 115.79 1m1g s ASP 131 Ca 0.20 -0.40 0.00 0.00 -0.00 0.00 0.00 52.55 52.35 1m1g s ASP 131 Cb -0.12 -1.68 0.20 0.00 -0.00 0.00 0.00 42.92 41.31 1m1g s ASP 131 CO 0.10 0.02 1.70 0.59 -0.00 0.00 0.00 175.17 177.58 1m1g n ASN 132 N 4.49 4.84 0.04 0.27 4.13 -1.26 -3.47 115.26 124.30 1m1g n ASN 132 Ca -0.19 -2.75 -0.20 0.00 1.68 0.00 0.00 54.58 53.13 1m1g n ASN 132 Cb 0.51 -0.87 -0.14 0.00 -1.54 0.00 0.00 39.78 37.75 1m1g n ASN 132 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1m1g h LYS 133 N 0.89 0.33 0.00 3.52 1.57 -1.94 -3.35 116.57 117.60 1m1g h LYS 133 Ca 0.22 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1m1g h LYS 133 Cb 1.27 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1m1g h LYS 133 CO 0.49 1.22 0.00 -0.89 -0.57 0.00 0.00 179.45 179.70 1m1g n ILE 134 N -4.13 0.00 -3.55 1.86 2.08 -1.26 -4.45 119.36 109.91 1m1g n ILE 134 Ca -0.13 1.06 -0.39 0.00 0.56 0.00 0.00 62.75 63.85 1m1g n ILE 134 Cb 0.80 -1.99 -0.05 0.00 -0.75 0.00 0.00 39.64 37.66 1m1g n ILE 134 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1m1g s PHE 135 N -1.57 3.92 0.58 1.39 0.40 -1.26 -5.08 117.98 116.37 1m1g s PHE 135 Ca 0.00 -2.82 -0.18 0.00 -0.60 0.00 0.00 56.93 53.33 1m1g s PHE 135 Cb 0.00 -3.44 -0.04 0.00 0.51 0.00 0.00 43.02 40.05 1m1g s PHE 135 CO 0.00 -0.82 1.12 -2.14 0.70 0.00 0.00 175.22 174.07 1m1g s PRO 136 N -1.05 3.21 -0.88 0.24 0.02 -1.26 -3.93 135.00 131.36 1m1g s PRO 136 Ca 0.26 1.52 0.00 0.00 0.02 0.00 0.00 61.00 62.80 1m1g s PRO 136 Cb -0.10 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.43 1m1g s PRO 136 CO -0.10 -0.94 0.00 0.41 -0.33 0.00 0.00 177.00 176.04 1m1g n GLY 137 N -0.11 0.19 3.24 0.52 0.00 -1.26 -4.97 105.19 102.80 1m1g n GLY 137 Ca 0.11 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 1m1g n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m1g s TYR 138 N -2.47 -0.22 -0.06 1.61 1.51 -1.25 -1.76 117.35 114.71 1m1g s TYR 138 Ca 0.00 0.39 -0.05 0.00 -1.01 0.00 0.00 57.07 56.40 1m1g s TYR 138 Cb 0.00 0.11 0.01 0.00 -0.11 0.00 0.00 41.96 41.97 1m1g s TYR 138 CO 0.00 -0.36 0.15 0.96 -1.11 0.00 0.00 175.55 175.19 1m1g s ILE 139 N -1.07 0.00 0.02 2.71 -4.36 -0.76 -4.40 121.20 113.34 1m1g s ILE 139 Ca -0.11 -0.00 -0.04 0.00 -0.26 0.00 0.00 60.65 60.24 1m1g s ILE 139 Cb -0.05 -0.22 -0.04 0.00 1.25 0.00 0.00 42.46 43.40 1m1g s ILE 139 CO 0.04 -0.00 0.23 -0.76 0.24 0.00 0.00 174.94 174.69 1m1g s LEU 140 N 0.08 4.36 0.01 0.37 1.43 0.02 -0.00 118.68 124.95 1m1g s LEU 140 Ca -0.00 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.54 1m1g s LEU 140 Cb -0.01 -2.72 -0.01 0.00 0.03 0.00 0.00 46.19 43.48 1m1g s LEU 140 CO 0.00 0.23 -0.04 0.27 0.23 0.00 0.00 176.35 177.05 1m1g s ILE 141 N -1.36 0.26 -0.25 -0.59 -5.25 -0.30 -0.39 121.20 113.31 1m1g s ILE 141 Ca 0.29 -0.39 -0.05 0.00 -0.99 0.00 0.00 60.65 59.51 1m1g s ILE 141 Cb -0.13 -0.27 0.00 0.00 2.95 0.00 0.00 42.46 45.02 1m1g s ILE 141 CO 0.19 -0.09 0.00 -0.75 -1.79 0.00 0.00 174.94 172.50 1m1g s LYS 142 N -0.52 3.16 0.25 0.37 2.20 -0.09 -0.34 119.74 124.77 1m1g s LYS 142 Ca -0.03 -0.78 -0.17 0.00 -0.36 0.00 0.00 55.97 54.62 1m1g s LYS 142 Cb -0.04 -3.15 0.01 0.00 -1.51 0.00 0.00 37.83 33.15 1m1g s LYS 142 CO -0.00 -0.33 0.59 0.00 -0.36 0.00 0.00 175.35 175.25 1m1g s ALA 143 N 1.46 -0.82 -0.60 3.13 0.00 0.02 -1.51 121.76 123.43 1m1g s ALA 143 Ca 0.03 -0.49 -0.19 0.00 0.00 0.00 0.00 51.96 51.31 1m1g s ALA 143 Cb -0.16 0.93 0.10 0.00 0.00 0.00 0.00 23.12 23.99 1m1g s ALA 143 CO -0.01 -0.92 0.74 -1.58 0.00 0.00 0.00 175.76 173.98 1m1g s HIS 144 N -3.94 2.96 0.13 0.00 2.46 -0.15 -0.70 115.29 116.04 1m1g s HIS 144 Ca 0.15 -0.92 -0.30 0.00 0.47 0.00 0.00 55.06 54.45 1m1g s HIS 144 Cb -0.03 -4.05 -0.07 0.00 -0.13 0.00 0.00 32.58 28.30 1m1g s HIS 144 CO 0.06 -1.34 1.17 1.41 -2.47 0.00 0.00 174.74 173.57 1m1g s MET 145 N 2.84 4.49 0.30 2.88 1.75 -1.26 -4.92 119.30 125.38 1m1g s MET 145 Ca 0.13 1.80 -0.09 0.00 -1.25 0.00 0.00 55.69 56.28 1m1g s MET 145 Cb -0.23 -3.29 0.00 0.00 2.84 0.00 0.00 34.83 34.15 1m1g s MET 145 CO 0.07 -0.11 0.49 0.54 -0.65 0.00 0.00 175.02 175.36 1m1g s ASN 146 N 0.43 0.32 0.35 1.11 6.03 -1.26 -5.04 114.94 116.89 1m1g s ASN 146 Ca 0.54 -1.19 0.03 0.00 -1.03 0.00 0.00 52.86 51.22 1m1g s ASN 146 Cb -0.31 0.64 0.65 0.00 -3.03 0.00 0.00 41.25 39.20 1m1g s ASN 146 CO 0.33 -1.25 1.97 0.44 -2.03 0.00 0.00 177.10 176.56 1m1g h ASP 147 N 2.19 0.61 -0.04 3.54 3.45 -1.98 0.11 116.42 124.30 1m1g h ASP 147 Ca -0.28 -0.05 -0.04 0.00 0.43 0.00 0.00 57.03 57.09 1m1g h ASP 147 Cb 1.25 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.86 1m1g h ASP 147 CO 0.38 0.52 -0.12 0.50 -1.57 0.00 0.00 179.24 178.95 1m1g h LYS 148 N 0.69 0.16 -0.08 3.56 3.64 -1.99 -2.60 116.57 119.95 1m1g h LYS 148 Ca 0.17 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1m1g h LYS 148 Cb 0.06 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1m1g h LYS 148 CO -0.03 0.73 0.05 1.25 -2.27 0.00 0.00 179.45 179.18 1m1g h LEU 149 N -0.39 0.10 -1.65 5.20 5.85 -1.91 -0.80 115.31 121.71 1m1g h LEU 149 Ca -0.00 -0.04 0.14 0.00 0.84 0.00 0.00 57.88 58.82 1m1g h LEU 149 Cb 0.73 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1m1g h LEU 149 CO 0.03 0.11 0.48 0.25 -0.34 0.00 0.00 178.44 178.96 1m1g h LEU 150 N 0.08 0.33 0.07 2.25 5.85 -0.85 -0.36 115.31 122.67 1m1g h LEU 150 Ca 0.03 0.02 -0.28 0.00 0.84 0.00 0.00 57.88 58.49 1m1g h LEU 150 Cb 0.03 -0.05 0.02 0.00 0.37 0.00 0.00 40.66 41.03 1m1g h LEU 150 CO -0.01 0.17 -1.20 -0.03 -0.34 0.00 0.00 178.44 177.04 1m1g h MET 151 N 0.35 0.48 -0.62 1.25 4.05 -1.04 -2.92 114.93 116.49 1m1g h MET 151 Ca 0.34 -0.67 -0.03 0.00 -0.28 0.00 0.00 59.70 59.07 1m1g h MET 151 Cb 0.85 0.22 -0.03 0.00 -0.80 0.00 0.00 31.60 31.84 1m1g h MET 151 CO -0.10 1.29 0.27 0.00 0.23 0.00 0.00 176.91 178.60 1m1g h ALA 152 N 0.45 1.32 -0.05 0.39 0.00 0.35 -2.41 119.26 119.31 1m1g h ALA 152 Ca -0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1m1g h ALA 152 Cb 1.88 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 1m1g h ALA 152 CO 0.22 0.52 0.01 0.82 0.00 0.00 0.00 179.25 180.81 1m1g h ILE 153 N 0.88 1.22 0.00 0.00 2.04 -1.16 -2.45 117.51 118.03 1m1g h ILE 153 Ca 0.21 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1m1g h ILE 153 Cb 0.13 1.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1m1g h ILE 153 CO -0.02 0.18 0.00 -0.33 0.00 0.00 0.00 178.15 177.98 1m1g h GLU 154 N -0.16 0.00 -0.01 2.37 5.08 -1.37 -1.95 114.58 118.54 1m1g h GLU 154 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1m1g h GLU 154 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1m1g h GLU 154 CO 0.00 0.00 -0.43 1.63 -1.00 0.00 0.00 179.01 179.22 1m1g n LYS 155 N -2.64 1.07 -2.38 2.33 4.76 -0.92 -4.71 118.16 115.67 1m1g n LYS 155 Ca 0.00 -0.82 -0.42 0.00 -2.87 0.00 0.00 58.31 54.20 1m1g n LYS 155 Cb 0.21 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 31.88 1m1g n LYS 155 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1m1g s THR 156 N -2.50 3.83 0.00 -0.18 2.01 -0.73 -4.99 115.64 113.08 1m1g s THR 156 Ca 0.20 1.37 0.00 0.00 0.31 0.00 0.00 61.69 63.57 1m1g s THR 156 Cb 0.18 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.82 1m1g s THR 156 CO 0.56 0.14 0.00 -2.65 -0.69 0.00 0.00 174.62 171.98 1m1g n PRO 157 N 3.55 0.00 -0.87 4.92 -0.02 -1.26 -1.70 135.00 139.62 1m1g n PRO 157 Ca 0.08 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.38 1m1g n PRO 157 Cb 0.45 0.00 0.08 0.00 -0.02 0.00 0.00 33.50 34.02 1m1g n PRO 157 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1m1g n HIS 158 N 0.00 1.95 -4.68 6.00 8.25 -1.26 -4.87 115.22 120.61 1m1g n HIS 158 Ca 0.00 -1.75 -0.33 0.00 -0.26 0.00 0.00 57.72 55.38 1m1g n HIS 158 Cb 0.00 -0.87 -0.16 0.00 1.12 0.00 0.00 29.99 30.08 1m1g n HIS 158 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1m1g s VAL 159 N -2.47 2.40 -0.76 1.59 1.01 -0.69 0.05 120.40 121.54 1m1g s VAL 159 Ca 0.37 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 1m1g s VAL 159 Cb 0.31 -1.98 0.19 0.00 0.00 0.00 0.00 36.38 34.89 1m1g s VAL 159 CO 0.03 0.53 0.61 0.12 0.00 0.00 0.00 175.10 176.40 1m1g s PHE 160 N 0.73 3.65 0.05 5.22 5.36 0.37 -4.59 117.98 128.77 1m1g s PHE 160 Ca -0.08 -2.91 0.00 0.00 -0.96 0.00 0.00 56.93 52.98 1m1g s PHE 160 Cb -0.16 -3.19 0.00 0.00 -0.34 0.00 0.00 43.02 39.33 1m1g s PHE 160 CO 0.01 -0.77 0.00 2.89 -1.46 0.00 0.00 175.22 175.89 1m1g n ARG 161 N 2.81 -0.37 -3.78 10.12 -4.01 -1.26 -4.03 116.66 116.13 1m1g n ARG 161 Ca 0.15 0.26 -0.27 0.00 -1.04 0.00 0.00 57.85 56.96 1m1g n ARG 161 Cb 0.37 -0.63 -0.03 0.00 -3.04 0.00 0.00 32.46 29.14 1m1g n ARG 161 CO 0.00 0.00 0.00 -2.14 -3.04 0.00 0.00 177.63 172.45 1m1g s PRO 162 N -1.90 3.49 0.11 2.89 0.02 -1.26 -1.69 135.00 136.65 1m1g s PRO 162 Ca 0.00 -0.44 -0.31 0.00 0.02 0.00 0.00 61.00 60.27 1m1g s PRO 162 Cb 0.00 -2.88 -0.10 0.00 0.02 0.00 0.00 34.50 31.54 1m1g s PRO 162 CO 0.00 0.44 1.82 0.08 -0.33 0.00 0.00 177.00 179.01 1m1g s VAL 163 N -1.84 2.61 0.02 3.83 1.01 0.16 -4.81 120.40 121.38 1m1g s VAL 163 Ca 0.37 0.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 1m1g s VAL 163 Cb -0.11 -3.06 -0.00 0.00 0.00 0.00 0.00 36.38 33.21 1m1g s VAL 163 CO 0.29 -0.00 0.12 0.00 0.00 0.00 0.00 175.10 175.51 1m1g s MET 164 N 2.86 0.55 -0.12 2.72 0.23 -1.26 -2.19 119.30 122.08 1m1g s MET 164 Ca 0.81 -0.57 0.03 0.00 -1.03 0.00 0.00 55.69 54.92 1m1g s MET 164 Cb -0.45 0.22 0.01 0.00 -1.53 0.00 0.00 34.83 33.08 1m1g s MET 164 CO 0.36 -0.14 -0.22 0.08 -2.03 0.00 0.00 175.02 173.08 1m1g s VAL 165 N -2.02 1.99 -0.89 5.16 1.01 -0.37 -4.61 120.40 120.67 1m1g s VAL 165 Ca -0.10 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 60.93 1m1g s VAL 165 Cb -0.04 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1m1g s VAL 165 CO -0.02 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1m1g n GLY 166 N 3.92 0.56 2.32 4.51 0.00 -1.26 -2.43 105.19 112.82 1m1g n GLY 166 Ca -0.20 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1m1g n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1g n GLY 167 N -1.44 2.36 3.68 -0.02 0.00 -1.26 -5.02 105.19 103.49 1m1g n GLY 167 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1m1g n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m1g s LYS 168 N -0.27 4.11 0.50 1.61 -0.14 -1.02 -5.01 119.74 119.51 1m1g s LYS 168 Ca 0.00 -0.22 -0.23 0.00 -1.36 0.00 0.00 55.97 54.16 1m1g s LYS 168 Cb 0.00 -3.51 -0.07 0.00 -1.68 0.00 0.00 37.83 32.57 1m1g s LYS 168 CO 0.00 0.11 1.34 -2.30 -0.76 0.00 0.00 175.35 173.74 1m1g n PRO 169 N 4.11 1.85 -3.25 -1.68 -0.02 -1.26 -1.23 135.00 133.52 1m1g n PRO 169 Ca -0.15 0.67 -0.40 0.00 -2.02 0.00 0.00 63.50 61.60 1m1g n PRO 169 Cb 0.52 -2.52 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 1m1g n PRO 169 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1m1g s VAL 170 N -1.26 5.06 0.06 -1.45 1.01 -0.93 -4.81 120.40 118.09 1m1g s VAL 170 Ca 0.67 0.69 -0.31 0.00 0.00 0.00 0.00 61.98 63.04 1m1g s VAL 170 Cb -0.45 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.01 1m1g s VAL 170 CO 0.53 -0.00 1.28 -2.84 0.00 0.00 0.00 175.10 174.07 1m1g s PRO 171 N 2.33 4.38 0.27 2.72 0.02 -1.26 -4.55 135.00 138.90 1m1g s PRO 171 Ca 0.20 1.88 -0.02 0.00 0.02 0.00 0.00 61.00 63.07 1m1g s PRO 171 Cb -0.16 -3.35 -0.05 0.00 0.02 0.00 0.00 34.50 30.97 1m1g s PRO 171 CO 0.11 -0.36 0.49 -0.51 -0.33 0.00 0.00 177.00 176.40 1m1g s LEU 172 N 1.28 4.11 -0.06 -5.54 2.01 0.94 -4.97 118.68 116.46 1m1g s LEU 172 Ca 0.61 0.55 -0.25 0.00 0.01 0.00 0.00 54.13 55.06 1m1g s LEU 172 Cb -0.32 -3.36 -0.03 0.00 0.01 0.00 0.00 46.19 42.49 1m1g s LEU 172 CO 0.29 -0.16 0.76 -0.75 1.01 0.00 0.00 176.35 177.50 1m1g s LYS 173 N -3.59 4.45 0.17 1.70 2.47 -1.26 -3.87 119.74 119.81 1m1g s LYS 173 Ca 0.41 0.99 -0.25 0.00 -1.56 0.00 0.00 55.97 55.56 1m1g s LYS 173 Cb -0.11 -3.46 0.02 0.00 -1.46 0.00 0.00 37.83 32.83 1m1g s LYS 173 CO 0.31 0.01 1.44 -1.91 0.16 0.00 0.00 175.35 175.36 1m1g n GLU 174 N 3.91 -0.35 -0.30 4.03 4.07 -1.26 -1.00 120.64 129.74 1m1g n GLU 174 Ca 0.00 1.42 -0.05 0.00 -0.06 0.00 0.00 57.16 58.47 1m1g n GLU 174 Cb 0.51 -2.09 0.07 0.00 -0.06 0.00 0.00 31.44 29.87 1m1g n GLU 174 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 1m1g h GLU 175 N 0.00 1.19 -0.18 5.31 4.81 -1.99 -2.25 114.58 121.47 1m1g h GLU 175 Ca 0.20 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1m1g h GLU 175 Cb 0.44 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1m1g h GLU 175 CO -0.89 0.92 -0.17 1.49 -0.73 0.00 0.00 179.01 179.64 1m1g h GLU 176 N 1.17 0.31 0.08 1.92 4.57 -1.47 -1.25 114.58 119.91 1m1g h GLU 176 Ca 0.28 -0.08 -0.29 0.00 -1.18 0.00 0.00 59.36 58.09 1m1g h GLU 176 Cb 0.14 -0.03 0.03 0.00 -0.16 0.00 0.00 28.75 28.72 1m1g h GLU 176 CO -0.03 0.48 -1.17 0.28 -1.18 0.00 0.00 179.01 177.38 1m1g h VAL 177 N 0.29 1.28 0.00 0.32 2.07 -0.94 -3.16 116.25 116.11 1m1g h VAL 177 Ca 0.05 -2.38 -0.03 0.00 0.82 0.00 0.00 66.70 65.16 1m1g h VAL 177 Cb 0.47 2.60 -0.00 0.00 -1.52 0.00 0.00 31.29 32.83 1m1g h VAL 177 CO 0.03 0.73 -0.16 0.06 0.02 0.00 0.00 177.57 178.25 1m1g h GLN 178 N 0.30 0.00 0.08 1.57 3.07 -1.23 -1.84 115.11 117.06 1m1g h GLN 178 Ca -0.17 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.57 1m1g h GLN 178 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.40 1m1g h GLN 178 CO 0.23 0.16 -0.04 -0.91 0.09 0.00 0.00 178.83 178.35 1m1g h ASN 179 N 0.00 -0.10 0.63 0.06 2.35 -1.24 0.25 115.58 117.54 1m1g h ASN 179 Ca -0.00 -0.44 -0.06 0.00 -0.55 0.00 0.00 56.30 55.24 1m1g h ASN 179 Cb 0.62 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 1m1g h ASN 179 CO 0.02 0.43 -0.30 0.16 -1.65 0.00 0.00 177.43 176.08 1m1g h ILE 180 N -0.65 0.86 0.00 2.81 -0.00 -1.53 -2.55 117.51 116.45 1m1g h ILE 180 Ca -0.01 -1.20 -0.22 0.00 -0.00 0.00 0.00 64.86 63.43 1m1g h ILE 180 Cb 0.53 1.73 -0.00 0.00 -0.00 0.00 0.00 36.82 39.08 1m1g h ILE 180 CO 0.02 0.30 -0.92 -0.07 -0.00 0.00 0.00 178.15 177.48 1m1g h LEU 181 N 0.00 0.45 -1.58 0.16 3.38 -1.29 -3.01 115.31 113.43 1m1g h LEU 181 Ca -0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1m1g h LEU 181 Cb 0.70 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1m1g h LEU 181 CO 0.04 1.16 0.00 -3.20 0.09 0.00 0.00 178.44 176.53 1m1g n ASN 182 N -3.72 2.11 -0.01 -0.43 4.05 0.87 -2.85 115.26 115.28 1m1g n ASN 182 Ca -0.06 -2.22 -0.01 0.00 0.45 0.00 0.00 54.58 52.74 1m1g n ASN 182 Cb 0.82 -0.52 -0.00 0.00 1.23 0.00 0.00 39.78 41.32 1m1g n ASN 182 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 177.26 175.88 1m1g n GLN 183 N 0.15 0.02 0.28 1.20 0.00 -1.10 -4.04 117.38 113.89 1m1g n GLN 183 Ca 0.07 0.01 0.14 0.00 -0.00 0.00 0.00 57.00 57.22 1m1g n GLN 183 Cb 0.47 -0.73 0.83 0.00 0.00 0.00 0.00 30.24 30.81 1m1g n GLN 183 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.06 176.22 1m1g h ILE 184 N -0.02 0.50 -3.57 1.69 3.07 -1.58 -3.00 117.51 114.60 1m1g h ILE 184 Ca -0.03 -0.31 -0.55 0.00 1.55 0.00 0.00 64.86 65.52 1m1g h ILE 184 Cb 1.03 1.21 -0.20 0.00 -0.27 0.00 0.00 36.82 38.59 1m1g h ILE 184 CO -0.01 0.07 -0.81 -0.75 -1.05 0.00 0.00 178.15 175.60 1m1g s LYS 185 N -4.33 1.24 0.00 0.16 2.20 -1.13 -4.48 119.74 113.39 1m1g s LYS 185 Ca -0.04 -1.31 0.00 0.00 -0.36 0.00 0.00 55.97 54.26 1m1g s LYS 185 Cb 0.14 -1.42 0.00 0.00 -1.51 0.00 0.00 37.83 35.04 1m1g s LYS 185 CO 0.56 0.31 0.00 0.54 -0.36 0.00 0.00 175.35 176.40 1m1g n ARG 186 N 0.64 0.00 -2.23 4.03 3.00 -1.26 -4.38 116.66 116.45 1m1g n ARG 186 Ca -0.16 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.27 1m1g n ARG 186 Cb 0.55 -2.01 -0.03 0.00 0.00 0.00 0.00 32.46 30.98 1m1g n ARG 186 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1m1g s GLY 187 N -0.87 2.93 -0.09 -0.13 0.00 -1.13 -4.97 107.32 103.06 1m1g s GLY 187 Ca 0.00 1.14 -0.30 0.00 0.00 0.00 0.00 44.72 45.56 1m1g s GLY 187 CO 0.00 1.82 1.33 0.14 0.00 0.00 0.00 173.10 176.39 1m1g s VAL 188 N -0.95 4.06 -0.30 1.40 1.01 -1.26 -4.98 120.40 119.37 1m1g s VAL 188 Ca 0.49 1.35 -0.11 0.00 0.00 0.00 0.00 61.98 63.71 1m1g s VAL 188 Cb -0.37 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 1m1g s VAL 188 CO 0.47 -0.06 0.18 -0.54 0.00 0.00 0.00 175.10 175.15 1m1g s LYS 189 N 3.00 3.58 0.22 2.72 1.02 -1.26 -5.06 119.74 123.96 1m1g s LYS 189 Ca 0.59 -0.56 -0.31 0.00 0.02 0.00 0.00 55.97 55.71 1m1g s LYS 189 Cb -0.26 -3.63 -0.11 0.00 -0.52 0.00 0.00 37.83 33.31 1m1g s LYS 189 CO 0.21 -0.33 1.62 -1.25 -0.92 0.00 0.00 175.35 174.68 1m1g s PRO 190 N 1.68 4.17 0.10 -1.68 0.04 -1.26 -4.94 135.00 133.11 1m1g s PRO 190 Ca 0.06 2.50 -0.28 0.00 0.04 0.00 0.00 61.00 63.31 1m1g s PRO 190 Cb -0.17 -3.09 -0.11 0.00 0.04 0.00 0.00 34.50 31.17 1m1g s PRO 190 CO 0.08 -0.65 1.64 0.66 0.04 0.00 0.00 177.00 178.78 1m1g h SER 191 N 6.22 -0.70 -1.23 6.66 4.64 -2.05 -3.45 113.55 123.64 1m1g h SER 191 Ca -0.44 0.07 -0.56 0.00 -0.47 0.00 0.00 61.79 60.39 1m1g h SER 191 Cb 1.21 0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 63.48 1m1g h SER 191 CO 0.89 -0.37 -0.42 -1.59 -0.87 0.00 0.00 176.83 174.47 1m1g s LYS 192 N -6.07 2.29 -0.09 4.77 0.00 -1.26 -5.12 119.74 114.26 1m1g s LYS 192 Ca -0.16 -1.86 -0.15 0.00 0.00 0.00 0.00 55.97 53.80 1m1g s LYS 192 Cb 0.07 -2.06 -0.05 0.00 0.00 0.00 0.00 37.83 35.79 1m1g s LYS 192 CO 0.64 -0.28 0.38 0.08 0.00 0.00 0.00 175.35 176.18 1m1g s VAL 193 N -2.64 5.18 -0.45 1.79 1.01 -1.26 -5.04 120.40 118.98 1m1g s VAL 193 Ca 0.38 0.76 -0.28 0.00 0.00 0.00 0.00 61.98 62.84 1m1g s VAL 193 Cb 0.01 -3.70 0.03 0.00 0.00 0.00 0.00 36.38 32.71 1m1g s VAL 193 CO 0.22 0.45 1.09 -0.70 0.00 0.00 0.00 175.10 176.16 1m1g s GLU 194 N -0.12 3.74 0.00 2.72 2.12 -1.26 -4.59 118.70 121.31 1m1g s GLU 194 Ca 0.22 0.56 0.00 0.00 0.36 0.00 0.00 54.97 56.11 1m1g s GLU 194 Cb -0.15 -3.89 0.00 0.00 0.26 0.00 0.00 34.13 30.35 1m1g s GLU 194 CO 0.09 -1.29 0.00 1.19 -0.54 0.00 0.00 175.26 174.72 1m1g n PHE 195 N 7.59 0.00 -4.48 5.30 0.99 -1.26 -5.06 117.46 120.53 1m1g n PHE 195 Ca 0.11 0.00 -0.23 0.00 -0.00 0.00 0.00 57.45 57.33 1m1g n PHE 195 Cb 0.49 0.00 -0.16 0.00 -1.00 0.00 0.00 39.48 38.81 1m1g n PHE 195 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.76 174.93 1m1g s GLU 196 N -0.84 1.32 0.00 -1.08 -1.05 -1.26 -4.86 118.70 110.93 1m1g s GLU 196 Ca 0.00 -0.35 0.00 0.00 -0.15 0.00 0.00 54.97 54.47 1m1g s GLU 196 Cb 0.00 -1.16 0.00 0.00 -0.44 0.00 0.00 34.13 32.53 1m1g s GLU 196 CO 0.00 0.06 0.00 1.17 0.95 0.00 0.00 175.26 177.44 1m1g n LYS 197 N 3.60 0.00 -0.48 -4.83 0.00 -1.26 -2.24 118.16 112.95 1m1g n LYS 197 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.10 1m1g n LYS 197 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.56 1m1g n LYS 197 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1m1g n GLY 198 N 0.00 0.93 3.73 3.14 0.00 0.13 -5.00 105.19 108.14 1m1g n GLY 198 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1m1g n GLY 198 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m1g s ASP 199 N -3.02 7.07 -0.18 1.61 1.01 -0.95 -4.68 116.67 117.53 1m1g s ASP 199 Ca 0.00 2.21 -0.24 0.00 0.71 0.00 0.00 52.55 55.23 1m1g s ASP 199 Cb 0.00 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.31 1m1g s ASP 199 CO 0.00 -0.40 0.77 -1.10 0.21 0.00 0.00 175.17 174.65 1m1g s GLN 200 N 0.03 4.27 0.16 8.23 -1.52 -1.26 -0.04 119.66 129.52 1m1g s GLN 200 Ca 0.54 0.90 0.03 0.00 -1.95 0.00 0.00 55.36 54.88 1m1g s GLN 200 Cb -0.32 -3.58 -0.05 0.00 -0.22 0.00 0.00 33.01 28.84 1m1g s GLN 200 CO 0.35 -0.31 -0.05 0.14 -0.25 0.00 0.00 175.29 175.17 1m1g s VAL 201 N 2.10 0.91 -0.02 1.09 -7.23 -0.48 0.68 120.40 117.44 1m1g s VAL 201 Ca 0.35 -2.01 0.06 0.00 -1.81 0.00 0.00 61.98 58.58 1m1g s VAL 201 Cb -0.16 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.80 1m1g s VAL 201 CO 0.12 -0.63 -0.22 -0.60 -0.31 0.00 0.00 175.10 173.45 1m1g s ARG 202 N -3.83 1.85 0.01 4.82 3.52 0.49 -1.72 118.95 124.09 1m1g s ARG 202 Ca 0.19 -0.78 -0.30 0.00 -0.13 0.00 0.00 55.73 54.72 1m1g s ARG 202 Cb 0.05 -1.74 -0.04 0.00 -1.56 0.00 0.00 34.95 31.66 1m1g s ARG 202 CO 0.02 0.44 1.04 0.08 -0.81 0.00 0.00 175.30 176.06 1m1g s VAL 203 N -0.42 4.66 -0.14 7.11 1.01 -0.48 -0.69 120.40 131.45 1m1g s VAL 203 Ca 0.06 1.91 0.17 0.00 0.00 0.00 0.00 61.98 64.11 1m1g s VAL 203 Cb -0.09 -4.22 0.30 0.00 0.00 0.00 0.00 36.38 32.36 1m1g s VAL 203 CO -0.00 0.14 1.18 2.30 0.00 0.00 0.00 175.10 178.72 1m1g n ILE 204 N 3.93 1.85 -3.64 2.22 -5.35 -0.69 -0.07 119.36 117.60 1m1g n ILE 204 Ca 0.07 -2.07 -0.08 0.00 -0.27 0.00 0.00 62.75 60.40 1m1g n ILE 204 Cb 0.50 -0.16 -0.07 0.00 -1.74 0.00 0.00 39.64 38.17 1m1g n ILE 204 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1m1g s GLU 205 N -2.66 0.42 0.41 6.28 -6.30 -1.24 -4.96 118.70 110.65 1m1g s GLU 205 Ca 0.30 0.51 0.00 0.00 -2.50 0.00 0.00 54.97 53.28 1m1g s GLU 205 Cb 0.26 0.20 0.00 0.00 0.00 0.00 0.00 34.13 34.59 1m1g s GLU 205 CO 0.04 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 175.68 1m1g n GLY 206 N 2.15 -1.82 0.34 -1.50 0.00 -1.26 -4.50 105.19 98.61 1m1g n GLY 206 Ca -0.12 -1.82 0.16 0.00 0.00 0.00 0.00 46.02 44.23 1m1g n GLY 206 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m1g h PRO 207 N 0.00 0.04 -0.98 1.61 0.13 -2.02 -2.64 132.00 128.15 1m1g h PRO 207 Ca 0.00 -0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.61 1m1g h PRO 207 Cb 0.00 -0.01 -0.30 0.00 0.13 0.00 0.00 31.00 30.82 1m1g h PRO 207 CO 0.00 0.03 0.64 1.19 -0.23 0.00 0.00 178.00 179.63 1m1g n PHE 208 N -4.44 3.02 -1.67 1.56 3.01 -1.26 -5.01 117.46 112.67 1m1g n PHE 208 Ca 0.06 -1.88 -0.46 0.00 1.01 0.00 0.00 57.45 56.18 1m1g n PHE 208 Cb 0.43 -0.95 -0.04 0.00 -0.01 0.00 0.00 39.48 38.90 1m1g n PHE 208 CO 0.00 0.00 0.00 -0.12 1.01 0.00 0.00 176.76 177.65 1m1g n MET 209 N -1.14 2.18 -0.99 -1.08 1.56 -1.00 -1.19 117.12 115.46 1m1g n MET 209 Ca 0.59 0.79 0.00 0.00 -0.27 0.00 0.00 57.70 58.81 1m1g n MET 209 Cb 1.63 -2.58 0.00 0.00 2.15 0.00 0.00 33.22 34.41 1m1g n MET 209 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 1m1g n ASN 210 N 4.32 -1.03 -4.73 6.12 5.15 0.89 -4.97 115.26 121.02 1m1g n ASN 210 Ca 0.18 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.75 1m1g n ASN 210 Cb 0.29 -0.26 -0.04 0.00 -0.53 0.00 0.00 39.78 39.23 1m1g n ASN 210 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1m1g s PHE 211 N -3.25 3.81 0.28 1.20 0.40 -0.33 -4.73 117.98 115.36 1m1g s PHE 211 Ca 0.00 1.78 0.02 0.00 -0.60 0.00 0.00 56.93 58.13 1m1g s PHE 211 Cb 0.00 -3.04 -0.03 0.00 0.51 0.00 0.00 43.02 40.46 1m1g s PHE 211 CO 0.00 0.22 0.45 0.95 0.70 0.00 0.00 175.22 177.54 1m1g s THR 212 N -0.04 5.19 -0.13 0.64 -4.23 -1.26 -1.38 115.64 114.42 1m1g s THR 212 Ca 0.46 -0.69 -0.33 0.00 -1.18 0.00 0.00 61.69 59.96 1m1g s THR 212 Cb -0.23 -3.85 0.13 0.00 1.34 0.00 0.00 72.50 69.89 1m1g s THR 212 CO 0.29 -0.42 1.10 -0.83 -0.54 0.00 0.00 174.62 174.23 1m1g s GLY 213 N -3.92 -0.33 -0.25 3.99 0.00 -0.70 -4.43 107.32 101.68 1m1g s GLY 213 Ca 0.37 1.51 -0.16 0.00 0.00 0.00 0.00 44.72 46.44 1m1g s GLY 213 CO 0.32 0.54 0.40 -1.59 0.00 0.00 0.00 173.10 172.77 1m1g s THR 214 N -2.47 5.16 0.23 0.90 2.01 -1.02 -1.39 115.64 119.07 1m1g s THR 214 Ca 0.07 0.65 -0.32 0.00 0.31 0.00 0.00 61.69 62.41 1m1g s THR 214 Cb -0.01 -3.73 -0.12 0.00 0.01 0.00 0.00 72.50 68.65 1m1g s THR 214 CO -0.06 0.16 1.65 0.52 -0.69 0.00 0.00 174.62 176.21 1m1g n VAL 215 N 4.97 0.33 -3.95 3.82 0.31 0.94 -1.22 118.33 123.52 1m1g n VAL 215 Ca -0.08 -0.08 -0.25 0.00 -0.01 0.00 0.00 64.34 63.92 1m1g n VAL 215 Cb 0.51 -1.88 -0.17 0.00 -0.91 0.00 0.00 33.84 31.39 1m1g n VAL 215 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1m1g s GLU 216 N 0.59 1.23 -0.01 5.55 2.56 0.22 0.23 118.70 129.07 1m1g s GLU 216 Ca 0.72 -0.15 -0.02 0.00 0.00 0.00 0.00 54.97 55.52 1m1g s GLU 216 Cb -0.54 -1.34 0.01 0.00 2.00 0.00 0.00 34.13 34.26 1m1g s GLU 216 CO 0.38 -0.24 0.03 -1.91 -0.56 0.00 0.00 175.26 172.97 1m1g n GLU 217 N 4.82 -3.97 -4.12 4.30 2.13 -1.26 -3.47 120.64 119.08 1m1g n GLU 217 Ca -0.13 3.01 -0.35 0.00 0.66 0.00 0.00 57.16 60.34 1m1g n GLU 217 Cb 0.50 -3.84 -0.09 0.00 0.27 0.00 0.00 31.44 28.28 1m1g n GLU 217 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1m1g s VAL 218 N -0.47 4.77 -0.85 6.31 1.01 -1.26 -2.76 120.40 127.14 1m1g s VAL 218 Ca -0.04 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.80 1m1g s VAL 218 Cb 0.00 -3.08 0.22 0.00 0.00 0.00 0.00 36.38 33.52 1m1g s VAL 218 CO 0.10 0.56 0.77 -1.00 0.00 0.00 0.00 175.10 175.52 1m1g s HIS 219 N -0.47 3.81 -0.22 5.22 0.09 -0.89 -5.04 115.29 117.79 1m1g s HIS 219 Ca 0.10 -2.51 -0.39 0.00 -0.00 0.00 0.00 55.06 52.26 1m1g s HIS 219 Cb -0.12 -3.57 -0.18 0.00 -0.00 0.00 0.00 32.58 28.71 1m1g s HIS 219 CO 0.02 -0.90 1.19 -2.30 -0.00 0.00 0.00 174.74 172.75 1m1g n PRO 220 N 3.28 0.00 -0.13 8.40 -0.02 -1.26 -1.06 135.00 144.20 1m1g n PRO 220 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1m1g n PRO 220 Cb 0.41 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 1m1g n PRO 220 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1m1g n GLU 221 N 2.44 0.00 0.00 -0.52 -0.58 -1.26 -4.48 120.64 116.24 1m1g n GLU 221 Ca 0.23 0.00 0.15 0.00 -0.42 0.00 0.00 57.16 57.12 1m1g n GLU 221 Cb 0.01 -3.54 0.75 0.00 -0.57 0.00 0.00 31.44 28.09 1m1g n GLU 221 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1m1g n LYS 222 N -1.63 0.86 -3.99 3.49 5.02 -0.23 -4.86 118.16 116.82 1m1g n LYS 222 Ca 0.00 -0.19 -0.32 0.00 -2.02 0.00 0.00 58.31 55.78 1m1g n LYS 222 Cb 0.00 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.47 1m1g n LYS 222 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1m1g n ARG 223 N -0.90 -2.21 -4.54 1.97 1.74 -1.11 -4.93 116.66 106.68 1m1g n ARG 223 Ca 0.18 0.25 -0.29 0.00 -0.77 0.00 0.00 57.85 57.22 1m1g n ARG 223 Cb 0.22 -4.89 -0.13 0.00 -1.02 0.00 0.00 32.46 26.63 1m1g n ARG 223 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1m1g s LYS 224 N -6.66 1.55 0.02 5.56 -0.14 -1.24 -0.87 119.74 117.96 1m1g s LYS 224 Ca 0.63 -1.26 0.02 0.00 -1.36 0.00 0.00 55.97 54.00 1m1g s LYS 224 Cb -0.36 -1.94 -0.01 0.00 -1.68 0.00 0.00 37.83 33.84 1m1g s LYS 224 CO 0.78 0.47 -0.07 -0.51 -0.76 0.00 0.00 175.35 175.26 1m1g s LEU 225 N -1.81 2.12 -0.49 3.17 1.43 0.42 -2.09 118.68 121.43 1m1g s LEU 225 Ca 0.14 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.88 1m1g s LEU 225 Cb -0.10 -0.26 0.13 0.00 0.03 0.00 0.00 46.19 45.99 1m1g s LEU 225 CO 0.05 -0.04 0.32 -0.89 0.23 0.00 0.00 176.35 176.01 1m1g s THR 226 N -0.69 3.70 -0.07 5.49 2.01 -1.11 -0.38 115.64 124.59 1m1g s THR 226 Ca -0.03 -2.22 -0.04 0.00 0.31 0.00 0.00 61.69 59.72 1m1g s THR 226 Cb -0.06 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.94 1m1g s THR 226 CO 0.00 -0.77 0.11 0.68 -0.69 0.00 0.00 174.62 173.96 1m1g s VAL 227 N 0.88 5.14 -0.53 3.82 -7.23 -0.88 0.72 120.40 122.32 1m1g s VAL 227 Ca 0.10 -0.06 -0.21 0.00 -1.81 0.00 0.00 61.98 60.00 1m1g s VAL 227 Cb -0.23 -3.28 0.06 0.00 0.56 0.00 0.00 36.38 33.49 1m1g s VAL 227 CO -0.03 0.51 0.74 -0.04 -0.31 0.00 0.00 175.10 175.96 1m1g s MET 228 N -1.32 3.17 -0.16 4.82 -1.94 -0.36 -0.96 119.30 122.56 1m1g s MET 228 Ca 0.19 -0.74 -0.02 0.00 -1.71 0.00 0.00 55.69 53.40 1m1g s MET 228 Cb -0.12 -4.10 -0.02 0.00 2.01 0.00 0.00 34.83 32.60 1m1g s MET 228 CO 0.09 -1.35 -0.08 0.42 -0.01 0.00 0.00 175.02 174.09 1m1g s ILE 229 N 3.09 3.43 -0.40 2.53 1.01 -0.79 -2.42 121.20 127.64 1m1g s ILE 229 Ca 0.19 -0.51 -0.29 0.00 0.00 0.00 0.00 60.65 60.04 1m1g s ILE 229 Cb -0.18 -2.49 0.02 0.00 0.01 0.00 0.00 42.46 39.82 1m1g s ILE 229 CO 0.13 0.49 1.21 -0.55 0.00 0.00 0.00 174.94 176.22 1m1g s SER 230 N 0.63 6.64 -0.24 3.58 0.15 -1.26 0.54 113.70 123.74 1m1g s SER 230 Ca -0.04 0.80 0.01 0.00 0.70 0.00 0.00 55.95 57.41 1m1g s SER 230 Cb -0.15 -2.54 0.04 0.00 -1.71 0.00 0.00 66.02 61.66 1m1g s SER 230 CO 0.03 -1.18 -0.12 -0.63 1.20 0.00 0.00 173.24 172.53 1m1g s ILE 231 N 4.48 2.31 -1.36 6.45 1.01 -0.81 -4.51 121.20 128.76 1m1g s ILE 231 Ca 0.52 -1.30 0.00 0.00 0.00 0.00 0.00 60.65 59.86 1m1g s ILE 231 Cb -0.11 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.15 1m1g s ILE 231 CO 0.27 0.18 0.00 0.49 0.00 0.00 0.00 174.94 175.88 1m1g n PHE 232 N 4.54 -0.73 -0.87 3.97 3.72 -1.26 -2.08 117.46 124.74 1m1g n PHE 232 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1m1g n PHE 232 Cb 0.45 -3.24 0.00 0.00 -0.94 0.00 0.00 39.48 35.75 1m1g n PHE 232 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1m1g n GLY 233 N -1.02 0.73 3.22 1.37 0.00 -1.26 -5.02 105.19 103.21 1m1g n GLY 233 Ca -0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1m1g n GLY 233 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m1g s ARG 234 N -0.13 2.50 -0.28 1.61 3.52 -0.88 -5.02 118.95 120.26 1m1g s ARG 234 Ca 0.00 -1.26 -0.33 0.00 -0.13 0.00 0.00 55.73 54.01 1m1g s ARG 234 Cb 0.00 -3.35 -0.09 0.00 -1.56 0.00 0.00 34.95 29.94 1m1g s ARG 234 CO 0.00 -0.68 2.17 -1.33 -0.81 0.00 0.00 175.30 174.65 1m1g n MET 235 N 4.72 1.45 -4.06 5.12 2.81 -1.26 -1.93 117.12 123.97 1m1g n MET 235 Ca -0.12 0.41 -0.33 0.00 -1.81 0.00 0.00 57.70 55.85 1m1g n MET 235 Cb 0.44 -2.72 -0.15 0.00 -0.71 0.00 0.00 33.22 30.08 1m1g n MET 235 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1m1g s THR 236 N 7.33 2.39 -0.24 2.03 2.01 0.19 -4.88 115.64 124.46 1m1g s THR 236 Ca 1.05 -0.99 -0.29 0.00 0.31 0.00 0.00 61.69 61.77 1m1g s THR 236 Cb -0.68 -2.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.70 1m1g s THR 236 CO 0.45 0.39 1.61 -2.16 -0.69 0.00 0.00 174.62 174.22 1m1g s PRO 237 N 1.30 3.75 -0.08 4.92 0.04 -1.26 -1.89 135.00 141.78 1m1g s PRO 237 Ca 0.02 1.60 0.02 0.00 0.04 0.00 0.00 61.00 62.69 1m1g s PRO 237 Cb -0.15 -4.04 -0.02 0.00 0.04 0.00 0.00 34.50 30.33 1m1g s PRO 237 CO -0.09 -1.34 -0.13 0.54 0.04 0.00 0.00 177.00 176.01 1m1g s VAL 238 N 5.32 3.14 -0.10 -0.36 0.11 -0.13 -4.91 120.40 123.46 1m1g s VAL 238 Ca 0.71 -0.67 -0.30 0.00 -2.93 0.00 0.00 61.98 58.80 1m1g s VAL 238 Cb -0.24 -2.27 -0.01 0.00 -1.53 0.00 0.00 36.38 32.33 1m1g s VAL 238 CO 0.29 0.57 1.03 -1.61 -3.33 0.00 0.00 175.10 172.05 1m1g s GLU 239 N -0.34 4.42 -0.14 1.54 8.01 -1.26 -2.08 118.70 128.85 1m1g s GLU 239 Ca 0.03 1.43 -0.15 0.00 0.01 0.00 0.00 54.97 56.29 1m1g s GLU 239 Cb -0.13 -3.54 0.04 0.00 -4.31 0.00 0.00 34.13 26.19 1m1g s GLU 239 CO 0.02 -0.33 0.42 -0.51 0.01 0.00 0.00 175.26 174.87 1m1g s LEU 240 N 2.02 0.40 0.74 1.80 1.43 0.49 -4.95 118.68 120.61 1m1g s LEU 240 Ca 0.49 0.78 -0.12 0.00 -1.03 0.00 0.00 54.13 54.25 1m1g s LEU 240 Cb -0.19 1.46 0.04 0.00 0.03 0.00 0.00 46.19 47.53 1m1g s LEU 240 CO 0.19 -0.19 1.10 -1.81 0.23 0.00 0.00 176.35 175.87 1m1g s ASP 241 N 0.04 4.65 0.29 2.29 -0.00 -1.26 0.16 116.67 122.84 1m1g s ASP 241 Ca -0.02 1.90 0.03 0.00 -0.00 0.00 0.00 52.55 54.46 1m1g s ASP 241 Cb -0.03 -2.53 0.63 0.00 -0.00 0.00 0.00 42.92 40.99 1m1g s ASP 241 CO 0.01 -1.94 1.79 -0.26 -0.00 0.00 0.00 175.17 174.78 1m1g h PHE 242 N -0.76 1.04 -0.00 4.23 -1.00 -1.32 -0.47 116.94 118.66 1m1g h PHE 242 Ca -0.45 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.37 1m1g h PHE 242 Cb 1.24 -0.32 0.00 0.00 3.61 0.00 0.00 35.95 40.48 1m1g h PHE 242 CO 0.56 0.30 -0.00 -0.40 -1.61 0.00 0.00 178.31 177.17 1m1g n ASP 243 N -4.73 0.16 -0.74 2.17 3.85 -1.26 -2.88 116.55 113.11 1m1g n ASP 243 Ca 0.21 -1.02 0.13 0.00 -0.71 0.00 0.00 54.79 53.39 1m1g n ASP 243 Cb 0.47 -0.01 0.32 0.00 -1.35 0.00 0.00 41.12 40.54 1m1g n ASP 243 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1m1g n GLN 244 N -0.89 2.01 -4.05 0.11 6.02 -0.19 -4.88 117.38 115.52 1m1g n GLN 244 Ca 0.23 -1.48 -0.08 0.00 -0.01 0.00 0.00 57.00 55.66 1m1g n GLN 244 Cb 0.14 -1.47 -0.09 0.00 1.02 0.00 0.00 30.24 29.84 1m1g n GLN 244 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1m1g s VAL 245 N -1.92 0.16 0.01 5.09 0.11 -1.14 -1.71 120.40 121.00 1m1g s VAL 245 Ca 0.34 -1.68 -0.01 0.00 -2.93 0.00 0.00 61.98 57.71 1m1g s VAL 245 Cb 0.20 -1.64 -0.01 0.00 -1.53 0.00 0.00 36.38 33.40 1m1g s VAL 245 CO 0.31 -0.74 -0.00 -1.83 -3.33 0.00 0.00 175.10 169.51 1m1g s GLU 246 N -3.94 0.18 0.57 1.54 -1.05 0.13 -4.88 118.70 111.26 1m1g s GLU 246 Ca 0.12 -0.30 -0.20 0.00 -0.15 0.00 0.00 54.97 54.44 1m1g s GLU 246 Cb 0.07 0.07 -0.04 0.00 -0.44 0.00 0.00 34.13 33.78 1m1g s GLU 246 CO -0.06 -0.03 1.23 0.15 0.95 0.00 0.00 175.26 177.50 1m1g s LYS 247 N -0.77 3.07 0.00 -4.83 1.02 -1.26 -0.38 119.74 116.59 1m1g s LYS 247 Ca -0.08 1.90 0.00 0.00 0.02 0.00 0.00 55.97 57.81 1m1g s LYS 247 Cb -0.05 -2.03 0.00 0.00 -0.52 0.00 0.00 37.83 35.22 1m1g s LYS 247 CO -0.00 -1.15 0.00 0.44 -0.92 0.00 0.00 175.35 173.72