#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qqc s ILE 2 N 0.00 4.65 -0.10 1.12 1.01 -1.26 -1.55 121.20 125.07 1qqc s ILE 2 Ca 0.00 1.96 -0.06 0.00 0.00 0.00 0.00 60.65 62.55 1qqc s ILE 2 Cb 0.00 -4.26 -0.27 0.00 0.01 0.00 0.00 42.46 37.94 1qqc s ILE 2 CO 0.00 -0.10 0.45 -0.07 0.00 0.00 0.00 174.94 175.22 1qqc h LEU 3 N 8.88 0.43 -7.67 2.97 3.38 -1.28 -1.78 115.31 120.24 1qqc h LEU 3 Ca -0.25 -0.90 0.37 0.00 0.09 0.00 0.00 57.88 57.19 1qqc h LEU 3 Cb 1.10 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.62 1qqc h LEU 3 CO 0.93 1.80 0.93 -0.62 0.09 0.00 0.00 178.44 181.57 1qqc s ASP 4 N -7.04 -0.01 -0.02 -0.43 3.68 -1.20 -4.55 116.67 107.11 1qqc s ASP 4 Ca -0.20 -0.11 -0.14 0.00 2.13 0.00 0.00 52.55 54.22 1qqc s ASP 4 Cb 0.06 0.09 0.02 0.00 -1.45 0.00 0.00 42.92 41.65 1qqc s ASP 4 CO 0.79 -0.18 0.31 0.00 0.13 0.00 0.00 175.17 176.22 1qqc s ALA 5 N -2.09 -0.78 0.00 3.66 0.00 -1.26 -1.02 121.76 120.27 1qqc s ALA 5 Ca 0.25 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.59 1qqc s ALA 5 Cb 0.02 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.16 1qqc s ALA 5 CO -0.03 -0.25 0.00 -0.40 0.00 0.00 0.00 175.76 175.08 1qqc n ASP 6 N 1.43 0.00 -3.45 0.00 5.75 -0.88 -4.90 116.55 114.50 1qqc n ASP 6 Ca -0.21 0.00 -0.12 0.00 -0.01 0.00 0.00 54.79 54.46 1qqc n ASP 6 Cb 0.56 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.63 1qqc n ASP 6 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1qqc s TYR 7 N -2.28 -0.50 0.39 2.11 -0.85 -1.26 -1.95 117.35 113.01 1qqc s TYR 7 Ca 0.00 0.38 0.04 0.00 -0.52 0.00 0.00 57.07 56.97 1qqc s TYR 7 Cb 0.00 0.54 -0.03 0.00 0.38 0.00 0.00 41.96 42.85 1qqc s TYR 7 CO 0.00 -0.75 0.15 0.96 -1.52 0.00 0.00 175.55 174.39 1qqc s ILE 8 N -3.31 0.51 -0.03 -3.49 -4.36 -0.73 -4.95 121.20 104.84 1qqc s ILE 8 Ca 0.01 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.41 1qqc s ILE 8 Cb -0.01 -2.37 0.02 0.00 1.25 0.00 0.00 42.46 41.34 1qqc s ILE 8 CO -0.10 0.00 -0.03 -0.89 0.24 0.00 0.00 174.94 174.16 1qqc s THR 9 N -3.26 0.39 -0.12 8.37 2.01 -1.26 -1.03 115.64 120.75 1qqc s THR 9 Ca 0.26 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.20 1qqc s THR 9 Cb 0.03 -0.42 0.02 0.00 0.01 0.00 0.00 72.50 72.14 1qqc s THR 9 CO 0.16 0.17 -0.14 -1.61 -0.69 0.00 0.00 174.62 172.51 1qqc s GLU 10 N 0.70 2.18 -1.55 4.92 2.02 -0.68 -4.78 118.70 121.50 1qqc s GLU 10 Ca -0.08 -0.54 -0.15 0.00 0.02 0.00 0.00 54.97 54.23 1qqc s GLU 10 Cb -0.11 -1.92 0.10 0.00 0.10 0.00 0.00 34.13 32.30 1qqc s GLU 10 CO -0.00 -0.12 0.86 -0.25 0.02 0.00 0.00 175.26 175.76 1qqc n ASP 11 N 4.40 -4.32 0.00 -0.19 10.43 -1.26 -1.83 116.55 123.78 1qqc n ASP 11 Ca -0.18 -0.78 0.00 0.00 2.57 0.00 0.00 54.79 56.40 1qqc n ASP 11 Cb 0.51 -3.48 0.00 0.00 1.84 0.00 0.00 41.12 39.99 1qqc n ASP 11 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1qqc n GLY 12 N -1.53 0.87 3.41 0.44 0.00 -1.26 -5.06 105.19 102.06 1qqc n GLY 12 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 1qqc n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qqc s LYS 13 N -0.20 2.38 0.43 1.61 1.02 -0.76 -4.54 119.74 119.68 1qqc s LYS 13 Ca 0.00 -0.79 -0.22 0.00 0.02 0.00 0.00 55.97 54.98 1qqc s LYS 13 Cb 0.00 -2.25 -0.09 0.00 -0.52 0.00 0.00 37.83 34.97 1qqc s LYS 13 CO 0.00 0.58 1.01 -1.25 -0.92 0.00 0.00 175.35 174.78 1qqc s PRO 14 N -0.65 4.07 -0.10 -1.68 0.04 -1.26 -1.69 135.00 133.73 1qqc s PRO 14 Ca 0.10 1.35 -0.02 0.00 0.04 0.00 0.00 61.00 62.47 1qqc s PRO 14 Cb -0.11 -2.30 0.03 0.00 0.04 0.00 0.00 34.50 32.16 1qqc s PRO 14 CO 0.00 -0.20 0.01 0.08 0.04 0.00 0.00 177.00 176.93 1qqc s VAL 15 N -1.90 0.38 0.27 -0.36 1.01 -0.19 -4.75 120.40 114.86 1qqc s VAL 15 Ca 0.62 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.30 1qqc s VAL 15 Cb -0.17 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 35.50 1qqc s VAL 15 CO 0.21 0.16 0.99 -0.63 0.00 0.00 0.00 175.10 175.83 1qqc s ILE 16 N 1.96 3.91 -0.12 2.22 -1.09 -0.73 -1.77 121.20 125.58 1qqc s ILE 16 Ca 0.04 1.85 0.01 0.00 -2.23 0.00 0.00 60.65 60.31 1qqc s ILE 16 Cb -0.13 -4.15 0.02 0.00 -1.58 0.00 0.00 42.46 36.62 1qqc s ILE 16 CO -0.06 0.38 -0.12 -0.13 -1.23 0.00 0.00 174.94 173.78 1qqc s ARG 17 N -1.45 2.00 -0.25 2.79 0.52 -0.82 -1.73 118.95 120.02 1qqc s ARG 17 Ca 0.44 -0.46 -0.05 0.00 -0.52 0.00 0.00 55.73 55.14 1qqc s ARG 17 Cb -0.26 -1.84 -0.00 0.00 0.52 0.00 0.00 34.95 33.36 1qqc s ARG 17 CO 0.33 -0.18 0.01 0.08 0.02 0.00 0.00 175.30 175.56 1qqc s VAL 18 N 1.36 3.69 -0.30 3.52 1.01 -0.59 -2.08 120.40 127.01 1qqc s VAL 18 Ca 0.01 -0.53 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 1qqc s VAL 18 Cb -0.13 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 1qqc s VAL 18 CO -0.07 0.29 0.65 -0.36 0.00 0.00 0.00 175.10 175.62 1qqc s PHE 19 N 1.50 3.22 0.31 5.22 0.40 -0.19 -1.74 117.98 126.71 1qqc s PHE 19 Ca 0.04 0.63 0.10 0.00 -0.60 0.00 0.00 56.93 57.11 1qqc s PHE 19 Cb -0.15 -3.01 -0.05 0.00 0.51 0.00 0.00 43.02 40.32 1qqc s PHE 19 CO -0.00 -0.47 -0.04 0.15 0.70 0.00 0.00 175.22 175.55 1qqc s LYS 20 N 2.65 2.03 -0.35 0.44 1.02 -0.42 -0.73 119.74 124.38 1qqc s LYS 20 Ca 0.26 -1.69 0.00 0.00 0.02 0.00 0.00 55.97 54.56 1qqc s LYS 20 Cb -0.15 -1.93 0.14 0.00 -0.52 0.00 0.00 37.83 35.37 1qqc s LYS 20 CO 0.12 0.22 0.25 0.21 -0.92 0.00 0.00 175.35 175.22 1qqc s LYS 21 N -3.66 0.52 -0.09 1.68 2.36 -0.60 -1.45 119.74 118.51 1qqc s LYS 21 Ca 0.33 -1.10 0.02 0.00 -2.55 0.00 0.00 55.97 52.67 1qqc s LYS 21 Cb -0.02 -1.12 0.01 0.00 -1.05 0.00 0.00 37.83 35.65 1qqc s LYS 21 CO 0.18 -1.18 -0.15 -1.83 1.55 0.00 0.00 175.35 173.92 1qqc s GLU 22 N 1.30 2.16 -1.33 4.03 -1.05 -0.91 -2.36 118.70 120.54 1qqc s GLU 22 Ca 0.17 -0.56 -0.00 0.00 -0.15 0.00 0.00 54.97 54.43 1qqc s GLU 22 Cb -0.20 -1.77 0.00 0.00 -0.44 0.00 0.00 34.13 31.72 1qqc s GLU 22 CO -0.05 0.01 0.64 1.63 0.95 0.00 0.00 175.26 178.44 1qqc n LYS 23 N 3.95 -4.55 0.00 -4.83 5.02 -1.26 -3.04 118.16 113.44 1qqc n LYS 23 Ca -0.20 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1qqc n LYS 23 Cb 0.52 -5.03 0.00 0.00 -0.02 0.00 0.00 35.03 30.49 1qqc n LYS 23 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qqc n GLY 24 N -1.66 3.10 3.52 0.72 0.00 -1.26 -5.05 105.19 104.56 1qqc n GLY 24 Ca -0.30 -0.87 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 1qqc n GLY 24 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qqc s GLU 25 N 0.00 1.90 0.30 1.61 -1.05 -1.17 -5.11 118.70 115.19 1qqc s GLU 25 Ca 0.00 -1.21 -0.28 0.00 -0.15 0.00 0.00 54.97 53.33 1qqc s GLU 25 Cb 0.00 -2.14 -0.09 0.00 -0.44 0.00 0.00 34.13 31.46 1qqc s GLU 25 CO 0.00 0.46 1.08 0.12 0.95 0.00 0.00 175.26 177.87 1qqc s PHE 26 N -1.37 3.55 0.05 4.83 5.36 -1.26 -2.15 117.98 126.99 1qqc s PHE 26 Ca 0.21 1.71 -0.02 0.00 -0.96 0.00 0.00 56.93 57.86 1qqc s PHE 26 Cb -0.10 -3.23 -0.03 0.00 -0.34 0.00 0.00 43.02 39.32 1qqc s PHE 26 CO 0.12 -0.49 0.00 0.15 -1.46 0.00 0.00 175.22 173.55 1qqc s LYS 27 N -1.63 0.62 -0.22 10.12 1.02 -0.53 -4.97 119.74 124.15 1qqc s LYS 27 Ca 0.47 -1.13 -0.03 0.00 0.02 0.00 0.00 55.97 55.30 1qqc s LYS 27 Cb -0.30 0.22 0.07 0.00 -0.52 0.00 0.00 37.83 37.31 1qqc s LYS 27 CO 0.38 -0.13 0.07 0.42 -0.92 0.00 0.00 175.35 175.17 1qqc s ILE 28 N -3.69 0.37 -0.02 2.17 1.01 -1.26 -1.30 121.20 118.48 1qqc s ILE 28 Ca 0.05 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.81 1qqc s ILE 28 Cb 0.06 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 1qqc s ILE 28 CO -0.09 -0.37 0.76 -1.81 0.00 0.00 0.00 174.94 173.43 1qqc s ASP 29 N 1.91 7.12 0.16 3.58 1.01 -0.71 -4.90 116.67 124.84 1qqc s ASP 29 Ca 0.03 1.34 0.06 0.00 0.71 0.00 0.00 52.55 54.68 1qqc s ASP 29 Cb -0.17 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1qqc s ASP 29 CO -0.15 -0.09 0.09 -0.31 0.21 0.00 0.00 175.17 174.91 1qqc s TYR 30 N 0.55 3.05 -0.22 4.23 1.51 -1.26 -1.55 117.35 123.66 1qqc s TYR 30 Ca 0.40 -0.05 -0.04 0.00 -1.01 0.00 0.00 57.07 56.37 1qqc s TYR 30 Cb -0.19 -1.47 0.11 0.00 -0.11 0.00 0.00 41.96 40.30 1qqc s TYR 30 CO 0.21 0.52 0.31 0.34 -1.11 0.00 0.00 175.55 175.82 1qqc s ASP 31 N -3.02 0.70 0.00 2.29 -1.08 -0.70 -4.98 116.67 109.88 1qqc s ASP 31 Ca 0.30 0.10 0.24 0.00 -0.52 0.00 0.00 52.55 52.66 1qqc s ASP 31 Cb -0.10 0.79 0.65 0.00 -1.46 0.00 0.00 42.92 42.80 1qqc s ASP 31 CO 0.22 -0.30 1.51 0.54 0.52 0.00 0.00 175.17 177.65 1qqc n ARG 32 N 5.35 2.00 -0.62 4.34 1.74 -1.26 -1.77 116.66 126.42 1qqc n ARG 32 Ca -0.05 -1.48 0.01 0.00 -0.77 0.00 0.00 57.85 55.57 1qqc n ARG 32 Cb 0.50 -1.46 0.20 0.00 -1.02 0.00 0.00 32.46 30.69 1qqc n ARG 32 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1qqc n ASP 33 N 0.74 2.51 -4.87 0.55 8.00 -1.26 -4.95 116.55 117.27 1qqc n ASP 33 Ca 0.17 -3.61 -0.37 0.00 0.71 0.00 0.00 54.79 51.69 1qqc n ASP 33 Cb 0.45 -0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 40.91 1qqc n ASP 33 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1qqc s PHE 34 N -3.14 3.64 -0.08 1.24 5.36 -1.26 -5.10 117.98 118.64 1qqc s PHE 34 Ca 0.41 0.67 0.05 0.00 -0.96 0.00 0.00 56.93 57.10 1qqc s PHE 34 Cb 0.37 -2.04 -0.01 0.00 -0.34 0.00 0.00 43.02 41.00 1qqc s PHE 34 CO 0.00 0.71 -0.23 -1.21 -1.46 0.00 0.00 175.22 173.03 1qqc s GLU 35 N -1.07 2.81 0.72 10.12 2.02 -1.26 -4.97 118.70 127.06 1qqc s GLU 35 Ca 0.18 -0.86 -0.12 0.00 0.02 0.00 0.00 54.97 54.19 1qqc s GLU 35 Cb -0.13 -2.27 0.03 0.00 0.10 0.00 0.00 34.13 31.85 1qqc s GLU 35 CO 0.07 0.31 1.08 -2.14 0.02 0.00 0.00 175.26 174.61 1qqc s PRO 36 N 0.03 2.62 0.13 0.39 0.02 -1.26 -4.95 135.00 131.98 1qqc s PRO 36 Ca -0.09 1.15 -0.25 0.00 0.02 0.00 0.00 61.00 61.83 1qqc s PRO 36 Cb -0.15 -1.94 0.07 0.00 0.02 0.00 0.00 34.50 32.50 1qqc s PRO 36 CO 0.05 -1.36 1.03 1.52 -0.33 0.00 0.00 177.00 177.91 1qqc s TYR 37 N -2.81 -0.08 0.23 6.54 -0.85 -1.26 -2.54 117.35 116.58 1qqc s TYR 37 Ca 0.61 -0.20 -0.01 0.00 -0.52 0.00 0.00 57.07 56.95 1qqc s TYR 37 Cb -0.17 0.63 0.01 0.00 0.38 0.00 0.00 41.96 42.81 1qqc s TYR 37 CO 0.52 -0.75 0.32 0.44 -1.52 0.00 0.00 175.55 174.56 1qqc n ILE 38 N -0.51 0.00 -4.27 -3.49 -5.35 -0.27 -4.80 119.36 100.66 1qqc n ILE 38 Ca -0.06 -1.19 -0.18 0.00 -0.27 0.00 0.00 62.75 61.05 1qqc n ILE 38 Cb 0.61 0.73 -0.11 0.00 -1.74 0.00 0.00 39.64 39.13 1qqc n ILE 38 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1qqc s TYR 39 N -3.61 1.48 -0.10 4.28 1.51 -0.54 -1.38 117.35 119.00 1qqc s TYR 39 Ca 0.19 -0.59 -0.08 0.00 -1.01 0.00 0.00 57.07 55.59 1qqc s TYR 39 Cb -0.01 -0.75 0.03 0.00 -0.11 0.00 0.00 41.96 41.13 1qqc s TYR 39 CO 0.14 0.20 0.26 0.00 -1.11 0.00 0.00 175.55 175.04 1qqc s ALA 40 N -2.54 -0.62 -0.36 3.71 0.00 -0.37 -0.72 121.76 120.85 1qqc s ALA 40 Ca 0.14 0.86 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 1qqc s ALA 40 Cb -0.03 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.58 1qqc s ALA 40 CO 0.04 -0.15 0.24 -1.17 0.00 0.00 0.00 175.76 174.71 1qqc s LEU 41 N 0.59 4.68 -0.12 0.00 2.96 -0.70 -0.78 118.68 125.31 1qqc s LEU 41 Ca -0.04 -0.72 -0.06 0.00 -0.22 0.00 0.00 54.13 53.10 1qqc s LEU 41 Cb -0.05 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 1qqc s LEU 41 CO -0.03 -0.33 0.10 -0.76 -1.32 0.00 0.00 176.35 174.01 1qqc s LEU 42 N 1.65 4.15 0.66 -0.68 1.02 -1.26 -0.20 118.68 124.02 1qqc s LEU 42 Ca 0.05 0.36 0.43 0.00 0.02 0.00 0.00 54.13 54.99 1qqc s LEU 42 Cb -0.18 -2.00 2.34 0.00 0.02 0.00 0.00 46.19 46.37 1qqc s LEU 42 CO 0.09 0.39 2.32 0.11 0.02 0.00 0.00 176.35 179.27 1qqc h LYS 43 N 5.15 0.00 -1.63 1.70 1.57 -1.44 -3.42 116.57 118.50 1qqc h LYS 43 Ca -0.53 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.35 1qqc h LYS 43 Cb 1.21 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.27 1qqc h LYS 43 CO 0.58 0.00 0.27 0.34 -0.57 0.00 0.00 179.45 180.07 1qqc s ASP 44 N -5.05 -0.64 0.47 0.86 2.15 -1.26 -5.05 116.67 108.14 1qqc s ASP 44 Ca -0.05 1.00 0.34 0.00 0.43 0.00 0.00 52.55 54.27 1qqc s ASP 44 Cb 0.12 1.31 1.47 0.00 -0.30 0.00 0.00 42.92 45.52 1qqc s ASP 44 CO 0.39 -0.16 1.64 0.44 -0.17 0.00 0.00 175.17 177.32 1qqc h ASP 45 N 6.42 0.19 -0.14 -0.34 3.32 -1.98 -1.21 116.42 122.68 1qqc h ASP 45 Ca -0.28 0.09 0.04 0.00 0.02 0.00 0.00 57.03 56.91 1qqc h ASP 45 Cb 1.20 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 1qqc h ASP 45 CO 0.18 -0.11 0.38 0.77 -1.72 0.00 0.00 179.24 178.75 1qqc h SER 46 N 0.09 0.00 1.18 6.45 4.64 -1.98 -2.44 113.55 121.49 1qqc h SER 46 Ca 0.80 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.12 1qqc h SER 46 Cb 2.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.77 1qqc h SER 46 CO -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.67 1qqc h ALA 47 N 1.36 1.00 -0.98 5.18 0.00 -1.62 -3.32 119.26 120.88 1qqc h ALA 47 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1qqc h ALA 47 Cb 0.83 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 1qqc h ALA 47 CO -0.00 0.00 0.64 -0.84 0.00 0.00 0.00 179.25 179.05 1qqc h ILE 48 N 0.00 1.14 0.00 0.00 3.07 -1.68 0.04 117.51 120.08 1qqc h ILE 48 Ca 0.00 -0.42 0.00 0.00 1.55 0.00 0.00 64.86 65.99 1qqc h ILE 48 Cb 0.59 -0.18 0.00 0.00 -0.27 0.00 0.00 36.82 36.97 1qqc h ILE 48 CO 0.00 0.22 0.00 -0.62 -1.05 0.00 0.00 178.15 176.70 1qqc n GLU 49 N -4.48 0.14 -0.09 0.16 -0.58 -1.25 -0.41 120.64 114.13 1qqc n GLU 49 Ca 0.14 0.56 -0.23 0.00 -0.42 0.00 0.00 57.16 57.21 1qqc n GLU 49 Cb 0.12 -1.88 -0.12 0.00 -0.57 0.00 0.00 31.44 28.99 1qqc n GLU 49 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1qqc n ASP 50 N -2.16 1.93 0.10 1.62 -0.08 -0.13 -4.32 116.55 113.50 1qqc n ASP 50 Ca -0.00 0.35 0.04 0.00 -1.51 0.00 0.00 54.79 53.67 1qqc n ASP 50 Cb 0.08 -0.90 0.45 0.00 2.34 0.00 0.00 41.12 43.09 1qqc n ASP 50 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1qqc h ILE 51 N -0.79 1.11 0.00 5.18 2.04 -0.05 -2.24 117.51 122.76 1qqc h ILE 51 Ca -0.44 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1qqc h ILE 51 Cb 1.50 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 1qqc h ILE 51 CO -0.20 0.14 0.00 0.29 0.00 0.00 0.00 178.15 178.38 1qqc n LYS 52 N -4.41 0.08 0.00 2.37 5.02 0.46 -2.27 118.16 119.41 1qqc n LYS 52 Ca 0.00 0.48 0.10 0.00 -2.02 0.00 0.00 58.31 56.87 1qqc n LYS 52 Cb 0.15 -1.71 0.07 0.00 -0.02 0.00 0.00 35.03 33.52 1qqc n LYS 52 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1qqc n LYS 53 N -1.87 1.75 -2.12 1.97 5.02 -0.84 -4.39 118.16 117.68 1qqc n LYS 53 Ca 0.01 -1.59 -0.36 0.00 -2.02 0.00 0.00 58.31 54.35 1qqc n LYS 53 Cb 0.09 -1.38 0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1qqc n LYS 53 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1qqc s ILE 54 N -1.74 2.86 0.17 -0.18 1.01 -0.96 -5.03 121.20 117.33 1qqc s ILE 54 Ca 0.22 0.54 -0.10 0.00 0.00 0.00 0.00 60.65 61.32 1qqc s ILE 54 Cb 0.17 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.41 1qqc s ILE 54 CO 0.28 -0.11 0.32 0.28 0.00 0.00 0.00 174.94 175.71 1qqc s THR 55 N -1.65 0.06 0.35 2.92 -1.32 -1.26 -4.46 115.64 110.27 1qqc s THR 55 Ca 0.75 -1.34 -0.08 0.00 -1.21 0.00 0.00 61.69 59.80 1qqc s THR 55 Cb -0.28 -1.86 0.03 0.00 -1.51 0.00 0.00 72.50 68.89 1qqc s THR 55 CO 0.31 -0.25 0.60 0.00 -2.21 0.00 0.00 174.62 173.07 1qqc n ALA 56 N -0.24 -1.00 -2.87 11.08 0.00 -1.01 -4.98 120.51 121.48 1qqc n ALA 56 Ca -0.07 -1.35 -0.12 0.00 0.00 0.00 0.00 53.44 51.90 1qqc n ALA 56 Cb 0.63 1.08 -0.12 0.00 0.00 0.00 0.00 19.45 21.04 1qqc n ALA 56 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1qqc s GLU 57 N -2.41 0.36 -0.07 0.00 2.02 -1.26 0.80 118.70 118.14 1qqc s GLU 57 Ca 0.21 -0.48 -0.03 0.00 0.02 0.00 0.00 54.97 54.68 1qqc s GLU 57 Cb -0.03 -0.16 0.04 0.00 0.10 0.00 0.00 34.13 34.08 1qqc s GLU 57 CO 0.15 0.03 0.16 0.50 0.02 0.00 0.00 175.26 176.12 1qqc s ARG 58 N -1.00 0.12 -1.52 1.61 3.52 -0.71 -4.84 118.95 116.12 1qqc s ARG 58 Ca -0.08 0.38 -0.06 0.00 -0.13 0.00 0.00 55.73 55.84 1qqc s ARG 58 Cb -0.07 -0.14 0.01 0.00 -1.56 0.00 0.00 34.95 33.20 1qqc s ARG 58 CO -0.00 -0.15 0.66 0.72 -0.81 0.00 0.00 175.30 175.72 1qqc n HIS 59 N 4.07 -2.05 -0.57 5.12 8.25 -1.26 -1.77 115.22 127.01 1qqc n HIS 59 Ca -0.25 0.57 0.00 0.00 -0.26 0.00 0.00 57.72 57.79 1qqc n HIS 59 Cb 0.53 -4.41 0.00 0.00 1.12 0.00 0.00 29.99 27.23 1qqc n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qqc n GLY 60 N -1.54 0.99 3.70 -1.41 0.00 -1.26 -4.99 105.19 100.68 1qqc n GLY 60 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 1qqc n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qqc s THR 61 N -2.67 4.07 0.28 2.61 2.01 -0.73 -5.09 115.64 116.12 1qqc s THR 61 Ca 0.00 -1.02 -0.29 0.00 0.31 0.00 0.00 61.69 60.68 1qqc s THR 61 Cb 0.00 -2.97 -0.10 0.00 0.01 0.00 0.00 72.50 69.45 1qqc s THR 61 CO 0.00 0.08 1.09 -0.89 -0.69 0.00 0.00 174.62 174.21 1qqc s THR 62 N -1.40 3.51 -0.09 -0.82 2.01 -1.26 -1.74 115.64 115.85 1qqc s THR 62 Ca 0.27 1.51 0.04 0.00 0.31 0.00 0.00 61.69 63.81 1qqc s THR 62 Cb -0.11 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 1qqc s THR 62 CO 0.19 0.35 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.57 1qqc s VAL 63 N -1.19 2.37 0.33 3.82 1.01 0.24 -4.93 120.40 122.05 1qqc s VAL 63 Ca 0.45 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.54 1qqc s VAL 63 Cb -0.31 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 1qqc s VAL 63 CO 0.40 0.56 0.15 -0.13 0.00 0.00 0.00 175.10 176.08 1qqc s ARG 64 N 0.11 1.68 -0.02 2.72 0.52 -1.26 -2.40 118.95 120.29 1qqc s ARG 64 Ca -0.10 -1.97 -0.27 0.00 -0.52 0.00 0.00 55.73 52.87 1qqc s ARG 64 Cb -0.16 -0.24 -0.03 0.00 0.52 0.00 0.00 34.95 35.04 1qqc s ARG 64 CO 0.06 -0.45 0.86 0.08 0.02 0.00 0.00 175.30 175.87 1qqc s VAL 65 N -3.49 4.92 -0.06 3.52 1.01 -1.26 -4.69 120.40 120.34 1qqc s VAL 65 Ca 0.33 1.80 -0.03 0.00 0.00 0.00 0.00 61.98 64.08 1qqc s VAL 65 Cb 0.05 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1qqc s VAL 65 CO 0.17 0.21 0.13 0.74 0.00 0.00 0.00 175.10 176.36 1qqc h THR 66 N 4.72 0.00 -4.34 3.92 2.02 -1.59 -3.49 112.91 114.16 1qqc h THR 66 Ca -0.41 -0.64 -0.25 0.00 0.77 0.00 0.00 66.41 65.87 1qqc h THR 66 Cb 1.21 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 67.47 1qqc h THR 66 CO 0.75 0.00 -0.63 -0.13 0.37 0.00 0.00 175.52 175.88 1qqc s ARG 67 N -1.74 1.18 -0.13 6.66 0.52 -1.26 -5.00 118.95 119.17 1qqc s ARG 67 Ca -0.01 -1.61 -0.08 0.00 -0.52 0.00 0.00 55.73 53.50 1qqc s ARG 67 Cb 0.00 0.12 0.05 0.00 0.52 0.00 0.00 34.95 35.64 1qqc s ARG 67 CO 0.04 -0.33 0.33 0.00 0.02 0.00 0.00 175.30 175.36 1qqc s ALA 68 N -4.02 -0.81 -0.04 2.13 0.00 -1.26 -2.29 121.76 115.46 1qqc s ALA 68 Ca 0.35 1.17 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 1qqc s ALA 68 Cb 0.07 -0.71 0.02 0.00 0.00 0.00 0.00 23.12 22.50 1qqc s ALA 68 CO 0.10 -0.21 0.10 -1.83 0.00 0.00 0.00 175.76 173.92 1qqc s GLU 69 N 1.00 0.08 0.10 0.00 -1.05 -1.10 -4.99 118.70 112.74 1qqc s GLU 69 Ca -0.07 0.22 -0.30 0.00 -0.15 0.00 0.00 54.97 54.67 1qqc s GLU 69 Cb -0.07 -0.07 -0.06 0.00 -0.44 0.00 0.00 34.13 33.48 1qqc s GLU 69 CO -0.07 -0.09 1.19 0.50 0.95 0.00 0.00 175.26 177.73 1qqc s ARG 70 N 0.58 4.46 0.03 -4.83 3.52 -1.26 -1.51 118.95 119.95 1qqc s ARG 70 Ca -0.04 1.78 0.02 0.00 -0.13 0.00 0.00 55.73 57.36 1qqc s ARG 70 Cb -0.06 -3.32 -0.02 0.00 -1.56 0.00 0.00 34.95 29.99 1qqc s ARG 70 CO -0.02 -0.18 -0.07 0.08 -0.81 0.00 0.00 175.30 174.29 1qqc s VAL 71 N 0.67 0.50 -0.18 7.11 1.01 0.31 -4.96 120.40 124.86 1qqc s VAL 71 Ca 0.56 -0.88 -0.14 0.00 0.00 0.00 0.00 61.98 61.52 1qqc s VAL 71 Cb -0.30 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.49 1qqc s VAL 71 CO 0.31 -0.27 0.29 -0.54 0.00 0.00 0.00 175.10 174.89 1qqc s LYS 72 N -1.25 4.21 0.34 2.72 1.02 -1.26 -1.95 119.74 123.58 1qqc s LYS 72 Ca -0.07 0.05 0.02 0.00 0.02 0.00 0.00 55.97 55.99 1qqc s LYS 72 Cb -0.08 -3.47 -0.01 0.00 -0.52 0.00 0.00 37.83 33.75 1qqc s LYS 72 CO 0.00 0.16 0.39 0.15 -0.92 0.00 0.00 175.35 175.13 1qqc s LYS 73 N 0.73 1.86 -0.12 1.68 1.02 -0.63 -5.02 119.74 119.25 1qqc s LYS 73 Ca 0.15 -1.89 0.03 0.00 0.02 0.00 0.00 55.97 54.29 1qqc s LYS 73 Cb -0.13 0.39 0.00 0.00 -0.52 0.00 0.00 37.83 37.57 1qqc s LYS 73 CO 0.04 -0.73 -0.23 0.15 -0.92 0.00 0.00 175.35 173.66 1qqc s LYS 74 N -3.20 3.05 -0.14 1.68 1.02 -1.09 -1.02 119.74 120.04 1qqc s LYS 74 Ca 0.35 -0.86 -0.01 0.00 0.02 0.00 0.00 55.97 55.47 1qqc s LYS 74 Cb 0.01 -2.37 0.04 0.00 -0.52 0.00 0.00 37.83 34.98 1qqc s LYS 74 CO 0.24 0.09 -0.05 0.12 -0.92 0.00 0.00 175.35 174.83 1qqc s PHE 75 N 0.55 1.47 -1.26 3.18 5.36 -0.85 -0.48 117.98 125.96 1qqc s PHE 75 Ca -0.13 -0.84 -0.17 0.00 -0.96 0.00 0.00 56.93 54.83 1qqc s PHE 75 Cb -0.17 -1.21 0.01 0.00 -0.34 0.00 0.00 43.02 41.31 1qqc s PHE 75 CO 0.04 -0.55 0.62 1.28 -1.46 0.00 0.00 175.22 175.15 1qqc n LEU 76 N 4.94 -2.02 -3.85 6.12 4.32 -1.26 -1.95 117.00 123.30 1qqc n LEU 76 Ca -0.11 -1.09 -0.30 0.00 -0.02 0.00 0.00 56.01 54.49 1qqc n LEU 76 Cb 0.49 -2.14 0.02 0.00 -1.62 0.00 0.00 43.42 40.17 1qqc n LEU 76 CO 0.16 0.53 0.09 0.61 -1.22 0.00 0.00 177.39 177.56 1qqc n GLY 77 N -1.91 -0.50 3.00 -0.72 0.00 -1.26 -4.85 105.19 98.95 1qqc n GLY 77 Ca -0.17 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 1qqc n GLY 77 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qqc s ARG 78 N -6.56 0.25 0.55 1.61 0.52 -0.82 -5.12 118.95 109.37 1qqc s ARG 78 Ca 0.64 0.67 -0.22 0.00 -0.52 0.00 0.00 55.73 56.30 1qqc s ARG 78 Cb -0.32 -0.26 -0.05 0.00 0.52 0.00 0.00 34.95 34.84 1qqc s ARG 78 CO 0.79 -0.43 1.37 -2.14 0.02 0.00 0.00 175.30 174.91 1qqc s PRO 79 N 2.48 3.13 0.01 3.54 0.02 -1.26 -2.01 135.00 140.91 1qqc s PRO 79 Ca 0.05 2.26 -0.28 0.00 0.02 0.00 0.00 61.00 63.04 1qqc s PRO 79 Cb -0.14 -2.26 0.09 0.00 0.02 0.00 0.00 34.50 32.21 1qqc s PRO 79 CO -0.12 -1.20 0.78 0.54 -0.33 0.00 0.00 177.00 176.67 1qqc s VAL 80 N -1.29 0.00 -0.08 3.83 0.11 -0.19 -4.90 120.40 117.89 1qqc s VAL 80 Ca 0.72 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.73 1qqc s VAL 80 Cb -0.41 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.40 1qqc s VAL 80 CO 0.48 0.00 0.06 -1.61 -3.33 0.00 0.00 175.10 170.71 1qqc s GLU 81 N -2.59 3.14 0.13 1.54 2.02 -1.26 -1.61 118.70 120.08 1qqc s GLU 81 Ca -0.00 -0.34 -0.08 0.00 0.02 0.00 0.00 54.97 54.56 1qqc s GLU 81 Cb -0.01 -2.93 -0.01 0.00 0.10 0.00 0.00 34.13 31.29 1qqc s GLU 81 CO -0.05 0.71 0.22 0.14 0.02 0.00 0.00 175.26 176.31 1qqc s VAL 82 N -1.00 0.10 -0.18 2.63 -7.23 -0.82 -4.74 120.40 109.16 1qqc s VAL 82 Ca 0.16 -1.37 -0.05 0.00 -1.81 0.00 0.00 61.98 58.92 1qqc s VAL 82 Cb -0.12 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 35.13 1qqc s VAL 82 CO 0.06 -0.46 -0.01 0.26 -0.31 0.00 0.00 175.10 174.64 1qqc s TRP 83 N -3.93 3.05 -0.41 2.82 0.52 0.04 -0.53 118.94 120.51 1qqc s TRP 83 Ca 0.13 -0.34 -0.22 0.00 0.02 0.00 0.00 56.10 55.69 1qqc s TRP 83 Cb 0.04 -2.03 0.02 0.00 -1.15 0.00 0.00 33.47 30.35 1qqc s TRP 83 CO -0.04 -0.12 0.70 0.21 0.02 0.00 0.00 176.95 177.72 1qqc s LYS 84 N 0.69 3.49 -0.23 4.98 2.20 -0.57 -1.24 119.74 129.06 1qqc s LYS 84 Ca -0.01 -0.09 -0.10 0.00 -0.36 0.00 0.00 55.97 55.41 1qqc s LYS 84 Cb -0.14 -3.89 -0.05 0.00 -1.51 0.00 0.00 37.83 32.24 1qqc s LYS 84 CO 0.02 -0.95 0.15 -0.51 -0.36 0.00 0.00 175.35 173.71 1qqc s LEU 85 N 2.97 4.11 0.36 5.43 1.43 -0.48 -2.69 118.68 129.80 1qqc s LEU 85 Ca 0.26 0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.53 1qqc s LEU 85 Cb -0.13 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 1qqc s LEU 85 CO 0.19 0.08 0.52 -0.31 0.23 0.00 0.00 176.35 177.05 1qqc s TYR 86 N 0.97 3.20 0.29 0.29 1.51 -0.97 -1.12 117.35 121.52 1qqc s TYR 86 Ca 0.07 -0.05 0.02 0.00 -1.01 0.00 0.00 57.07 56.11 1qqc s TYR 86 Cb -0.13 -2.03 -0.01 0.00 -0.11 0.00 0.00 41.96 39.68 1qqc s TYR 86 CO 0.04 -0.05 0.33 1.19 -1.11 0.00 0.00 175.55 175.95 1qqc n PHE 87 N -1.74 -1.00 -0.12 2.71 3.01 -1.05 -1.44 117.46 117.83 1qqc n PHE 87 Ca -0.01 -2.17 -0.25 0.00 1.01 0.00 0.00 57.45 56.03 1qqc n PHE 87 Cb 0.58 0.36 -0.11 0.00 -0.01 0.00 0.00 39.48 40.30 1qqc n PHE 87 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1qqc n THR 88 N -0.51 1.54 -5.03 4.37 -1.04 -1.26 -4.29 114.28 108.06 1qqc n THR 88 Ca 0.03 -0.37 -0.28 0.00 -2.04 0.00 0.00 64.05 61.40 1qqc n THR 88 Cb 0.50 -1.82 -0.16 0.00 -1.82 0.00 0.00 70.33 67.04 1qqc n THR 88 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1qqc s HIS 89 N -2.48 1.98 0.36 -1.42 5.65 -1.26 -4.48 115.29 113.63 1qqc s HIS 89 Ca -0.35 -0.50 0.11 0.00 0.25 0.00 0.00 55.06 54.57 1qqc s HIS 89 Cb 0.11 -1.30 0.89 0.00 -1.18 0.00 0.00 32.58 31.10 1qqc s HIS 89 CO 0.55 -0.13 1.83 -1.00 -0.65 0.00 0.00 174.74 175.35 1qqc h PRO 90 N 5.95 0.60 0.00 2.88 0.13 -1.94 0.66 132.00 140.27 1qqc h PRO 90 Ca -0.35 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1qqc h PRO 90 Cb 1.16 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1qqc h PRO 90 CO 0.48 0.40 0.00 1.04 -0.23 0.00 0.00 178.00 179.68 1qqc n GLN 91 N -4.60 0.12 -0.31 0.86 1.13 -1.26 -2.14 117.38 111.17 1qqc n GLN 91 Ca 0.20 0.40 -0.05 0.00 -1.94 0.00 0.00 57.00 55.61 1qqc n GLN 91 Cb 0.59 -1.74 0.07 0.00 0.11 0.00 0.00 30.24 29.27 1qqc n GLN 91 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1qqc h ASP 92 N 0.00 1.11 -0.15 1.08 5.19 -1.28 -3.20 116.42 119.17 1qqc h ASP 92 Ca 0.00 -0.14 0.05 0.00 -0.62 0.00 0.00 57.03 56.31 1qqc h ASP 92 Cb 0.26 -0.29 -0.07 0.00 0.18 0.00 0.00 39.33 39.42 1qqc h ASP 92 CO 0.00 0.94 -0.39 0.58 -3.12 0.00 0.00 179.24 177.25 1qqc h VAL 93 N 1.20 0.18 -0.08 -1.35 2.07 -1.56 -1.64 116.25 115.06 1qqc h VAL 93 Ca 0.29 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.83 1qqc h VAL 93 Cb 0.14 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.08 1qqc h VAL 93 CO -0.03 0.00 0.18 -0.65 0.02 0.00 0.00 177.57 177.09 1qqc h PRO 94 N -0.46 0.00 0.00 1.57 0.11 -1.72 -2.05 132.00 129.46 1qqc h PRO 94 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1qqc h PRO 94 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 1qqc h PRO 94 CO -0.40 0.00 -1.09 0.00 -0.21 0.00 0.00 178.00 176.30 1qqc n ALA 95 N -2.14 3.81 0.00 -0.75 0.00 -0.66 -4.56 120.51 116.21 1qqc n ALA 95 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1qqc n ALA 95 Cb 0.27 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1qqc n ALA 95 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1qqc n ILE 96 N -1.80 0.00 -0.04 0.00 3.06 -0.97 -4.75 119.36 114.87 1qqc n ILE 96 Ca 0.02 -0.14 -0.08 0.00 -2.50 0.00 0.00 62.75 60.05 1qqc n ILE 96 Cb 0.41 0.62 -0.02 0.00 0.54 0.00 0.00 39.64 41.18 1qqc n ILE 96 CO 0.00 0.00 0.00 0.08 -2.50 0.00 0.00 176.55 174.13 1qqc h ARG 97 N 0.00 -0.05 -0.56 9.51 0.11 -1.62 -2.90 114.38 118.88 1qqc h ARG 97 Ca 0.00 0.00 0.11 0.00 0.10 0.00 0.00 59.98 60.20 1qqc h ARG 97 Cb 0.00 0.01 -0.10 0.00 1.11 0.00 0.00 29.97 30.99 1qqc h ARG 97 CO 0.00 -0.03 -0.07 -0.44 0.10 0.00 0.00 179.97 179.53 1qqc h ASP 98 N -0.05 -0.38 -0.09 0.08 3.32 -1.86 -1.52 116.42 115.91 1qqc h ASP 98 Ca 0.10 0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.34 1qqc h ASP 98 Cb 0.21 0.29 -0.04 0.00 0.22 0.00 0.00 39.33 40.01 1qqc h ASP 98 CO -0.23 -0.14 -0.17 0.11 -1.72 0.00 0.00 179.24 177.09 1qqc h LYS 99 N 0.05 -0.22 -0.95 3.56 1.57 -1.86 -1.88 116.57 116.84 1qqc h LYS 99 Ca 0.28 0.02 0.19 0.00 -1.87 0.00 0.00 60.65 59.27 1qqc h LYS 99 Cb 0.43 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.71 1qqc h LYS 99 CO -0.52 -0.15 0.61 0.82 -0.57 0.00 0.00 179.45 179.64 1qqc h ILE 100 N -0.23 0.70 -0.01 1.86 2.04 -1.14 -0.41 117.51 120.32 1qqc h ILE 100 Ca 0.08 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1qqc h ILE 100 Cb 0.35 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1qqc h ILE 100 CO -0.23 0.11 -0.00 -2.11 0.00 0.00 0.00 178.15 175.92 1qqc n ARG 101 N -4.61 1.62 -0.42 2.37 1.85 -0.76 -3.41 116.66 113.31 1qqc n ARG 101 Ca 0.21 -0.91 0.09 0.00 -1.00 0.00 0.00 57.85 56.24 1qqc n ARG 101 Cb 0.63 -1.48 0.28 0.00 -1.05 0.00 0.00 32.46 30.84 1qqc n ARG 101 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1qqc n GLU 102 N 0.10 3.19 -2.79 2.89 1.02 -0.17 -4.90 120.64 119.98 1qqc n GLU 102 Ca 0.19 -2.60 -0.35 0.00 -0.02 0.00 0.00 57.16 54.38 1qqc n GLU 102 Cb 0.34 -1.64 -0.07 0.00 -0.02 0.00 0.00 31.44 30.05 1qqc n GLU 102 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1qqc s HIS 103 N -1.56 3.49 0.16 -0.32 2.46 -1.17 -4.99 115.29 113.36 1qqc s HIS 103 Ca 0.42 1.69 -0.12 0.00 0.47 0.00 0.00 55.06 57.52 1qqc s HIS 103 Cb 0.26 -2.89 0.05 0.00 -0.13 0.00 0.00 32.58 29.87 1qqc s HIS 103 CO 0.22 0.02 1.69 -1.00 -2.47 0.00 0.00 174.74 173.20 1qqc h PRO 104 N 2.51 0.87 -0.48 2.88 0.13 -1.91 -3.11 132.00 132.90 1qqc h PRO 104 Ca -0.48 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1qqc h PRO 104 Cb 1.19 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1qqc h PRO 104 CO 0.63 0.80 0.00 0.00 -0.23 0.00 0.00 178.00 179.20 1qqc n ALA 105 N -2.39 2.27 -3.51 -0.56 0.00 -1.26 -4.73 120.51 110.34 1qqc n ALA 105 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.11 1qqc n ALA 105 Cb 0.21 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.52 1qqc n ALA 105 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1qqc s VAL 106 N -1.41 3.29 -0.01 0.00 1.01 -1.18 -1.04 120.40 121.06 1qqc s VAL 106 Ca 0.00 -0.92 -0.25 0.00 0.00 0.00 0.00 61.98 60.81 1qqc s VAL 106 Cb 0.00 -2.69 -0.19 0.00 0.00 0.00 0.00 36.38 33.50 1qqc s VAL 106 CO 0.00 0.14 1.28 0.58 0.00 0.00 0.00 175.10 177.10 1qqc h VAL 107 N 6.05 1.19 -2.03 2.92 2.07 -0.87 -3.47 116.25 122.12 1qqc h VAL 107 Ca -0.31 -0.93 0.24 0.00 0.82 0.00 0.00 66.70 66.52 1qqc h VAL 107 Cb 1.11 1.79 -0.09 0.00 -1.52 0.00 0.00 31.29 32.59 1qqc h VAL 107 CO 0.58 0.23 0.65 -0.62 0.02 0.00 0.00 177.57 178.43 1qqc s ASP 108 N -5.52 -0.09 0.14 0.57 -1.08 -1.25 -5.02 116.67 104.42 1qqc s ASP 108 Ca -0.15 -0.34 0.10 0.00 -0.52 0.00 0.00 52.55 51.64 1qqc s ASP 108 Cb 0.02 0.35 -0.04 0.00 -1.46 0.00 0.00 42.92 41.79 1qqc s ASP 108 CO 0.64 -0.66 -0.24 0.27 0.52 0.00 0.00 175.17 175.70 1qqc s ILE 109 N -2.72 2.07 0.10 4.11 -4.36 -1.26 -1.73 121.20 117.41 1qqc s ILE 109 Ca 0.15 -1.78 0.03 0.00 -0.26 0.00 0.00 60.65 58.80 1qqc s ILE 109 Cb 0.01 -1.88 -0.04 0.00 1.25 0.00 0.00 42.46 41.80 1qqc s ILE 109 CO 0.00 -0.05 -0.09 -0.31 0.24 0.00 0.00 174.94 174.74 1qqc s TYR 110 N -1.34 1.02 -1.24 1.37 1.51 0.10 -4.90 117.35 113.87 1qqc s TYR 110 Ca 0.13 -0.75 -0.12 0.00 -1.01 0.00 0.00 57.07 55.33 1qqc s TYR 110 Cb -0.09 -0.56 -0.01 0.00 -0.11 0.00 0.00 41.96 41.19 1qqc s TYR 110 CO 0.06 -0.04 0.67 0.39 -1.11 0.00 0.00 175.55 175.53 1qqc n GLU 111 N 0.29 -2.28 -0.06 -0.62 1.02 -1.26 -1.47 120.64 116.25 1qqc n GLU 111 Ca -0.14 0.46 0.07 0.00 -0.02 0.00 0.00 57.16 57.53 1qqc n GLU 111 Cb 0.59 -4.37 0.10 0.00 -0.02 0.00 0.00 31.44 27.74 1qqc n GLU 111 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1qqc n TYR 112 N -4.26 0.17 -2.16 -0.32 4.11 -1.26 -4.58 117.16 108.86 1qqc n TYR 112 Ca -0.18 -0.14 -0.02 0.00 -0.00 0.00 0.00 57.90 57.55 1qqc n TYR 112 Cb 0.63 -0.01 0.09 0.00 -0.00 0.00 0.00 39.34 40.05 1qqc n TYR 112 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.86 176.46 1qqc n ASP 113 N 0.78 2.17 -4.50 9.48 3.85 -1.26 -4.83 116.55 122.25 1qqc n ASP 113 Ca 0.10 -3.02 -0.42 0.00 -0.71 0.00 0.00 54.79 50.75 1qqc n ASP 113 Cb 0.39 -0.42 -0.10 0.00 -1.35 0.00 0.00 41.12 39.64 1qqc n ASP 113 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1qqc s ILE 114 N -2.73 5.22 0.19 2.12 -1.09 -1.26 -5.04 121.20 118.61 1qqc s ILE 114 Ca 0.38 -0.35 -0.32 0.00 -2.23 0.00 0.00 60.65 58.12 1qqc s ILE 114 Cb 0.38 -3.87 -0.15 0.00 -1.58 0.00 0.00 42.46 37.24 1qqc s ILE 114 CO -0.07 -0.21 1.29 -2.65 -1.23 0.00 0.00 174.94 172.07 1qqc n PRO 115 N 5.27 1.55 -0.33 2.79 -0.02 -1.26 -4.69 135.00 138.31 1qqc n PRO 115 Ca -0.10 0.55 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 1qqc n PRO 115 Cb 0.48 -2.13 0.26 0.00 -0.02 0.00 0.00 33.50 32.09 1qqc n PRO 115 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1qqc h PHE 116 N 3.87 -0.07 -0.04 6.00 3.57 -1.97 -1.16 116.94 127.13 1qqc h PHE 116 Ca -0.44 0.07 -0.17 0.00 3.53 0.00 0.00 57.97 60.96 1qqc h PHE 116 Cb 1.31 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 40.23 1qqc h PHE 116 CO 0.56 -0.40 -0.71 0.00 -2.23 0.00 0.00 178.31 175.52 1qqc h ALA 117 N 1.95 0.72 -0.15 2.41 0.00 -1.89 -1.94 119.26 120.35 1qqc h ALA 117 Ca 0.57 -0.61 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 1qqc h ALA 117 Cb 1.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1qqc h ALA 117 CO -0.89 0.80 -0.71 0.87 0.00 0.00 0.00 179.25 179.32 1qqc h LYS 118 N 0.15 0.67 -0.96 0.00 1.57 -1.76 -1.50 116.57 114.74 1qqc h LYS 118 Ca -0.02 -0.52 0.04 0.00 -1.87 0.00 0.00 60.65 58.28 1qqc h LYS 118 Cb 1.26 0.10 -0.06 0.00 0.08 0.00 0.00 32.23 33.61 1qqc h LYS 118 CO 0.11 1.14 0.63 -0.09 -0.57 0.00 0.00 179.45 180.66 1qqc h ARG 119 N 0.47 1.15 -0.14 3.15 9.65 -1.13 -1.41 114.38 126.13 1qqc h ARG 119 Ca -0.03 -0.07 -0.02 0.00 -1.10 0.00 0.00 59.98 58.76 1qqc h ARG 119 Cb 1.32 -0.26 -0.01 0.00 -1.39 0.00 0.00 29.97 29.63 1qqc h ARG 119 CO 0.14 0.76 0.02 -0.92 2.80 0.00 0.00 179.97 182.78 1qqc h TYR 120 N 1.19 0.24 -0.75 2.20 3.20 -1.13 -0.92 116.97 121.00 1qqc h TYR 120 Ca 0.39 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.27 1qqc h TYR 120 Cb 0.05 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.21 1qqc h TYR 120 CO -0.01 0.41 0.47 -0.07 -1.64 0.00 0.00 178.16 177.33 1qqc h LEU 121 N 0.00 0.77 -0.26 2.82 3.38 -0.75 -0.58 115.31 120.70 1qqc h LEU 121 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1qqc h LEU 121 Cb 0.30 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1qqc h LEU 121 CO 0.00 0.53 -0.13 0.40 0.09 0.00 0.00 178.44 179.33 1qqc h ILE 122 N 0.91 1.30 -0.04 1.22 2.04 -1.20 -0.17 117.51 121.57 1qqc h ILE 122 Ca 0.31 -1.22 -0.18 0.00 1.00 0.00 0.00 64.86 64.76 1qqc h ILE 122 Cb 0.04 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1qqc h ILE 122 CO -0.12 0.38 -0.76 0.44 0.00 0.00 0.00 178.15 178.09 1qqc h ASP 123 N 0.28 0.36 0.12 1.72 5.19 -0.97 -2.88 116.42 120.24 1qqc h ASP 123 Ca 0.06 -0.25 0.00 0.00 -0.62 0.00 0.00 57.03 56.22 1qqc h ASP 123 Cb 0.64 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1qqc h ASP 123 CO 0.04 0.99 -0.09 0.54 -3.12 0.00 0.00 179.24 177.61 1qqc n ARG 124 N -3.78 1.21 -2.47 3.56 5.12 -0.24 -4.94 116.66 115.11 1qqc n ARG 124 Ca -0.04 -0.61 -0.17 0.00 -1.93 0.00 0.00 57.85 55.10 1qqc n ARG 124 Cb 0.73 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.54 1qqc n ARG 124 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1qqc n GLY 125 N 1.22 -0.33 3.81 -0.13 0.00 -0.55 -5.00 105.19 104.21 1qqc n GLY 125 Ca 0.17 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1qqc n GLY 125 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qqc s LEU 126 N -5.08 4.42 -0.24 0.99 1.43 -0.18 -5.02 118.68 115.00 1qqc s LEU 126 Ca 0.06 1.36 0.01 0.00 -1.03 0.00 0.00 54.13 54.53 1qqc s LEU 126 Cb -0.03 -3.34 0.06 0.00 0.03 0.00 0.00 46.19 42.92 1qqc s LEU 126 CO 0.08 0.12 -0.05 -0.63 0.23 0.00 0.00 176.35 176.10 1qqc s ILE 127 N -1.37 1.54 0.81 -0.59 1.01 -1.26 -4.67 121.20 116.67 1qqc s ILE 127 Ca 0.38 -1.25 -0.11 0.00 0.00 0.00 0.00 60.65 59.66 1qqc s ILE 127 Cb -0.18 -1.82 0.08 0.00 0.01 0.00 0.00 42.46 40.55 1qqc s ILE 127 CO 0.21 -0.12 1.13 -2.16 0.00 0.00 0.00 174.94 174.00 1qqc s PRO 128 N 1.38 1.83 -1.27 2.79 0.04 -1.26 -4.03 135.00 134.48 1qqc s PRO 128 Ca -0.05 1.42 -0.03 0.00 0.04 0.00 0.00 61.00 62.38 1qqc s PRO 128 Cb -0.19 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 1qqc s PRO 128 CO -0.07 -2.00 0.72 -1.33 0.04 0.00 0.00 177.00 174.36 1qqc n MET 129 N -3.57 -4.20 -0.08 4.56 2.81 -0.67 -3.99 117.12 112.00 1qqc n MET 129 Ca 0.11 0.61 -0.08 0.00 -1.81 0.00 0.00 57.70 56.53 1qqc n MET 129 Cb 0.52 -5.07 -0.12 0.00 -0.71 0.00 0.00 33.22 27.84 1qqc n MET 129 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1qqc n GLU 130 N -4.19 1.48 0.00 0.03 2.13 -1.26 -4.54 120.64 114.30 1qqc n GLU 130 Ca -0.26 -0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.56 1qqc n GLU 130 Cb 0.66 -1.39 0.00 0.00 0.27 0.00 0.00 31.44 30.99 1qqc n GLU 130 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1qqc n GLY 131 N 2.10 -3.04 1.06 8.31 0.00 -1.26 -4.99 105.19 107.37 1qqc n GLY 131 Ca -0.25 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.04 1qqc n GLY 131 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qqc n ASP 132 N 0.00 0.10 -4.88 1.61 -0.08 -1.26 -5.12 116.55 106.91 1qqc n ASP 132 Ca 0.00 -1.88 -0.30 0.00 -1.51 0.00 0.00 54.79 51.11 1qqc n ASP 132 Cb 0.00 -0.06 -0.01 0.00 2.34 0.00 0.00 41.12 43.39 1qqc n ASP 132 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1qqc s GLU 133 N 0.00 3.64 -0.33 -0.67 2.02 -1.26 -5.07 118.70 117.04 1qqc s GLU 133 Ca 0.14 0.50 -0.08 0.00 0.02 0.00 0.00 54.97 55.55 1qqc s GLU 133 Cb 0.16 -2.26 0.02 0.00 0.10 0.00 0.00 34.13 32.15 1qqc s GLU 133 CO -0.07 -0.30 0.13 -1.83 0.02 0.00 0.00 175.26 173.21 1qqc s GLU 134 N -4.65 2.91 -0.17 1.61 -1.05 -1.26 -5.08 118.70 111.01 1qqc s GLU 134 Ca 0.52 -1.00 -0.08 0.00 -0.15 0.00 0.00 54.97 54.26 1qqc s GLU 134 Cb -0.10 -3.52 -0.04 0.00 -0.44 0.00 0.00 34.13 30.03 1qqc s GLU 134 CO 0.44 -0.57 0.12 -0.51 0.95 0.00 0.00 175.26 175.68 1qqc s LEU 135 N 1.50 4.18 -0.01 1.83 1.43 -1.26 -5.04 118.68 121.31 1qqc s LEU 135 Ca 0.01 0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 53.10 1qqc s LEU 135 Cb -0.18 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 1qqc s LEU 135 CO 0.04 0.26 1.13 -0.13 0.23 0.00 0.00 176.35 177.88 1qqc s ARG 136 N -0.16 4.43 0.34 1.70 0.52 -1.26 -4.95 118.95 119.57 1qqc s ARG 136 Ca 0.10 1.61 0.09 0.00 -0.52 0.00 0.00 55.73 57.02 1qqc s ARG 136 Cb -0.12 -3.47 -0.06 0.00 0.52 0.00 0.00 34.95 31.83 1qqc s ARG 136 CO 0.00 -0.29 -0.04 -1.64 0.02 0.00 0.00 175.30 173.36 1qqc s MET 137 N 1.57 1.96 -0.29 3.54 -1.94 -1.26 -1.44 119.30 121.45 1qqc s MET 137 Ca 0.55 -1.81 -0.20 0.00 -1.71 0.00 0.00 55.69 52.51 1qqc s MET 137 Cb -0.25 -1.84 0.16 0.00 2.01 0.00 0.00 34.83 34.91 1qqc s MET 137 CO 0.25 0.15 1.11 -1.17 -0.01 0.00 0.00 175.02 175.35 1qqc s LEU 138 N -3.66 -0.35 0.46 -0.03 0.20 -0.70 -4.76 118.68 109.83 1qqc s LEU 138 Ca 0.34 0.61 0.08 0.00 0.69 0.00 0.00 54.13 55.85 1qqc s LEU 138 Cb 0.00 1.59 0.01 0.00 -0.43 0.00 0.00 46.19 47.36 1qqc s LEU 138 CO 0.18 -0.10 0.50 0.00 -0.29 0.00 0.00 176.35 176.64 1qqc s ALA 139 N 0.76 4.34 -0.08 5.97 0.00 -1.02 -0.92 121.76 130.81 1qqc s ALA 139 Ca -0.03 -1.79 -0.30 0.00 0.00 0.00 0.00 51.96 49.84 1qqc s ALA 139 Cb -0.04 -1.22 0.10 0.00 0.00 0.00 0.00 23.12 21.96 1qqc s ALA 139 CO -0.12 -0.37 0.87 -0.59 0.00 0.00 0.00 175.76 175.55 1qqc s PHE 140 N -2.51 -0.45 0.04 0.00 -0.12 -1.13 -2.02 117.98 111.79 1qqc s PHE 140 Ca 0.51 0.65 -0.14 0.00 -0.05 0.00 0.00 56.93 57.90 1qqc s PHE 140 Cb -0.05 0.47 0.02 0.00 -0.63 0.00 0.00 43.02 42.82 1qqc s PHE 140 CO 0.30 -0.48 0.30 0.34 -0.05 0.00 0.00 175.22 175.63 1qqc s ASP 141 N -1.52 -0.13 0.22 1.98 -1.08 0.50 -4.75 116.67 111.89 1qqc s ASP 141 Ca -0.03 -0.16 0.11 0.00 -0.52 0.00 0.00 52.55 51.95 1qqc s ASP 141 Cb -0.00 0.35 -0.05 0.00 -1.46 0.00 0.00 42.92 41.76 1qqc s ASP 141 CO 0.01 -0.60 -0.21 0.27 0.52 0.00 0.00 175.17 175.16 1qqc s ILE 142 N -2.42 2.26 -0.09 4.11 -4.36 -1.26 -1.00 121.20 118.44 1qqc s ILE 142 Ca -0.06 -2.15 -0.00 0.00 -0.26 0.00 0.00 60.65 58.18 1qqc s ILE 142 Cb -0.01 -2.13 0.02 0.00 1.25 0.00 0.00 42.46 41.59 1qqc s ILE 142 CO -0.03 -0.28 -0.06 -0.70 0.24 0.00 0.00 174.94 174.12 1qqc s GLU 143 N -3.03 1.27 0.03 0.37 2.56 0.42 -4.95 118.70 115.36 1qqc s GLU 143 Ca 0.23 -0.17 0.06 0.00 0.00 0.00 0.00 54.97 55.09 1qqc s GLU 143 Cb -0.06 -1.37 -0.03 0.00 2.00 0.00 0.00 34.13 34.67 1qqc s GLU 143 CO 0.11 -0.24 -0.14 0.99 -0.56 0.00 0.00 175.26 175.42 1qqc s THR 144 N 1.63 3.12 0.07 -1.70 2.01 -1.26 -0.75 115.64 118.76 1qqc s THR 144 Ca 0.02 -1.02 -0.31 0.00 0.31 0.00 0.00 61.69 60.69 1qqc s THR 144 Cb -0.13 -2.33 -0.08 0.00 0.01 0.00 0.00 72.50 69.97 1qqc s THR 144 CO -0.06 0.36 1.52 -1.48 -0.69 0.00 0.00 174.62 174.28 1qqc s LEU 145 N -1.43 4.35 -0.09 4.42 -0.00 -1.22 -4.91 118.68 119.81 1qqc s LEU 145 Ca 0.16 2.36 -0.29 0.00 -0.00 0.00 0.00 54.13 56.35 1qqc s LEU 145 Cb -0.11 -3.57 -0.05 0.00 -0.00 0.00 0.00 46.19 42.47 1qqc s LEU 145 CO 0.06 -0.79 1.62 -0.31 -0.00 0.00 0.00 176.35 176.93 1qqc s TYR 146 N 2.16 2.07 -0.75 3.48 4.12 -1.26 -4.85 117.35 122.32 1qqc s TYR 146 Ca 0.69 0.33 0.02 0.00 0.02 0.00 0.00 57.07 58.13 1qqc s TYR 146 Cb -0.37 -3.88 0.34 0.00 -1.52 0.00 0.00 41.96 36.53 1qqc s TYR 146 CO 0.30 -3.51 1.39 0.72 0.02 0.00 0.00 175.55 174.47 1qqc n HIS 147 N 7.33 3.42 0.00 2.71 -0.00 -1.26 -5.00 115.22 122.43 1qqc n HIS 147 Ca 0.17 -3.22 0.00 0.00 -0.00 0.00 0.00 57.72 54.67 1qqc n HIS 147 Cb 0.43 -0.76 0.00 0.00 -0.00 0.00 0.00 29.99 29.66 1qqc n HIS 147 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 1qqc n GLU 148 N -0.24 0.00 -1.72 -0.41 -0.58 -1.26 -2.95 120.64 113.48 1qqc n GLU 148 Ca 0.40 0.00 -0.22 0.00 -0.42 0.00 0.00 57.16 56.91 1qqc n GLU 148 Cb 0.36 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.17 1qqc n GLU 148 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1qqc s GLY 149 N 0.00 -0.44 0.68 0.62 0.00 -1.26 -4.90 107.32 102.02 1qqc s GLY 149 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 44.72 43.78 1qqc s GLY 149 CO 0.00 3.98 1.07 1.85 0.00 0.00 0.00 173.10 180.00 1qqc s GLU 150 N 8.19 2.87 -0.29 2.90 2.12 -1.15 -4.96 118.70 128.38 1qqc s GLU 150 Ca 0.86 1.14 0.08 0.00 0.36 0.00 0.00 54.97 57.41 1qqc s GLU 150 Cb -0.12 -1.97 0.28 0.00 0.26 0.00 0.00 34.13 32.57 1qqc s GLU 150 CO 0.10 -1.17 1.23 -0.85 -0.54 0.00 0.00 175.26 174.04 1qqc n GLU 151 N -2.81 0.90 0.00 4.30 0.00 -1.26 -5.09 120.64 116.68 1qqc n GLU 151 Ca 0.09 -1.05 0.00 0.00 0.00 0.00 0.00 57.16 56.19 1qqc n GLU 151 Cb 0.53 0.17 0.00 0.00 0.00 0.00 0.00 31.44 32.14 1qqc n GLU 151 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1qqc n PHE 152 N -0.89 0.00 0.00 -1.84 7.35 -1.26 -3.11 117.46 117.71 1qqc n PHE 152 Ca -0.12 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.57 1qqc n PHE 152 Cb 0.77 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.60 1qqc n PHE 152 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1qqc n GLY 153 N 0.23 4.05 3.58 7.13 0.00 -1.26 -5.07 105.19 113.85 1qqc n GLY 153 Ca 0.00 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 1qqc n GLY 153 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qqc s GLU 154 N 0.00 3.30 0.00 1.61 4.04 -1.18 -4.72 118.70 121.75 1qqc s GLU 154 Ca 0.00 0.59 0.00 0.00 0.04 0.00 0.00 54.97 55.60 1qqc s GLU 154 Cb 0.00 -4.13 0.00 0.00 0.02 0.00 0.00 34.13 30.02 1qqc s GLU 154 CO 0.00 -1.93 0.00 0.41 -1.84 0.00 0.00 175.26 171.90 1qqc n GLY 155 N 5.27 3.27 3.11 -3.83 0.00 -1.26 -4.74 105.19 107.00 1qqc n GLY 155 Ca 0.14 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 1qqc n GLY 155 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1qqc n PRO 156 N 0.00 -1.59 -3.37 1.61 -0.04 -1.26 -4.66 135.00 125.69 1qqc n PRO 156 Ca 0.00 -0.46 -0.45 0.00 -0.04 0.00 0.00 63.50 62.55 1qqc n PRO 156 Cb 0.00 -1.47 -0.06 0.00 -0.04 0.00 0.00 33.50 31.93 1qqc n PRO 156 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1qqc s ILE 157 N -2.12 4.96 0.15 0.52 1.01 -1.26 -3.39 121.20 121.06 1qqc s ILE 157 Ca 0.43 -1.56 -0.16 0.00 0.00 0.00 0.00 60.65 59.36 1qqc s ILE 157 Cb -0.05 -4.19 0.03 0.00 0.01 0.00 0.00 42.46 38.25 1qqc s ILE 157 CO 0.50 -0.84 1.74 -0.07 0.00 0.00 0.00 174.94 176.28 1qqc h LEU 158 N 8.78 0.09 -8.24 2.97 3.38 -1.29 -3.46 115.31 117.53 1qqc h LEU 158 Ca -0.28 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 1qqc h LEU 158 Cb 1.09 0.04 -0.13 0.00 0.09 0.00 0.00 40.66 41.76 1qqc h LEU 158 CO 0.99 0.09 -0.40 -0.04 0.09 0.00 0.00 178.44 179.16 1qqc s MET 159 N -6.16 1.16 -0.29 1.13 -1.94 -0.90 -4.32 119.30 107.98 1qqc s MET 159 Ca -0.13 -1.30 -0.05 0.00 -1.71 0.00 0.00 55.69 52.50 1qqc s MET 159 Cb 0.12 0.35 0.16 0.00 2.01 0.00 0.00 34.83 37.46 1qqc s MET 159 CO 0.71 -0.41 0.60 -1.50 -0.01 0.00 0.00 175.02 174.41 1qqc s ILE 160 N -4.02 -0.97 0.15 2.53 2.07 -1.19 -0.44 121.20 119.35 1qqc s ILE 160 Ca 0.22 0.00 0.09 0.00 -1.41 0.00 0.00 60.65 59.56 1qqc s ILE 160 Cb 0.04 -0.98 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 1qqc s ILE 160 CO 0.03 -0.00 -0.16 -0.94 -1.91 0.00 0.00 174.94 171.96 1qqc s SER 161 N 2.85 3.96 0.32 4.50 1.04 -0.17 -2.29 113.70 123.91 1qqc s SER 161 Ca 0.08 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.94 1qqc s SER 161 Cb -0.14 -0.57 -0.06 0.00 0.10 0.00 0.00 66.02 65.35 1qqc s SER 161 CO -0.20 0.14 0.06 -0.72 0.98 0.00 0.00 173.24 173.51 1qqc s TYR 162 N -1.43 1.93 -0.16 5.02 -0.85 -0.96 -0.37 117.35 120.53 1qqc s TYR 162 Ca 0.21 -0.98 -0.08 0.00 -0.52 0.00 0.00 57.07 55.69 1qqc s TYR 162 Cb -0.10 -1.25 0.06 0.00 0.38 0.00 0.00 41.96 41.05 1qqc s TYR 162 CO 0.12 -0.03 0.37 0.00 -1.52 0.00 0.00 175.55 174.50 1qqc s ALA 163 N -3.33 -0.95 0.08 9.51 0.00 -0.86 -3.25 121.76 122.97 1qqc s ALA 163 Ca 0.36 1.41 -0.03 0.00 0.00 0.00 0.00 51.96 53.70 1qqc s ALA 163 Cb 0.09 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 1qqc s ALA 163 CO 0.15 -0.30 0.05 0.34 0.00 0.00 0.00 175.76 176.00 1qqc s ASP 164 N 1.50 0.35 0.59 0.00 -1.08 -1.07 -2.43 116.67 114.54 1qqc s ASP 164 Ca -0.09 -0.96 0.29 0.00 -0.52 0.00 0.00 52.55 51.28 1qqc s ASP 164 Cb -0.09 0.26 1.34 0.00 -1.46 0.00 0.00 42.92 42.97 1qqc s ASP 164 CO -0.12 -0.67 1.72 -0.33 0.52 0.00 0.00 175.17 176.29 1qqc h GLU 165 N 2.98 0.00 -3.19 4.34 4.39 -2.00 -2.57 114.58 118.53 1qqc h GLU 165 Ca -0.34 0.00 -0.79 0.00 0.34 0.00 0.00 59.36 58.57 1qqc h GLU 165 Cb 1.17 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.59 1qqc h GLU 165 CO 0.62 0.00 1.27 -1.91 -1.16 0.00 0.00 179.01 177.82 1qqc n GLU 166 N -3.61 4.11 0.00 2.33 2.13 -1.26 -4.99 120.64 119.35 1qqc n GLU 166 Ca 0.15 -4.14 0.00 0.00 0.66 0.00 0.00 57.16 53.82 1qqc n GLU 166 Cb 0.98 -2.68 0.00 0.00 0.27 0.00 0.00 31.44 30.01 1qqc n GLU 166 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1qqc n GLY 167 N 1.98 -0.63 3.15 8.31 0.00 -0.97 -4.94 105.19 112.09 1qqc n GLY 167 Ca 0.31 -1.14 0.06 0.00 0.00 0.00 0.00 46.02 45.25 1qqc n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qqc s ALA 168 N -1.08 -3.92 0.51 4.61 0.00 -1.26 -2.58 121.76 118.03 1qqc s ALA 168 Ca 0.00 1.28 0.02 0.00 0.00 0.00 0.00 51.96 53.26 1qqc s ALA 168 Cb 0.00 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 1qqc s ALA 168 CO 0.00 -1.53 0.08 1.03 0.00 0.00 0.00 175.76 175.34 1qqc s ARG 169 N 2.99 2.20 -0.00 0.00 0.52 -1.20 -4.99 118.95 118.46 1qqc s ARG 169 Ca -0.08 -2.30 0.02 0.00 -0.52 0.00 0.00 55.73 52.85 1qqc s ARG 169 Cb -0.08 -1.65 -0.00 0.00 0.52 0.00 0.00 34.95 33.73 1qqc s ARG 169 CO -0.08 -0.39 -0.06 0.08 0.02 0.00 0.00 175.30 174.87 1qqc s VAL 170 N -2.84 0.49 -0.09 3.52 1.01 -1.13 -2.27 120.40 119.09 1qqc s VAL 170 Ca 0.13 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1qqc s VAL 170 Cb 0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.97 1qqc s VAL 170 CO 0.08 0.14 -0.22 -0.51 0.00 0.00 0.00 175.10 174.58 1qqc s ILE 171 N -0.16 2.29 0.11 2.22 1.10 -0.97 -0.60 121.20 125.20 1qqc s ILE 171 Ca 0.02 -0.95 -0.07 0.00 -0.51 0.00 0.00 60.65 59.14 1qqc s ILE 171 Cb -0.02 -1.88 -0.01 0.00 0.15 0.00 0.00 42.46 40.69 1qqc s ILE 171 CO -0.00 0.56 0.17 0.42 -2.11 0.00 0.00 174.94 173.98 1qqc s THR 172 N 0.15 0.12 -0.35 4.00 -4.23 0.37 -3.14 115.64 112.57 1qqc s THR 172 Ca -0.12 -1.43 0.08 0.00 -1.18 0.00 0.00 61.69 59.05 1qqc s THR 172 Cb -0.16 -1.62 0.63 0.00 1.34 0.00 0.00 72.50 72.69 1qqc s THR 172 CO 0.07 -0.56 1.71 -2.67 -0.54 0.00 0.00 174.62 172.63 1qqc n TRP 173 N -0.09 2.13 -4.45 3.99 4.27 -1.26 0.62 117.44 122.65 1qqc n TRP 173 Ca -0.11 -1.52 -0.23 0.00 -3.89 0.00 0.00 57.50 51.74 1qqc n TRP 173 Cb 0.63 -0.69 -0.09 0.00 -1.36 0.00 0.00 31.31 29.80 1qqc n TRP 173 CO 0.00 0.00 0.00 0.15 -2.29 0.00 0.00 177.69 175.55 1qqc s LYS 174 N -3.17 1.80 -0.20 -2.67 1.02 -1.26 -4.75 119.74 110.52 1qqc s LYS 174 Ca 0.52 -2.07 -0.09 0.00 0.02 0.00 0.00 55.97 54.35 1qqc s LYS 174 Cb 0.44 -0.49 -0.05 0.00 -0.52 0.00 0.00 37.83 37.21 1qqc s LYS 174 CO 0.08 -0.43 0.10 1.21 -0.92 0.00 0.00 175.35 175.39 1qqc s ASN 175 N -3.52 5.90 -0.16 2.83 3.84 -1.26 -4.52 114.94 118.05 1qqc s ASN 175 Ca 0.29 0.13 -0.08 0.00 0.21 0.00 0.00 52.86 53.41 1qqc s ASN 175 Cb 0.04 -2.03 0.06 0.00 -0.55 0.00 0.00 41.25 38.77 1qqc s ASN 175 CO 0.16 0.16 0.38 -0.63 -2.79 0.00 0.00 177.10 174.37 1qqc s ILE 176 N 0.49 -0.05 -0.43 -5.21 1.01 -1.26 -5.04 121.20 110.71 1qqc s ILE 176 Ca 0.06 0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.63 1qqc s ILE 176 Cb -0.12 -0.57 0.02 0.00 0.01 0.00 0.00 42.46 41.81 1qqc s ILE 176 CO -0.00 0.04 0.52 -0.62 0.00 0.00 0.00 174.94 174.88 1qqc s ASP 177 N 1.43 6.24 -0.13 3.58 -1.08 -1.26 -4.86 116.67 120.59 1qqc s ASP 177 Ca -0.09 -0.58 -0.29 0.00 -0.52 0.00 0.00 52.55 51.07 1qqc s ASP 177 Cb -0.09 -2.26 0.07 0.00 -1.46 0.00 0.00 42.92 39.18 1qqc s ASP 177 CO -0.12 -0.67 0.69 -0.76 0.52 0.00 0.00 175.17 174.84 1qqc s LEU 178 N 2.39 -0.68 0.00 -1.34 1.43 -1.26 -5.03 118.68 114.18 1qqc s LEU 178 Ca 0.16 0.97 0.12 0.00 -1.03 0.00 0.00 54.13 54.36 1qqc s LEU 178 Cb -0.16 2.51 0.72 0.00 0.03 0.00 0.00 46.19 49.29 1qqc s LEU 178 CO 0.15 -0.48 1.19 -0.81 0.23 0.00 0.00 176.35 176.63 1qqc n PRO 179 N 1.54 0.35 0.00 1.29 -0.04 -1.26 -3.20 135.00 133.68 1qqc n PRO 179 Ca -0.17 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1qqc n PRO 179 Cb 0.56 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1qqc n PRO 179 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1qqc n TYR 180 N -1.05 0.00 -2.63 0.54 0.18 -1.26 -5.08 117.16 107.86 1qqc n TYR 180 Ca 0.09 0.00 -0.25 0.00 1.88 0.00 0.00 57.90 59.62 1qqc n TYR 180 Cb 0.05 0.00 0.03 0.00 -0.38 0.00 0.00 39.34 39.04 1qqc n TYR 180 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1qqc s VAL 181 N -0.40 3.62 -0.02 -3.48 1.01 -1.19 -2.84 120.40 117.10 1qqc s VAL 181 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1qqc s VAL 181 Cb 0.00 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 33.00 1qqc s VAL 181 CO 0.00 -0.35 -0.00 -1.61 0.00 0.00 0.00 175.10 173.14 1qqc s GLU 182 N -4.82 0.18 -0.04 2.72 0.41 0.23 -4.91 118.70 112.48 1qqc s GLU 182 Ca 0.52 0.05 0.07 0.00 -0.41 0.00 0.00 54.97 55.20 1qqc s GLU 182 Cb -0.10 -0.32 -0.02 0.00 -1.78 0.00 0.00 34.13 31.91 1qqc s GLU 182 CO 0.42 -0.08 -0.25 -1.12 -0.49 0.00 0.00 175.26 173.74 1qqc s SER 183 N 0.66 3.11 0.20 -0.19 0.01 -1.24 0.14 113.70 116.38 1qqc s SER 183 Ca -0.06 -0.47 -0.03 0.00 1.31 0.00 0.00 55.95 56.69 1qqc s SER 183 Cb -0.09 -0.55 -0.03 0.00 0.21 0.00 0.00 66.02 65.56 1qqc s SER 183 CO -0.01 0.29 0.19 -0.69 0.41 0.00 0.00 173.24 173.43 1qqc s VAL 184 N -0.45 0.01 0.00 3.43 1.01 0.20 -4.94 120.40 119.66 1qqc s VAL 184 Ca 0.05 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.16 1qqc s VAL 184 Cb -0.11 -2.39 0.00 0.00 0.00 0.00 0.00 36.38 33.87 1qqc s VAL 184 CO 0.01 -0.05 0.20 -0.24 0.00 0.00 0.00 175.10 175.02 1qqc n SER 185 N -0.27 0.00 -4.76 3.32 2.88 -1.26 -4.07 113.62 109.46 1qqc n SER 185 Ca 0.01 0.20 -0.30 0.00 -1.33 0.00 0.00 58.87 57.44 1qqc n SER 185 Cb 0.65 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.04 1qqc n SER 185 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1qqc s THR 186 N -0.39 1.56 0.40 2.46 -1.32 -1.26 -4.77 115.64 112.32 1qqc s THR 186 Ca 0.00 -1.87 0.10 0.00 -1.21 0.00 0.00 61.69 58.71 1qqc s THR 186 Cb 0.00 -2.43 0.18 0.00 -1.51 0.00 0.00 72.50 68.74 1qqc s THR 186 CO 0.00 0.00 1.95 1.05 -2.21 0.00 0.00 174.62 175.41 1qqc h GLU 187 N 1.34 0.25 -0.31 7.08 4.11 -1.90 -1.13 114.58 124.01 1qqc h GLU 187 Ca -0.43 -0.05 -0.00 0.00 0.07 0.00 0.00 59.36 58.95 1qqc h GLU 187 Cb 1.29 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 1qqc h GLU 187 CO 0.72 0.34 0.19 0.87 0.07 0.00 0.00 179.01 181.21 1qqc h LYS 188 N 0.24 0.43 0.00 1.06 6.56 -1.95 0.25 116.57 123.16 1qqc h LYS 188 Ca 0.05 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 1qqc h LYS 188 Cb 0.30 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 31.87 1qqc h LYS 188 CO 0.01 0.32 0.00 0.93 -2.06 0.00 0.00 179.45 178.66 1qqc h GLU 189 N 0.41 0.00 0.01 3.15 4.39 -1.82 -1.63 114.58 119.09 1qqc h GLU 189 Ca 0.11 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 1qqc h GLU 189 Cb 0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1qqc h GLU 189 CO -0.02 0.00 -0.00 1.98 -1.16 0.00 0.00 179.01 179.81 1qqc h MET 190 N 0.00 -0.01 -0.51 2.33 4.05 0.12 -2.62 114.93 118.29 1qqc h MET 190 Ca 0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1qqc h MET 190 Cb 0.49 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.27 1qqc h MET 190 CO 0.00 0.79 0.29 0.82 0.23 0.00 0.00 176.91 179.04 1qqc h ILE 191 N -0.83 1.15 -0.14 1.77 2.04 -0.21 -0.29 117.51 121.01 1qqc h ILE 191 Ca -0.00 -0.36 -0.14 0.00 1.00 0.00 0.00 64.86 65.36 1qqc h ILE 191 Cb 0.80 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1qqc h ILE 191 CO 0.00 0.16 -0.52 0.11 0.00 0.00 0.00 178.15 177.91 1qqc h LYS 192 N 0.70 0.38 -0.22 2.37 1.57 -1.38 -2.29 116.57 117.71 1qqc h LYS 192 Ca 0.18 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1qqc h LYS 192 Cb -0.00 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1qqc h LYS 192 CO -0.03 0.81 0.06 -0.09 -0.57 0.00 0.00 179.45 179.63 1qqc h ARG 193 N 0.30 0.35 -0.30 3.15 1.12 -0.83 -2.02 114.38 116.15 1qqc h ARG 193 Ca 0.01 -0.08 0.06 0.00 -1.11 0.00 0.00 59.98 58.86 1qqc h ARG 193 Cb 1.01 -0.05 -0.05 0.00 -0.01 0.00 0.00 29.97 30.87 1qqc h ARG 193 CO 0.09 0.45 -0.05 0.35 -3.11 0.00 0.00 179.97 177.70 1qqc h PHE 194 N 0.19 -0.11 -0.93 2.20 -0.00 -0.97 -2.24 116.94 115.09 1qqc h PHE 194 Ca 0.07 0.03 -0.01 0.00 -0.00 0.00 0.00 57.97 58.05 1qqc h PHE 194 Cb 0.25 0.10 -0.04 0.00 -0.00 0.00 0.00 35.95 36.25 1qqc h PHE 194 CO 0.01 -0.10 0.53 -0.07 -0.00 0.00 0.00 178.31 178.67 1qqc h LEU 195 N 0.03 1.14 -1.83 0.59 3.38 -1.32 -1.89 115.31 115.41 1qqc h LEU 195 Ca 0.15 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1qqc h LEU 195 Cb 0.21 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1qqc h LEU 195 CO -0.29 0.89 -0.13 0.50 0.09 0.00 0.00 178.44 179.50 1qqc h LYS 196 N 1.29 0.00 0.49 1.13 3.64 -0.85 -2.23 116.57 120.05 1qqc h LYS 196 Ca 0.33 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 1qqc h LYS 196 Cb -0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1qqc h LYS 196 CO -0.06 0.13 -0.24 0.28 -2.27 0.00 0.00 179.45 177.30 1qqc h VAL 197 N 0.00 0.00 -0.76 2.00 2.07 -0.78 -2.89 116.25 115.89 1qqc h VAL 197 Ca -0.00 -0.43 0.13 0.00 0.82 0.00 0.00 66.70 67.22 1qqc h VAL 197 Cb 0.37 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.05 1qqc h VAL 197 CO 0.02 0.00 0.34 0.40 0.02 0.00 0.00 177.57 178.35 1qqc h ILE 198 N -1.09 0.71 -0.72 4.57 2.04 -1.49 0.29 117.51 121.82 1qqc h ILE 198 Ca -0.07 -0.18 0.16 0.00 1.00 0.00 0.00 64.86 65.78 1qqc h ILE 198 Cb 0.51 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 1qqc h ILE 198 CO 0.11 0.09 0.49 -0.61 0.00 0.00 0.00 178.15 178.24 1qqc h GLN 199 N 0.51 0.27 0.12 2.37 4.15 -1.46 0.57 115.11 121.66 1qqc h GLN 199 Ca 0.41 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.81 1qqc h GLN 199 Cb 0.58 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.21 1qqc h GLN 199 CO -0.37 0.18 -0.06 0.93 -1.93 0.00 0.00 178.83 177.59 1qqc h GLU 200 N 0.28 -0.16 -0.06 1.69 5.08 -0.23 -3.36 114.58 117.82 1qqc h GLU 200 Ca 0.35 0.01 -0.20 0.00 -1.00 0.00 0.00 59.36 58.52 1qqc h GLU 200 Cb 0.98 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1qqc h GLU 200 CO -0.09 0.24 -0.79 0.87 -1.00 0.00 0.00 179.01 178.24 1qqc h LYS 201 N -0.95 0.44 -5.66 2.33 1.57 -1.21 -3.49 116.57 109.60 1qqc h LYS 201 Ca -0.02 -0.39 -0.13 0.00 -1.87 0.00 0.00 60.65 58.24 1qqc h LYS 201 Cb 0.48 0.09 0.02 0.00 0.08 0.00 0.00 32.23 32.90 1qqc h LYS 201 CO 0.03 1.04 -0.31 -3.47 -0.57 0.00 0.00 179.45 176.17 1qqc n ASP 202 N -3.82 -7.07 -4.77 0.86 2.03 0.20 -4.95 116.55 99.03 1qqc n ASP 202 Ca -0.05 -0.33 -0.38 0.00 0.52 0.00 0.00 54.79 54.55 1qqc n ASP 202 Cb 0.75 -4.56 -0.00 0.00 -0.72 0.00 0.00 41.12 36.58 1qqc n ASP 202 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 1qqc s PRO 203 N -3.60 3.79 0.04 -0.67 0.02 -1.26 -4.94 135.00 128.37 1qqc s PRO 203 Ca 0.06 1.96 0.08 0.00 0.02 0.00 0.00 61.00 63.12 1qqc s PRO 203 Cb -0.01 -2.55 -0.23 0.00 0.02 0.00 0.00 34.50 31.73 1qqc s PRO 203 CO 0.78 -0.58 0.97 -0.44 -0.33 0.00 0.00 177.00 177.41 1qqc h ASP 204 N 2.27 0.05 -3.20 2.53 3.32 -1.61 -3.46 116.42 116.32 1qqc h ASP 204 Ca -0.49 -0.08 -0.50 0.00 0.02 0.00 0.00 57.03 55.98 1qqc h ASP 204 Cb 1.25 -0.02 -0.37 0.00 0.22 0.00 0.00 39.33 40.41 1qqc h ASP 204 CO 0.61 1.06 -0.79 -0.69 -1.72 0.00 0.00 179.24 177.71 1qqc s VAL 205 N -2.65 0.83 -0.22 -1.35 1.01 -1.07 -1.11 120.40 115.84 1qqc s VAL 205 Ca -0.03 -0.17 -0.09 0.00 0.00 0.00 0.00 61.98 61.70 1qqc s VAL 205 Cb 0.09 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1qqc s VAL 205 CO 0.83 0.34 0.11 -0.76 0.00 0.00 0.00 175.10 175.61 1qqc s LEU 206 N 1.78 3.93 -0.10 3.92 1.43 -0.27 -1.72 118.68 127.64 1qqc s LEU 206 Ca 0.05 0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.20 1qqc s LEU 206 Cb -0.12 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 1qqc s LEU 206 CO -0.07 0.10 -0.02 -0.63 0.23 0.00 0.00 176.35 175.96 1qqc s ILE 207 N 0.81 4.13 0.27 -0.59 1.01 -0.10 -1.04 121.20 125.70 1qqc s ILE 207 Ca 0.06 -0.31 -0.06 0.00 0.00 0.00 0.00 60.65 60.34 1qqc s ILE 207 Cb -0.13 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 1qqc s ILE 207 CO 0.02 0.58 0.39 0.42 0.00 0.00 0.00 174.94 176.36 1qqc s THR 208 N -0.61 0.00 -0.20 2.92 -4.23 -0.84 -2.83 115.64 109.84 1qqc s THR 208 Ca 0.10 -1.62 0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1qqc s THR 208 Cb -0.12 -2.42 0.04 0.00 1.34 0.00 0.00 72.50 71.34 1qqc s THR 208 CO 0.02 0.00 -0.13 -0.47 -0.54 0.00 0.00 174.62 173.50 1qqc s TYR 209 N -3.72 2.66 -1.83 3.99 5.04 -1.26 -1.28 117.35 120.94 1qqc s TYR 209 Ca 0.29 -1.73 0.00 0.00 -2.44 0.00 0.00 57.07 53.19 1qqc s TYR 209 Cb 0.01 -1.76 0.00 0.00 0.35 0.00 0.00 41.96 40.56 1qqc s TYR 209 CO 0.14 -0.78 0.00 -1.71 -1.34 0.00 0.00 175.55 171.86 1qqc n ASN 210 N 4.62 -5.68 0.14 4.32 5.15 -1.26 -4.85 115.26 117.70 1qqc n ASN 210 Ca -0.16 0.11 0.12 0.00 -0.60 0.00 0.00 54.58 54.05 1qqc n ASN 210 Cb 0.47 -4.80 0.51 0.00 -0.53 0.00 0.00 39.78 35.43 1qqc n ASN 210 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1qqc n GLY 211 N -0.86 -1.18 0.21 8.20 0.00 -1.26 -2.14 105.19 108.16 1qqc n GLY 211 Ca -0.23 0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.01 1qqc n GLY 211 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1qqc h ASP 212 N 0.00 0.00 -0.00 1.61 3.32 -1.88 -3.28 116.42 116.19 1qqc h ASP 212 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1qqc h ASP 212 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1qqc h ASP 212 CO 0.00 0.13 -0.01 0.59 -1.72 0.00 0.00 179.24 178.23 1qqc n ASN 213 N -3.16 0.77 0.02 6.45 3.02 -0.91 -3.96 115.26 117.50 1qqc n ASN 213 Ca 0.03 -0.89 0.00 0.00 -0.03 0.00 0.00 54.58 53.69 1qqc n ASN 213 Cb 0.53 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 40.00 1qqc n ASN 213 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1qqc n PHE 214 N -0.27 -0.43 -0.30 3.10 -0.00 -1.01 -4.86 117.46 113.69 1qqc n PHE 214 Ca 0.00 0.08 0.12 0.00 -0.00 0.00 0.00 57.45 57.65 1qqc n PHE 214 Cb 0.02 0.50 0.29 0.00 -0.00 0.00 0.00 39.48 40.30 1qqc n PHE 214 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 1qqc h ASP 215 N 0.00 0.29 0.88 -2.13 3.32 -1.74 -1.64 116.42 115.40 1qqc h ASP 215 Ca 0.00 0.15 -0.23 0.00 0.02 0.00 0.00 57.03 56.97 1qqc h ASP 215 Cb 0.00 0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1qqc h ASP 215 CO 0.00 -0.00 -1.10 -0.26 -1.72 0.00 0.00 179.24 176.15 1qqc h PHE 216 N 0.39 0.12 0.00 4.55 -1.00 -1.91 -2.94 116.94 116.14 1qqc h PHE 216 Ca 0.54 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 61.23 1qqc h PHE 216 Cb 1.01 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.56 1qqc h PHE 216 CO -0.15 1.07 0.00 0.00 -1.61 0.00 0.00 178.31 177.62 1qqc n ALA 217 N -2.41 2.48 -0.01 2.45 0.00 -0.68 -2.82 120.51 119.52 1qqc n ALA 217 Ca -0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 53.44 53.24 1qqc n ALA 217 Cb 0.97 -1.32 -0.02 0.00 0.00 0.00 0.00 19.45 19.08 1qqc n ALA 217 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1qqc n TYR 218 N -0.85 0.00 0.29 0.00 9.36 -0.83 -4.14 117.16 120.99 1qqc n TYR 218 Ca 0.15 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.49 1qqc n TYR 218 Cb 0.07 -0.22 0.59 0.00 -0.63 0.00 0.00 39.34 39.14 1qqc n TYR 218 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1qqc h LEU 219 N -0.35 0.00 0.00 2.98 3.38 -1.60 -1.42 115.31 118.30 1qqc h LEU 219 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1qqc h LEU 219 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1qqc h LEU 219 CO -0.04 0.00 -0.08 0.50 0.09 0.00 0.00 178.44 178.91 1qqc h LYS 220 N 0.00 0.00 -0.48 1.13 3.64 -1.76 -3.34 116.57 115.76 1qqc h LYS 220 Ca 0.04 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.51 1qqc h LYS 220 Cb 1.14 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.86 1qqc h LYS 220 CO -0.00 0.00 -0.23 -0.22 -2.27 0.00 0.00 179.45 176.73 1qqc h LYS 221 N -0.54 -0.12 -1.24 1.90 3.64 -1.51 0.17 116.57 118.88 1qqc h LYS 221 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1qqc h LYS 221 Cb 0.08 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1qqc h LYS 221 CO 0.00 -0.08 0.00 0.54 -2.27 0.00 0.00 179.45 177.64 1qqc n ARG 222 N -5.41 0.98 0.00 1.90 1.74 -0.61 -2.45 116.66 112.81 1qqc n ARG 222 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 1qqc n ARG 222 Cb 0.32 -1.01 0.00 0.00 -1.02 0.00 0.00 32.46 30.75 1qqc n ARG 222 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1qqc n SER 223 N 0.74 0.96 0.20 0.55 2.88 0.55 -4.34 113.62 115.16 1qqc n SER 223 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1qqc n SER 223 Cb 0.49 0.16 0.39 0.00 -0.75 0.00 0.00 64.21 64.50 1qqc n SER 223 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1qqc h GLU 224 N 0.00 0.00 0.01 -1.46 5.08 -1.05 -0.93 114.58 116.23 1qqc h GLU 224 Ca 0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.00 1qqc h GLU 224 Cb 0.07 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 1qqc h GLU 224 CO 0.00 0.30 -2.24 0.00 -1.00 0.00 0.00 179.01 176.07 1qqc n MET 225 N -3.48 0.68 0.00 2.33 0.00 -1.24 -3.91 117.12 111.50 1qqc n MET 225 Ca -0.00 0.10 0.11 0.00 0.00 0.00 0.00 57.70 57.91 1qqc n MET 225 Cb 0.47 -1.59 0.61 0.00 0.00 0.00 0.00 33.22 32.71 1qqc n MET 225 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1qqc n LEU 226 N -2.95 0.00 -2.91 3.17 4.32 -1.20 -4.87 117.00 112.55 1qqc n LEU 226 Ca -0.32 0.07 -0.17 0.00 -0.02 0.00 0.00 56.01 55.58 1qqc n LEU 226 Cb 1.10 -0.07 0.07 0.00 -1.62 0.00 0.00 43.42 42.89 1qqc n LEU 226 CO 0.40 -0.02 0.15 0.61 -1.22 0.00 0.00 177.39 177.31 1qqc n GLY 227 N 0.37 -0.20 3.34 -0.72 0.00 -0.94 -5.00 105.19 102.04 1qqc n GLY 227 Ca 0.14 0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 1qqc n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qqc s VAL 228 N -3.26 1.90 -0.47 1.61 1.01 -0.40 -5.05 120.40 115.74 1qqc s VAL 228 Ca 0.28 -1.85 -0.12 0.00 0.00 0.00 0.00 61.98 60.30 1qqc s VAL 228 Cb -0.12 -1.83 0.10 0.00 0.00 0.00 0.00 36.38 34.53 1qqc s VAL 228 CO 0.57 -0.21 0.36 -0.54 0.00 0.00 0.00 175.10 175.28 1qqc s LYS 229 N -2.55 2.70 -1.16 2.72 1.02 -1.26 -4.52 119.74 116.69 1qqc s LYS 229 Ca 0.14 -1.61 -0.23 0.00 0.02 0.00 0.00 55.97 54.30 1qqc s LYS 229 Cb -0.07 -4.00 -0.09 0.00 -0.52 0.00 0.00 37.83 33.15 1qqc s LYS 229 CO 0.07 -1.13 1.95 0.12 -0.92 0.00 0.00 175.35 175.43 1qqc s PHE 230 N 1.47 1.90 -0.27 3.18 5.36 -1.26 -4.93 117.98 123.44 1qqc s PHE 230 Ca 0.04 0.57 -0.11 0.00 -0.96 0.00 0.00 56.93 56.47 1qqc s PHE 230 Cb -0.26 -3.97 -0.05 0.00 -0.34 0.00 0.00 43.02 38.40 1qqc s PHE 230 CO 0.02 -1.22 0.20 0.42 -1.46 0.00 0.00 175.22 173.17 1qqc s ILE 231 N 11.23 5.31 0.00 3.12 -1.09 -1.26 -4.30 121.20 134.21 1qqc s ILE 231 Ca 0.69 0.20 0.00 0.00 -2.23 0.00 0.00 60.65 59.31 1qqc s ILE 231 Cb -0.01 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1qqc s ILE 231 CO 0.12 0.26 0.00 0.18 -1.23 0.00 0.00 174.94 174.28 1qqc n LEU 232 N 4.93 0.00 -4.74 2.97 4.77 -1.13 -5.00 117.00 118.79 1qqc n LEU 232 Ca -0.14 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.43 1qqc n LEU 232 Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1qqc n LEU 232 CO 0.34 0.00 0.99 -0.83 -1.33 0.00 0.00 177.39 176.56 1qqc s GLY 233 N -1.59 2.53 0.00 -0.72 0.00 -1.12 -4.86 107.32 101.56 1qqc s GLY 233 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 44.72 45.86 1qqc s GLY 233 CO 0.00 2.05 0.65 0.54 0.00 0.00 0.00 173.10 176.34 1qqc n ARG 234 N 2.31 0.00 -0.02 2.90 1.74 -0.59 0.74 116.66 123.75 1qqc n ARG 234 Ca 0.05 0.19 0.08 0.00 -0.77 0.00 0.00 57.85 57.40 1qqc n ARG 234 Cb 0.42 -1.53 0.08 0.00 -1.02 0.00 0.00 32.46 30.41 1qqc n ARG 234 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1qqc n ASP 235 N -1.15 2.43 0.00 0.55 5.75 -1.26 -4.98 116.55 117.90 1qqc n ASP 235 Ca 0.00 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.08 1qqc n ASP 235 Cb 0.03 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 1qqc n ASP 235 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qqc n GLY 236 N 0.92 0.70 4.02 6.12 0.00 0.23 -5.07 105.19 112.11 1qqc n GLY 236 Ca 0.10 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 1qqc n GLY 236 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qqc s SER 237 N -2.14 4.73 0.16 1.61 1.04 -1.25 -4.90 113.70 112.94 1qqc s SER 237 Ca 0.00 -0.69 0.02 0.00 0.48 0.00 0.00 55.95 55.76 1qqc s SER 237 Cb 0.00 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 66.34 1qqc s SER 237 CO 0.00 -1.61 0.30 -1.61 0.98 0.00 0.00 173.24 171.30 1qqc s GLU 238 N -4.89 3.46 0.23 4.02 2.02 -1.26 -2.80 118.70 119.47 1qqc s GLU 238 Ca 0.64 -0.54 -0.31 0.00 0.02 0.00 0.00 54.97 54.78 1qqc s GLU 238 Cb -0.05 -2.94 -0.14 0.00 0.10 0.00 0.00 34.13 31.10 1qqc s GLU 238 CO 0.42 0.50 1.32 -0.35 0.02 0.00 0.00 175.26 177.17 1qqc n PRO 239 N -0.53 1.78 -3.08 0.39 -0.04 -1.26 -4.90 135.00 127.36 1qqc n PRO 239 Ca -0.06 0.63 -0.44 0.00 -0.04 0.00 0.00 63.50 63.59 1qqc n PRO 239 Cb 0.54 -2.23 -0.05 0.00 -0.04 0.00 0.00 33.50 31.72 1qqc n PRO 239 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1qqc s LYS 240 N -0.51 3.09 -0.69 0.54 2.20 -0.44 -4.93 119.74 119.00 1qqc s LYS 240 Ca 0.69 -1.08 -0.27 0.00 -0.36 0.00 0.00 55.97 54.94 1qqc s LYS 240 Cb -0.70 -4.20 0.03 0.00 -1.51 0.00 0.00 37.83 31.45 1qqc s LYS 240 CO 0.51 -1.47 1.26 0.42 -0.36 0.00 0.00 175.35 175.72 1qqc s ILE 241 N 2.88 3.80 0.50 5.43 1.01 -1.26 -2.15 121.20 131.41 1qqc s ILE 241 Ca 0.15 0.56 0.08 0.00 0.00 0.00 0.00 60.65 61.43 1qqc s ILE 241 Cb -0.21 -4.85 0.08 0.00 0.01 0.00 0.00 42.46 37.49 1qqc s ILE 241 CO 0.09 -1.70 0.69 0.00 0.00 0.00 0.00 174.94 174.02 1qqc n GLN 242 N 9.10 0.63 -4.41 2.79 6.02 -0.30 -4.98 117.38 126.23 1qqc n GLN 242 Ca 0.05 -2.64 -0.27 0.00 -0.01 0.00 0.00 57.00 54.13 1qqc n GLN 242 Cb 0.49 -0.22 -0.17 0.00 1.02 0.00 0.00 30.24 31.36 1qqc n GLN 242 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1qqc s ARG 243 N -4.25 2.01 0.00 -1.09 1.04 -1.26 -2.60 118.95 112.79 1qqc s ARG 243 Ca 0.52 -0.49 0.00 0.00 -1.04 0.00 0.00 55.73 54.72 1qqc s ARG 243 Cb -0.04 -1.74 0.00 0.00 -2.04 0.00 0.00 34.95 31.13 1qqc s ARG 243 CO 0.33 -0.07 0.00 -1.33 -0.04 0.00 0.00 175.30 174.19 1qqc n MET 244 N 4.22 0.00 0.00 3.89 2.81 -1.19 -4.95 117.12 121.90 1qqc n MET 244 Ca -0.19 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.70 1qqc n MET 244 Cb 0.51 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.02 1qqc n MET 244 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1qqc n GLY 245 N 3.33 1.23 0.65 3.03 0.00 -1.26 -4.87 105.19 107.30 1qqc n GLY 245 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1qqc n GLY 245 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qqc n ASP 246 N 0.00 2.32 -0.02 1.61 -0.08 -1.26 -4.94 116.55 114.18 1qqc n ASP 246 Ca 0.00 -1.66 0.00 0.00 -1.51 0.00 0.00 54.79 51.62 1qqc n ASP 246 Cb 0.00 0.19 0.00 0.00 2.34 0.00 0.00 41.12 43.65 1qqc n ASP 246 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1qqc n ARG 247 N 0.65 3.78 -4.45 -0.67 1.74 -1.26 -5.17 116.66 111.28 1qqc n ARG 247 Ca 0.10 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.96 1qqc n ARG 247 Cb 0.46 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.80 1qqc n ARG 247 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1qqc s PHE 248 N 1.19 1.80 -0.06 -1.55 0.40 -1.26 -3.17 117.98 115.33 1qqc s PHE 248 Ca 0.00 -1.15 -0.13 0.00 -0.60 0.00 0.00 56.93 55.06 1qqc s PHE 248 Cb 0.00 -1.15 0.03 0.00 0.51 0.00 0.00 43.02 42.41 1qqc s PHE 248 CO 0.00 -0.20 0.30 0.00 0.70 0.00 0.00 175.22 176.03 1qqc s ALA 249 N -3.35 -0.76 0.01 5.36 0.00 -1.07 -4.53 121.76 117.42 1qqc s ALA 249 Ca 0.32 0.55 0.06 0.00 0.00 0.00 0.00 51.96 52.89 1qqc s ALA 249 Cb 0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1qqc s ALA 249 CO 0.15 -0.21 -0.18 0.08 0.00 0.00 0.00 175.76 175.60 1qqc s VAL 250 N -0.68 2.80 0.11 0.00 1.01 -1.26 -1.15 120.40 121.22 1qqc s VAL 250 Ca -0.08 -1.04 0.10 0.00 0.00 0.00 0.00 61.98 60.96 1qqc s VAL 250 Cb -0.04 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 1qqc s VAL 250 CO 0.02 0.44 -0.25 -0.70 0.00 0.00 0.00 175.10 174.61 1qqc s GLU 251 N -1.15 1.36 -0.32 2.72 2.12 -0.91 -4.77 118.70 117.75 1qqc s GLU 251 Ca 0.13 -1.28 -0.01 0.00 0.36 0.00 0.00 54.97 54.18 1qqc s GLU 251 Cb -0.10 -1.77 0.11 0.00 0.26 0.00 0.00 34.13 32.62 1qqc s GLU 251 CO 0.03 0.42 0.12 0.08 -0.54 0.00 0.00 175.26 175.38 1qqc s VAL 252 N -1.06 0.73 0.10 3.70 1.01 -1.26 -1.33 120.40 122.30 1qqc s VAL 252 Ca 0.12 -1.43 -0.35 0.00 0.00 0.00 0.00 61.98 60.31 1qqc s VAL 252 Cb -0.10 -1.56 -0.18 0.00 0.00 0.00 0.00 36.38 34.55 1qqc s VAL 252 CO 0.05 -0.73 1.08 0.29 0.00 0.00 0.00 175.10 175.79 1qqc n LYS 253 N 4.73 0.60 0.00 2.72 4.76 -1.26 -0.73 118.16 128.99 1qqc n LYS 253 Ca -0.01 0.22 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 1qqc n LYS 253 Cb 0.41 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 1qqc n LYS 253 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1qqc n GLY 254 N 1.93 2.80 0.00 0.72 0.00 -1.26 -1.54 105.19 107.84 1qqc n GLY 254 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1qqc n GLY 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qqc n ARG 255 N -0.45 2.47 -3.63 1.61 1.74 0.09 -4.91 116.66 113.58 1qqc n ARG 255 Ca 0.00 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.82 1qqc n ARG 255 Cb 0.00 0.00 -0.17 0.00 -1.02 0.00 0.00 32.46 31.27 1qqc n ARG 255 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1qqc s ILE 256 N 0.78 0.02 -0.52 0.55 1.01 -0.27 -4.77 121.20 117.99 1qqc s ILE 256 Ca 0.00 -0.20 -0.23 0.00 0.00 0.00 0.00 60.65 60.22 1qqc s ILE 256 Cb 0.00 -0.63 0.04 0.00 0.01 0.00 0.00 42.46 41.88 1qqc s ILE 256 CO 0.00 -0.25 0.84 -2.28 0.00 0.00 0.00 174.94 173.26 1qqc s HIS 257 N 2.09 2.89 -0.53 3.97 5.65 -1.26 -1.12 115.29 126.98 1qqc s HIS 257 Ca 0.02 -0.11 -0.17 0.00 0.25 0.00 0.00 55.06 55.05 1qqc s HIS 257 Cb -0.16 -3.88 0.09 0.00 -1.18 0.00 0.00 32.58 27.46 1qqc s HIS 257 CO -0.09 -1.22 0.55 0.12 -0.65 0.00 0.00 174.74 173.46 1qqc s PHE 258 N 3.53 3.14 -0.41 3.88 5.99 -0.20 -4.91 117.98 129.00 1qqc s PHE 258 Ca 0.27 -0.97 -0.19 0.00 0.00 0.00 0.00 56.93 56.04 1qqc s PHE 258 Cb -0.14 -3.65 0.02 0.00 0.00 0.00 0.00 43.02 39.25 1qqc s PHE 258 CO 0.18 -1.04 0.55 0.34 -0.00 0.00 0.00 175.22 175.25 1qqc s ASP 259 N 3.18 6.28 0.26 6.13 -1.08 -1.26 -2.00 116.67 128.19 1qqc s ASP 259 Ca 0.08 -0.35 -0.03 0.00 -0.52 0.00 0.00 52.55 51.72 1qqc s ASP 259 Cb -0.25 -2.28 0.38 0.00 -1.46 0.00 0.00 42.92 39.32 1qqc s ASP 259 CO 0.06 -0.64 1.87 -0.07 0.52 0.00 0.00 175.17 176.92 1qqc h LEU 260 N 9.34 0.99 -0.86 -1.34 3.38 -1.58 -3.31 115.31 121.93 1qqc h LEU 260 Ca -0.26 0.01 0.08 0.00 0.09 0.00 0.00 57.88 57.80 1qqc h LEU 260 Cb 1.11 -0.20 -0.11 0.00 0.09 0.00 0.00 40.66 41.55 1qqc h LEU 260 CO 0.83 0.63 -0.49 0.00 0.09 0.00 0.00 178.44 179.50 1qqc n TYR 261 N -4.53 -0.34 -0.07 1.13 9.36 -1.26 -1.67 117.16 119.77 1qqc n TYR 261 Ca 0.15 1.07 -0.07 0.00 3.32 0.00 0.00 57.90 62.37 1qqc n TYR 261 Cb 0.18 -0.59 -0.01 0.00 -0.63 0.00 0.00 39.34 38.29 1qqc n TYR 261 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 1qqc h PRO 262 N 0.00 -0.08 0.66 2.98 0.11 -1.89 -0.52 132.00 133.26 1qqc h PRO 262 Ca 0.15 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.24 1qqc h PRO 262 Cb 0.37 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 1qqc h PRO 262 CO -0.81 -0.06 -0.51 0.28 -0.21 0.00 0.00 178.00 176.70 1qqc h VAL 263 N -0.09 0.00 -0.63 3.15 2.07 -1.53 -2.83 116.25 116.40 1qqc h VAL 263 Ca 0.15 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.81 1qqc h VAL 263 Cb 0.31 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 1qqc h VAL 263 CO -0.34 0.00 0.43 0.40 0.02 0.00 0.00 177.57 178.08 1qqc h ILE 264 N -1.13 0.78 -0.05 4.57 2.04 -1.19 0.62 117.51 123.16 1qqc h ILE 264 Ca -0.09 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1qqc h ILE 264 Cb 0.93 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1qqc h ILE 264 CO 0.02 0.04 0.00 -1.14 0.00 0.00 0.00 178.15 177.07 1qqc n ARG 265 N -4.43 1.26 0.00 2.37 0.63 -0.22 -2.68 116.66 113.59 1qqc n ARG 265 Ca 0.12 -0.25 0.00 0.00 -0.92 0.00 0.00 57.85 56.80 1qqc n ARG 265 Cb 0.55 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 32.07 1qqc n ARG 265 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1qqc n ARG 266 N -0.08 0.14 -0.04 -0.14 0.63 0.17 -4.90 116.66 112.45 1qqc n ARG 266 Ca 0.02 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.88 1qqc n ARG 266 Cb 0.23 -0.47 -0.14 0.00 0.45 0.00 0.00 32.46 32.54 1qqc n ARG 266 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1qqc n THR 267 N -0.49 1.42 -4.61 5.15 -1.04 0.12 -4.86 114.28 109.97 1qqc n THR 267 Ca 0.00 -0.79 -0.32 0.00 -2.04 0.00 0.00 64.05 60.91 1qqc n THR 267 Cb 0.00 -0.78 -0.17 0.00 -1.82 0.00 0.00 70.33 67.56 1qqc n THR 267 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1qqc s ILE 268 N -2.65 1.92 -0.23 12.58 1.01 -1.09 -5.06 121.20 127.68 1qqc s ILE 268 Ca -0.06 -0.90 -0.14 0.00 0.00 0.00 0.00 60.65 59.55 1qqc s ILE 268 Cb 0.08 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 1qqc s ILE 268 CO 0.83 0.52 0.33 0.21 0.00 0.00 0.00 174.94 176.83 1qqc s ASN 269 N 0.86 6.31 0.06 3.58 3.84 -1.26 -4.58 114.94 123.74 1qqc s ASN 269 Ca -0.07 0.35 -0.08 0.00 0.21 0.00 0.00 52.86 53.28 1qqc s ASN 269 Cb -0.15 -2.19 -0.01 0.00 -0.55 0.00 0.00 41.25 38.35 1qqc s ASN 269 CO -0.02 -0.06 0.15 -0.76 -2.79 0.00 0.00 177.10 173.62 1qqc s LEU 270 N 1.42 1.58 0.04 3.21 1.43 -1.26 -5.08 118.68 120.02 1qqc s LEU 270 Ca 0.15 -0.55 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 1qqc s LEU 270 Cb -0.15 0.84 -0.17 0.00 0.03 0.00 0.00 46.19 46.74 1qqc s LEU 270 CO 0.08 -0.60 1.38 1.55 0.23 0.00 0.00 176.35 178.98 1qqc h PRO 271 N 3.25 -0.82 -4.13 1.29 0.13 -2.00 -3.42 132.00 126.31 1qqc h PRO 271 Ca -0.33 0.06 -0.53 0.00 -0.87 0.00 0.00 66.00 64.33 1qqc h PRO 271 Cb 1.19 0.19 -0.37 0.00 0.13 0.00 0.00 31.00 32.13 1qqc h PRO 271 CO 0.53 -0.50 -0.79 0.95 -0.23 0.00 0.00 178.00 177.95 1qqc s THR 272 N -5.32 0.98 0.25 1.56 -4.23 -1.26 -5.13 115.64 102.49 1qqc s THR 272 Ca -0.16 -0.40 -0.16 0.00 -1.18 0.00 0.00 61.69 59.79 1qqc s THR 272 Cb 0.02 -1.10 -0.08 0.00 1.34 0.00 0.00 72.50 72.69 1qqc s THR 272 CO 0.54 0.24 0.68 -0.31 -0.54 0.00 0.00 174.62 175.23 1qqc s TYR 273 N 1.71 3.52 -0.17 3.99 1.51 -1.26 -4.88 117.35 121.75 1qqc s TYR 273 Ca 0.03 1.21 -0.29 0.00 -1.01 0.00 0.00 57.07 57.01 1qqc s TYR 273 Cb -0.14 -2.50 0.10 0.00 -0.11 0.00 0.00 41.96 39.31 1qqc s TYR 273 CO -0.08 0.26 0.89 0.99 -1.11 0.00 0.00 175.55 176.50 1qqc s THR 274 N -1.71 0.00 0.27 -0.71 2.01 -1.26 -4.97 115.64 109.27 1qqc s THR 274 Ca 0.47 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.43 1qqc s THR 274 Cb -0.13 -1.00 0.32 0.00 0.01 0.00 0.00 72.50 71.70 1qqc s THR 274 CO 0.19 0.00 1.62 0.25 -0.69 0.00 0.00 174.62 175.99 1qqc h LEU 275 N 3.37 -0.33 -0.54 4.42 7.12 -1.98 0.81 115.31 128.17 1qqc h LEU 275 Ca -0.24 0.22 -0.14 0.00 0.13 0.00 0.00 57.88 57.85 1qqc h LEU 275 Cb 1.16 0.37 -0.02 0.00 -0.53 0.00 0.00 40.66 41.64 1qqc h LEU 275 CO 0.25 -0.22 -0.66 1.05 -0.13 0.00 0.00 178.44 178.73 1qqc h GLU 276 N 0.10 0.00 0.00 1.25 9.09 -1.96 -2.41 114.58 120.65 1qqc h GLU 276 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.90 1qqc h GLU 276 Cb 0.92 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.02 1qqc h GLU 276 CO -0.74 0.66 0.00 2.41 0.05 0.00 0.00 179.01 181.39 1qqc n THR 277 N -3.59 0.00 0.30 -1.06 -1.04 0.25 -3.26 114.28 105.88 1qqc n THR 277 Ca -0.00 1.06 0.11 0.00 -2.04 0.00 0.00 64.05 63.18 1qqc n THR 277 Cb 0.68 -1.97 0.51 0.00 -1.82 0.00 0.00 70.33 67.73 1qqc n THR 277 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1qqc h VAL 278 N 0.00 0.02 0.00 12.58 2.07 -0.65 0.15 116.25 130.43 1qqc h VAL 278 Ca 0.00 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.37 1qqc h VAL 278 Cb 0.00 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1qqc h VAL 278 CO 0.00 0.00 -0.70 0.22 0.02 0.00 0.00 177.57 177.11 1qqc h TYR 279 N 0.00 0.00 -0.01 1.57 3.20 -1.41 -3.20 116.97 117.12 1qqc h TYR 279 Ca 0.03 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 1qqc h TYR 279 Cb 1.26 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.54 1qqc h TYR 279 CO 0.00 0.70 -0.41 1.49 -1.64 0.00 0.00 178.16 178.30 1qqc h GLU 280 N 0.00 0.31 0.00 1.82 4.81 -0.94 -3.31 114.58 117.27 1qqc h GLU 280 Ca -0.01 -0.31 -0.02 0.00 -0.13 0.00 0.00 59.36 58.90 1qqc h GLU 280 Cb 1.40 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.86 1qqc h GLU 280 CO 0.09 1.00 -0.09 -1.00 -0.73 0.00 0.00 179.01 178.28 1qqc h PRO 281 N -0.27 0.00 -0.08 0.92 0.13 -1.67 -2.48 132.00 128.55 1qqc h PRO 281 Ca -0.05 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.97 1qqc h PRO 281 Cb 1.13 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.27 1qqc h PRO 281 CO 0.08 0.09 -0.40 0.28 -0.23 0.00 0.00 178.00 177.82 1qqc h VAL 282 N 0.00 1.40 -0.04 1.56 2.07 -1.64 -3.44 116.25 116.17 1qqc h VAL 282 Ca -0.00 -1.78 -0.19 0.00 0.82 0.00 0.00 66.70 65.56 1qqc h VAL 282 Cb 0.47 2.28 -0.17 0.00 -1.52 0.00 0.00 31.29 32.35 1qqc h VAL 282 CO 0.01 0.52 -0.35 2.22 0.02 0.00 0.00 177.57 179.99 1qqc n PHE 283 N -4.34 -1.91 0.00 1.57 1.16 -1.20 -5.11 117.46 107.63 1qqc n PHE 283 Ca -0.08 -1.80 0.00 0.00 -1.87 0.00 0.00 57.45 53.70 1qqc n PHE 283 Cb 0.55 1.44 0.00 0.00 -1.61 0.00 0.00 39.48 39.86 1qqc n PHE 283 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1qqc n GLY 284 N -1.31 3.21 3.25 4.97 0.00 -0.94 -5.07 105.19 109.30 1qqc n GLY 284 Ca -0.13 -0.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.92 1qqc n GLY 284 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1qqc s GLN 285 N 0.00 1.17 1.07 1.61 -2.07 -1.26 -5.00 119.66 115.18 1qqc s GLN 285 Ca 0.00 -1.48 -0.13 0.00 -1.82 0.00 0.00 55.36 51.93 1qqc s GLN 285 Cb 0.00 0.30 0.23 0.00 -1.09 0.00 0.00 33.01 32.45 1qqc s GLN 285 CO 0.00 -0.39 1.07 -1.25 -1.32 0.00 0.00 175.29 173.40 1qqc s PRO 286 N -4.09 -0.14 0.31 9.60 0.04 -1.26 -4.19 135.00 135.27 1qqc s PRO 286 Ca 0.31 0.61 -0.03 0.00 0.04 0.00 0.00 61.00 61.93 1qqc s PRO 286 Cb 0.06 -1.66 -0.01 0.00 0.04 0.00 0.00 34.50 32.93 1qqc s PRO 286 CO 0.08 -3.14 0.42 0.21 0.04 0.00 0.00 177.00 174.61 1qqc s LYS 287 N -4.78 1.77 0.05 4.56 2.20 -1.26 -5.04 119.74 117.23 1qqc s LYS 287 Ca 0.67 -1.70 0.08 0.00 -0.36 0.00 0.00 55.97 54.66 1qqc s LYS 287 Cb -0.21 0.42 -0.03 0.00 -1.51 0.00 0.00 37.83 36.50 1qqc s LYS 287 CO 0.60 -0.72 -0.24 -1.21 -0.36 0.00 0.00 175.35 173.43 1qqc s GLU 288 N -3.34 1.62 0.26 4.03 0.41 -1.26 -5.02 118.70 115.40 1qqc s GLU 288 Ca 0.31 -1.04 -0.20 0.00 -0.41 0.00 0.00 54.97 53.63 1qqc s GLU 288 Cb 0.01 -1.77 0.02 0.00 -1.78 0.00 0.00 34.13 30.61 1qqc s GLU 288 CO 0.19 0.46 0.66 0.21 -0.49 0.00 0.00 175.26 176.29 1qqc s LYS 289 N -1.22 1.68 0.00 1.61 2.36 -1.26 -5.04 119.74 117.87 1qqc s LYS 289 Ca 0.10 -0.97 0.00 0.00 -2.55 0.00 0.00 55.97 52.55 1qqc s LYS 289 Cb -0.09 0.58 0.00 0.00 -1.05 0.00 0.00 37.83 37.27 1qqc s LYS 289 CO 0.02 -0.76 0.00 0.28 1.55 0.00 0.00 175.35 176.44 1qqc n VAL 290 N -0.43 -1.04 -4.25 4.02 0.31 -1.26 -4.87 118.33 110.81 1qqc n VAL 290 Ca -0.05 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.00 1qqc n VAL 290 Cb 0.60 -1.30 -0.09 0.00 -0.91 0.00 0.00 33.84 32.14 1qqc n VAL 290 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1qqc s TYR 291 N 0.00 2.73 0.00 3.52 4.12 -1.26 -4.81 117.35 121.64 1qqc s TYR 291 Ca 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 57.07 56.91 1qqc s TYR 291 Cb 0.00 -1.35 0.00 0.00 -1.52 0.00 0.00 41.96 39.09 1qqc s TYR 291 CO 0.00 0.49 0.22 0.00 0.02 0.00 0.00 175.55 176.28 1qqc n ALA 292 N 0.17 0.54 0.28 3.71 0.00 -1.26 -4.78 120.51 119.18 1qqc n ALA 292 Ca -0.11 -0.22 0.18 0.00 0.00 0.00 0.00 53.44 53.29 1qqc n ALA 292 Cb 0.54 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.74 1qqc n ALA 292 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1qqc h GLU 293 N 0.00 0.00 -0.21 0.00 5.08 -2.00 -1.48 114.58 115.96 1qqc h GLU 293 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1qqc h GLU 293 Cb 0.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1qqc h GLU 293 CO 0.00 0.01 -0.06 0.93 -1.00 0.00 0.00 179.01 178.89 1qqc h GLU 294 N 0.00 0.33 -0.41 2.33 4.39 -1.98 -0.41 114.58 118.83 1qqc h GLU 294 Ca -0.00 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.56 1qqc h GLU 294 Cb 0.46 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1qqc h GLU 294 CO 0.00 0.41 -0.03 -0.84 -1.16 0.00 0.00 179.01 177.38 1qqc h ILE 295 N 0.32 1.27 -0.54 3.13 -2.65 -1.65 -1.57 117.51 115.81 1qqc h ILE 295 Ca 0.07 -1.08 -0.04 0.00 1.03 0.00 0.00 64.86 64.84 1qqc h ILE 295 Cb 0.31 1.15 -0.02 0.00 -2.05 0.00 0.00 36.82 36.20 1qqc h ILE 295 CO 0.01 0.37 0.19 0.00 0.03 0.00 0.00 178.15 178.75 1qqc h ALA 296 N 0.87 0.70 -0.01 0.16 0.00 -1.34 -2.19 119.26 117.45 1qqc h ALA 296 Ca 0.11 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1qqc h ALA 296 Cb 0.53 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1qqc h ALA 296 CO 0.03 0.34 -0.34 0.00 0.00 0.00 0.00 179.25 179.28 1qqc h ARG 297 N 0.74 0.02 -0.24 0.00 3.08 -1.01 -1.59 114.38 115.38 1qqc h ARG 297 Ca 0.18 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 60.07 1qqc h ARG 297 Cb 0.24 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1qqc h ARG 297 CO -0.01 0.36 -0.46 0.00 -1.07 0.00 0.00 179.97 178.79 1qqc h ALA 298 N 1.65 0.75 0.01 0.04 0.00 -0.84 -3.29 119.26 117.58 1qqc h ALA 298 Ca -0.00 -0.47 -0.24 0.00 0.00 0.00 0.00 54.91 54.20 1qqc h ALA 298 Cb 0.60 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1qqc h ALA 298 CO 0.04 0.67 -1.19 0.11 0.00 0.00 0.00 179.25 178.88 1qqc h TRP 299 N 0.49 0.05 -3.29 0.00 0.09 -1.11 -3.46 115.95 108.72 1qqc h TRP 299 Ca 0.03 -0.04 -0.65 0.00 0.09 0.00 0.00 58.89 58.33 1qqc h TRP 299 Cb 0.99 -0.00 -0.15 0.00 0.08 0.00 0.00 29.16 30.07 1qqc h TRP 299 CO 0.04 1.03 -0.74 -1.83 0.09 0.00 0.00 178.44 177.04 1qqc s GLU 300 N -2.68 2.06 -0.24 0.12 -1.05 -0.62 -5.04 118.70 111.24 1qqc s GLU 300 Ca -0.01 -1.16 -0.10 0.00 -0.15 0.00 0.00 54.97 53.55 1qqc s GLU 300 Cb 0.09 -2.21 -0.16 0.00 -0.44 0.00 0.00 34.13 31.41 1qqc s GLU 300 CO 0.83 0.47 -0.14 0.45 0.95 0.00 0.00 175.26 177.82 1qqc n SER 301 N 0.37 1.97 0.00 0.83 2.88 -1.26 -4.57 113.62 113.83 1qqc n SER 301 Ca -0.12 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1qqc n SER 301 Cb 0.54 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 1qqc n SER 301 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1qqc n GLY 302 N 1.64 -3.36 0.00 0.46 0.00 -1.26 -4.88 105.19 97.79 1qqc n GLY 302 Ca -0.46 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1qqc n GLY 302 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1qqc n GLU 303 N -1.79 0.00 0.00 1.61 1.02 -1.26 -4.63 120.64 115.58 1qqc n GLU 303 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1qqc n GLU 303 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1qqc n GLU 303 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qqc n GLY 304 N 0.00 1.81 0.26 0.62 0.00 -1.26 -4.50 105.19 102.12 1qqc n GLY 304 Ca 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 1qqc n GLY 304 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1qqc h LEU 305 N 0.00 -0.73 0.00 0.99 6.46 -1.88 0.15 115.31 120.31 1qqc h LEU 305 Ca 0.00 0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 1qqc h LEU 305 Cb 0.00 0.38 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 1qqc h LEU 305 CO 0.00 -0.24 0.00 1.21 -0.62 0.00 0.00 178.44 178.79 1qqc n GLU 306 N -5.39 0.02 -0.10 1.25 2.13 -1.26 -0.67 120.64 116.63 1qqc n GLU 306 Ca 0.02 0.33 -0.22 0.00 0.66 0.00 0.00 57.16 57.95 1qqc n GLU 306 Cb 0.30 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.39 1qqc n GLU 306 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1qqc n ARG 307 N -1.35 0.65 0.26 5.31 0.63 0.46 -4.23 116.66 118.38 1qqc n ARG 307 Ca 0.01 0.27 0.15 0.00 -0.92 0.00 0.00 57.85 57.36 1qqc n ARG 307 Cb 0.02 -1.59 0.85 0.00 0.45 0.00 0.00 32.46 32.19 1qqc n ARG 307 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1qqc h VAL 308 N -0.39 0.56 -0.34 5.15 2.07 -0.14 -0.63 116.25 122.53 1qqc h VAL 308 Ca -0.54 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1qqc h VAL 308 Cb 1.77 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 1qqc h VAL 308 CO -0.16 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.60 1qqc h ALA 309 N 1.91 0.44 -0.57 1.67 0.00 -1.54 -2.56 119.26 118.61 1qqc h ALA 309 Ca 0.04 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 54.94 1qqc h ALA 309 Cb 0.20 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 1qqc h ALA 309 CO -0.00 -0.01 0.20 0.00 0.00 0.00 0.00 179.25 179.44 1qqc h ARG 310 N 0.42 0.36 -0.68 0.00 2.47 -1.30 -1.45 114.38 114.19 1qqc h ARG 310 Ca 0.12 -0.02 0.14 0.00 -1.26 0.00 0.00 59.98 58.95 1qqc h ARG 310 Cb 0.10 -0.08 -0.13 0.00 -1.65 0.00 0.00 29.97 28.21 1qqc h ARG 310 CO -0.02 0.24 -0.15 -0.92 0.56 0.00 0.00 179.97 179.68 1qqc h TYR 311 N 0.37 -0.33 0.00 3.04 -0.00 -1.32 -1.90 116.97 116.83 1qqc h TYR 311 Ca 0.28 0.06 0.00 0.00 -0.00 0.00 0.00 58.73 59.07 1qqc h TYR 311 Cb 0.34 0.25 0.00 0.00 -0.00 0.00 0.00 36.73 37.33 1qqc h TYR 311 CO -0.17 -0.29 0.00 0.43 -0.00 0.00 0.00 178.16 178.13 1qqc n SER 312 N -5.44 0.00 0.13 -2.11 7.64 -0.56 -0.98 113.62 112.30 1qqc n SER 312 Ca 0.09 0.94 0.17 0.00 1.01 0.00 0.00 58.87 61.08 1qqc n SER 312 Cb 0.36 -0.44 0.56 0.00 -1.01 0.00 0.00 64.21 63.68 1qqc n SER 312 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1qqc h MET 313 N 0.00 0.00 0.06 1.43 -0.00 -1.42 0.89 114.93 115.90 1qqc h MET 313 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 59.70 59.47 1qqc h MET 313 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 31.60 31.62 1qqc h MET 313 CO 0.00 0.00 -0.93 0.93 -0.00 0.00 0.00 176.91 176.91 1qqc h GLU 314 N 0.00 0.52 -0.47 -0.10 5.08 -0.91 -0.92 114.58 117.78 1qqc h GLU 314 Ca 0.17 -0.64 0.01 0.00 -1.00 0.00 0.00 59.36 57.90 1qqc h GLU 314 Cb 1.55 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.98 1qqc h GLU 314 CO -0.00 1.26 0.31 -0.44 -1.00 0.00 0.00 179.01 179.14 1qqc h ASP 315 N 0.07 0.54 -0.87 1.42 3.45 0.25 0.11 116.42 121.39 1qqc h ASP 315 Ca -0.13 -0.01 0.03 0.00 0.43 0.00 0.00 57.03 57.35 1qqc h ASP 315 Cb 1.63 -0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 40.22 1qqc h ASP 315 CO 0.18 0.39 0.57 0.00 -1.57 0.00 0.00 179.24 178.81 1qqc h ALA 316 N 1.18 1.45 0.16 3.45 0.00 -0.99 -1.38 119.26 123.12 1qqc h ALA 316 Ca 0.17 -0.04 -0.27 0.00 0.00 0.00 0.00 54.91 54.78 1qqc h ALA 316 Cb -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.43 1qqc h ALA 316 CO -0.04 0.46 -1.27 -0.22 0.00 0.00 0.00 179.25 178.19 1qqc h LYS 317 N 1.09 0.33 -0.06 0.00 3.64 -0.76 -2.63 116.57 118.18 1qqc h LYS 317 Ca 0.34 -0.57 0.02 0.00 -1.27 0.00 0.00 60.65 59.17 1qqc h LYS 317 Cb 0.02 0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1qqc h LYS 317 CO -0.10 1.27 0.09 0.00 -2.27 0.00 0.00 179.45 178.44 1qqc h ALA 318 N 0.05 1.49 0.03 5.00 0.00 -0.71 -1.88 119.26 123.24 1qqc h ALA 318 Ca -0.25 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1qqc h ALA 318 Cb 1.83 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.63 1qqc h ALA 318 CO 0.14 -0.12 -0.38 1.15 0.00 0.00 0.00 179.25 180.04 1qqc h THR 319 N 0.00 1.59 0.00 0.00 2.02 -1.27 -3.17 112.91 112.09 1qqc h THR 319 Ca 0.03 -2.36 -0.01 0.00 0.77 0.00 0.00 66.41 64.84 1qqc h THR 319 Cb 0.21 3.17 -0.00 0.00 -1.74 0.00 0.00 68.15 69.79 1qqc h THR 319 CO -0.00 0.59 -0.03 0.22 0.37 0.00 0.00 175.52 176.67 1qqc h TYR 320 N -0.86 0.00 0.00 3.16 3.20 -0.97 -2.08 116.97 119.42 1qqc h TYR 320 Ca -0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.78 1qqc h TYR 320 Cb 1.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.46 1qqc h TYR 320 CO 0.23 0.03 -1.50 0.39 -1.64 0.00 0.00 178.16 175.67 1qqc n GLU 321 N -4.15 0.55 0.10 1.82 1.02 -0.90 -2.93 120.64 116.15 1qqc n GLU 321 Ca -0.03 -0.07 -0.17 0.00 -0.02 0.00 0.00 57.16 56.87 1qqc n GLU 321 Cb 0.12 -1.62 -0.14 0.00 -0.02 0.00 0.00 31.44 29.78 1qqc n GLU 321 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1qqc h LEU 322 N 0.00 0.48 -1.29 -4.62 3.38 -1.49 -3.04 115.31 108.74 1qqc h LEU 322 Ca 0.00 -0.54 -0.07 0.00 0.09 0.00 0.00 57.88 57.36 1qqc h LEU 322 Cb 0.93 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1qqc h LEU 322 CO 0.00 1.43 -0.26 1.23 0.09 0.00 0.00 178.44 180.93 1qqc h GLY 323 N 1.39 0.16 2.00 0.83 0.00 -1.50 0.12 103.07 106.07 1qqc h GLY 323 Ca -0.17 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1qqc h GLY 323 CO 0.21 0.11 0.00 1.17 0.00 0.00 0.00 176.54 178.02 1qqc n LYS 324 N -4.18 0.04 -0.06 4.80 4.81 -1.15 -2.35 118.16 120.06 1qqc n LYS 324 Ca -0.01 0.16 -0.12 0.00 -0.87 0.00 0.00 58.31 57.46 1qqc n LYS 324 Cb 0.35 -1.56 -0.14 0.00 0.02 0.00 0.00 35.03 33.69 1qqc n LYS 324 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1qqc n GLU 325 N -1.64 0.67 -0.07 1.64 4.07 -0.03 -4.47 120.64 120.82 1qqc n GLU 325 Ca 0.05 0.16 0.08 0.00 -0.06 0.00 0.00 57.16 57.39 1qqc n GLU 325 Cb 0.27 -1.64 0.11 0.00 -0.06 0.00 0.00 31.44 30.12 1qqc n GLU 325 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 1qqc n PHE 326 N -3.02 0.17 -0.05 4.31 3.01 -0.82 -4.64 117.46 116.42 1qqc n PHE 326 Ca -0.29 -0.12 -0.13 0.00 1.01 0.00 0.00 57.45 57.91 1qqc n PHE 326 Cb 1.08 -0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 40.48 1qqc n PHE 326 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 1qqc h PHE 327 N 3.19 0.36 -0.22 1.38 3.57 -1.69 -3.24 116.94 120.29 1qqc h PHE 327 Ca 0.00 -0.11 0.06 0.00 3.53 0.00 0.00 57.97 61.45 1qqc h PHE 327 Cb 0.73 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.32 1qqc h PHE 327 CO 0.09 0.70 -0.25 -1.35 -2.23 0.00 0.00 178.31 175.27 1qqc h PRO 328 N -0.08 -0.26 -0.81 6.41 0.11 -1.86 -0.02 132.00 135.50 1qqc h PRO 328 Ca 0.02 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 1qqc h PRO 328 Cb 0.63 0.06 -0.04 0.00 0.11 0.00 0.00 31.00 31.76 1qqc h PRO 328 CO 0.03 -0.17 0.47 0.52 -0.21 0.00 0.00 178.00 178.63 1qqc h MET 329 N -0.27 1.11 -0.15 1.05 2.86 -1.88 -1.58 114.93 116.08 1qqc h MET 329 Ca 0.13 -0.11 -0.13 0.00 -2.06 0.00 0.00 59.70 57.53 1qqc h MET 329 Cb 0.47 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1qqc h MET 329 CO -0.37 0.80 -0.47 0.93 1.06 0.00 0.00 176.91 178.85 1qqc h GLU 330 N 1.13 0.37 -0.38 1.72 4.39 -1.48 -1.88 114.58 118.44 1qqc h GLU 330 Ca 0.29 -0.20 -0.16 0.00 0.34 0.00 0.00 59.36 59.62 1qqc h GLU 330 Cb -0.01 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1qqc h GLU 330 CO -0.05 0.77 -0.39 0.00 -1.16 0.00 0.00 179.01 178.18 1qqc h ALA 331 N 1.20 0.57 -0.10 3.43 0.00 -0.60 -2.17 119.26 121.59 1qqc h ALA 331 Ca 0.02 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 1qqc h ALA 331 Cb 0.95 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1qqc h ALA 331 CO 0.08 0.68 -0.50 1.96 0.00 0.00 0.00 179.25 181.47 1qqc h GLN 332 N 0.77 0.27 -0.50 0.00 1.08 -1.22 -2.29 115.11 113.22 1qqc h GLN 332 Ca 0.06 -0.15 -0.07 0.00 -1.45 0.00 0.00 58.65 57.04 1qqc h GLN 332 Cb 0.99 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.41 1qqc h GLN 332 CO 0.10 0.71 0.03 -0.07 -0.95 0.00 0.00 178.83 178.65 1qqc h LEU 333 N 0.22 0.76 0.00 1.46 3.38 -1.23 -0.58 115.31 119.32 1qqc h LEU 333 Ca 0.01 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1qqc h LEU 333 Cb 0.96 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1qqc h LEU 333 CO 0.08 0.81 -0.00 0.28 0.09 0.00 0.00 178.44 179.70 1qqc h SER 334 N 0.76 -0.00 -0.64 -0.43 0.02 -1.00 -1.25 113.55 111.01 1qqc h SER 334 Ca 0.15 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1qqc h SER 334 Cb 0.41 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1qqc h SER 334 CO 0.01 0.15 0.27 -0.09 -1.14 0.00 0.00 176.83 176.03 1qqc h ARG 335 N -0.15 0.94 -0.48 3.45 2.43 -1.26 0.13 114.38 119.45 1qqc h ARG 335 Ca -0.00 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 58.97 1qqc h ARG 335 Cb 0.15 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1qqc h ARG 335 CO 0.00 0.78 0.15 1.25 -1.51 0.00 0.00 179.97 180.64 1qqc h LEU 336 N 0.89 0.69 0.00 3.80 5.85 -1.00 -3.26 115.31 122.28 1qqc h LEU 336 Ca 0.21 -0.20 -0.15 0.00 0.84 0.00 0.00 57.88 58.58 1qqc h LEU 336 Cb 0.18 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1qqc h LEU 336 CO -0.02 0.71 -0.81 0.58 -0.34 0.00 0.00 178.44 178.56 1qqc h VAL 337 N 0.64 1.12 0.00 1.05 2.07 -1.12 -3.49 116.25 116.51 1qqc h VAL 337 Ca 0.15 -2.63 0.00 0.00 0.82 0.00 0.00 66.70 65.04 1qqc h VAL 337 Cb 0.27 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1qqc h VAL 337 CO -0.01 0.64 0.00 0.61 0.02 0.00 0.00 177.57 178.83 1qqc n GLY 338 N 1.30 0.78 3.24 2.17 0.00 0.46 -4.37 105.19 108.77 1qqc n GLY 338 Ca -0.01 -0.61 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 1qqc n GLY 338 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qqc s GLN 339 N -1.87 1.15 0.75 1.61 -1.52 -1.18 -4.74 119.66 113.85 1qqc s GLN 339 Ca 0.00 -1.57 -0.13 0.00 -1.95 0.00 0.00 55.36 51.71 1qqc s GLN 339 Cb 0.00 -0.19 0.05 0.00 -0.22 0.00 0.00 33.01 32.65 1qqc s GLN 339 CO 0.00 -0.19 1.13 -1.54 -0.25 0.00 0.00 175.29 174.45 1qqc s SER 340 N -3.18 4.36 0.43 5.90 1.04 -1.26 -4.62 113.70 116.36 1qqc s SER 340 Ca 0.27 2.07 0.20 0.00 0.48 0.00 0.00 55.95 58.96 1qqc s SER 340 Cb 0.07 -2.55 0.98 0.00 0.10 0.00 0.00 66.02 64.62 1qqc s SER 340 CO 0.06 -2.14 1.90 0.25 0.98 0.00 0.00 173.24 174.28 1qqc h LEU 341 N -0.69 0.00 0.35 2.42 5.85 -1.91 -1.09 115.31 120.24 1qqc h LEU 341 Ca -0.45 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.25 1qqc h LEU 341 Cb 1.26 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 1qqc h LEU 341 CO 0.50 0.27 -0.21 -0.25 -0.34 0.00 0.00 178.44 178.41 1qqc h TRP 342 N 0.00 -0.55 -0.26 1.25 7.01 -1.91 -1.37 115.95 120.12 1qqc h TRP 342 Ca -0.00 -0.01 -0.16 0.00 2.11 0.00 0.00 58.89 60.83 1qqc h TRP 342 Cb 0.59 0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.84 1qqc h TRP 342 CO 0.00 -0.33 -0.45 -0.44 -2.79 0.00 0.00 178.44 174.43 1qqc h ASP 343 N -0.54 0.84 -0.58 2.65 3.32 -1.90 -3.30 116.42 116.92 1qqc h ASP 343 Ca -0.04 -0.53 -0.06 0.00 0.02 0.00 0.00 57.03 56.42 1qqc h ASP 343 Cb 0.44 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1qqc h ASP 343 CO 0.04 1.21 0.12 0.58 -1.72 0.00 0.00 179.24 179.48 1qqc h VAL 344 N 0.50 1.25 0.00 -1.35 2.07 -1.19 -2.45 116.25 115.09 1qqc h VAL 344 Ca 0.02 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.61 1qqc h VAL 344 Cb 1.05 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1qqc h VAL 344 CO 0.10 0.34 0.00 -1.54 0.02 0.00 0.00 177.57 176.49 1qqc n SER 345 N -4.36 0.05 -0.41 0.57 3.41 -0.52 -2.39 113.62 109.97 1qqc n SER 345 Ca 0.03 0.52 0.04 0.00 -0.26 0.00 0.00 58.87 59.19 1qqc n SER 345 Cb 0.25 -0.53 0.08 0.00 -0.26 0.00 0.00 64.21 63.75 1qqc n SER 345 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1qqc n ARG 346 N -1.56 1.72 -4.05 4.33 1.74 -0.95 -4.17 116.66 113.72 1qqc n ARG 346 Ca 0.03 -1.51 -0.23 0.00 -0.77 0.00 0.00 57.85 55.37 1qqc n ARG 346 Cb 0.14 -1.18 -0.06 0.00 -1.02 0.00 0.00 32.46 30.34 1qqc n ARG 346 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1qqc s SER 347 N -0.87 4.87 0.62 0.55 1.04 -1.01 -5.08 113.70 113.82 1qqc s SER 347 Ca 0.14 -0.66 -0.08 0.00 0.48 0.00 0.00 55.95 55.83 1qqc s SER 347 Cb 0.08 -0.84 -0.00 0.00 0.10 0.00 0.00 66.02 65.36 1qqc s SER 347 CO 0.11 -0.27 0.97 -0.94 0.98 0.00 0.00 173.24 174.09 1qqc s SER 348 N -3.87 5.69 0.40 7.02 1.04 -1.26 -4.93 113.70 117.80 1qqc s SER 348 Ca 0.38 0.95 0.07 0.00 0.48 0.00 0.00 55.95 57.83 1qqc s SER 348 Cb -0.04 -1.93 0.83 0.00 0.10 0.00 0.00 66.02 64.98 1qqc s SER 348 CO 0.23 -1.08 2.02 0.71 0.98 0.00 0.00 173.24 176.11 1qqc h THR 349 N -0.30 1.12 -0.36 2.02 1.35 -1.99 -1.93 112.91 112.82 1qqc h THR 349 Ca -0.45 -0.34 0.06 0.00 -0.55 0.00 0.00 66.41 65.13 1qqc h THR 349 Cb 1.24 0.67 -0.05 0.00 -1.73 0.00 0.00 68.15 68.27 1qqc h THR 349 CO 0.62 0.14 0.03 1.23 -0.25 0.00 0.00 175.52 177.29 1qqc h GLY 350 N 0.59 0.38 1.95 5.82 0.00 -1.93 -0.91 103.07 108.98 1qqc h GLY 350 Ca 0.13 0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.41 1qqc h GLY 350 CO -0.02 -0.06 -0.28 3.43 0.00 0.00 0.00 176.54 179.61 1qqc h ASN 351 N 0.14 0.06 -0.38 0.19 2.35 -1.75 -2.04 115.58 114.15 1qqc h ASN 351 Ca 0.17 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 1qqc h ASN 351 Cb 0.23 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1qqc h ASN 351 CO -0.27 0.34 0.08 -0.07 -1.65 0.00 0.00 177.43 175.86 1qqc h LEU 352 N 0.05 0.59 -0.24 1.61 3.38 -0.54 -1.45 115.31 118.71 1qqc h LEU 352 Ca 0.01 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1qqc h LEU 352 Cb 0.52 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1qqc h LEU 352 CO 0.04 0.68 0.13 0.58 0.09 0.00 0.00 178.44 179.96 1qqc h VAL 353 N 0.47 1.11 0.17 1.22 2.07 -0.92 -2.11 116.25 118.26 1qqc h VAL 353 Ca 0.12 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1qqc h VAL 353 Cb 0.34 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1qqc h VAL 353 CO 0.00 0.11 -0.46 -0.08 0.02 0.00 0.00 177.57 177.16 1qqc h GLU 354 N 0.28 -0.70 -0.92 1.57 4.57 -1.17 0.20 114.58 118.41 1qqc h GLU 354 Ca 0.08 0.05 0.24 0.00 -1.18 0.00 0.00 59.36 58.56 1qqc h GLU 354 Cb 0.06 0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.76 1qqc h GLU 354 CO -0.01 -0.47 0.64 -1.49 -1.18 0.00 0.00 179.01 176.49 1qqc h TRP 355 N -0.73 0.23 -0.20 0.92 -0.00 -1.16 -0.28 115.95 114.73 1qqc h TRP 355 Ca 0.00 0.01 -0.19 0.00 -0.00 0.00 0.00 58.89 58.71 1qqc h TRP 355 Cb 0.73 -0.07 0.01 0.00 -0.00 0.00 0.00 29.16 29.83 1qqc h TRP 355 CO -0.38 0.05 -0.61 0.35 -0.00 0.00 0.00 178.44 177.85 1qqc h PHE 356 N 0.17 1.00 -0.33 0.49 3.57 -0.33 -3.18 116.94 118.33 1qqc h PHE 356 Ca 0.46 -0.40 -0.14 0.00 3.53 0.00 0.00 57.97 61.42 1qqc h PHE 356 Cb 1.53 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.09 1qqc h PHE 356 CO -0.00 1.22 -0.36 -0.07 -2.23 0.00 0.00 178.31 176.87 1qqc h LEU 357 N 0.50 0.80 -1.36 0.59 3.38 0.62 -2.89 115.31 116.96 1qqc h LEU 357 Ca -0.02 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1qqc h LEU 357 Cb 1.23 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1qqc h LEU 357 CO 0.13 1.08 0.06 -0.07 0.09 0.00 0.00 178.44 179.72 1qqc h LEU 358 N 0.63 0.45 -0.08 1.67 3.38 -1.35 0.14 115.31 120.15 1qqc h LEU 358 Ca 0.06 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1qqc h LEU 358 Cb 0.90 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1qqc h LEU 358 CO 0.08 0.48 -0.13 -0.09 0.09 0.00 0.00 178.44 178.86 1qqc h ARG 359 N 0.48 0.24 -0.73 1.13 2.43 -1.52 -2.49 114.38 113.92 1qqc h ARG 359 Ca 0.11 -0.14 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 1qqc h ARG 359 Cb 0.22 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1qqc h ARG 359 CO -0.00 0.72 0.21 0.87 -1.51 0.00 0.00 179.97 180.25 1qqc h LYS 360 N -0.22 1.15 -0.68 0.20 1.79 -1.27 -1.54 116.57 115.99 1qqc h LYS 360 Ca 0.01 -0.26 0.06 0.00 -2.18 0.00 0.00 60.65 58.27 1qqc h LYS 360 Cb 0.70 -0.16 -0.05 0.00 -1.58 0.00 0.00 32.23 31.13 1qqc h LYS 360 CO 0.03 0.99 0.38 0.00 -1.08 0.00 0.00 179.45 179.77 1qqc h ALA 361 N 1.11 0.91 -0.08 3.86 0.00 -0.71 0.03 119.26 124.38 1qqc h ALA 361 Ca 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1qqc h ALA 361 Cb 0.34 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1qqc h ALA 361 CO -0.00 0.07 0.02 -0.92 0.00 0.00 0.00 179.25 178.41 1qqc h TYR 362 N 0.71 0.13 -0.98 0.00 3.20 -1.16 0.34 116.97 119.21 1qqc h TYR 362 Ca 0.30 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.38 1qqc h TYR 362 Cb 0.17 -0.04 -0.09 0.00 1.54 0.00 0.00 36.73 38.32 1qqc h TYR 362 CO -0.07 0.31 0.63 0.93 -1.64 0.00 0.00 178.16 178.32 1qqc h GLU 363 N -0.09 0.50 -0.42 1.82 5.08 -0.41 -1.90 114.58 119.15 1qqc h GLU 363 Ca 0.02 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1qqc h GLU 363 Cb 0.25 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1qqc h GLU 363 CO 0.00 0.33 0.00 0.54 -1.00 0.00 0.00 179.01 178.88 1qqc n ARG 364 N -4.63 3.41 -3.82 2.33 1.74 -0.08 -4.98 116.66 110.63 1qqc n ARG 364 Ca 0.23 -2.74 -0.28 0.00 -0.77 0.00 0.00 57.85 54.29 1qqc n ARG 364 Cb 0.72 -1.80 0.04 0.00 -1.02 0.00 0.00 32.46 30.40 1qqc n ARG 364 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1qqc n ASN 365 N 0.28 -4.59 -4.46 0.55 5.15 -0.61 -4.94 115.26 106.64 1qqc n ASN 365 Ca 0.21 -0.74 -0.36 0.00 -0.60 0.00 0.00 54.58 53.10 1qqc n ASN 365 Cb 0.84 -4.15 -0.12 0.00 -0.53 0.00 0.00 39.78 35.82 1qqc n ASN 365 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1qqc s ASP 366 N -3.47 5.13 0.28 1.20 1.01 0.01 -2.67 116.67 118.15 1qqc s ASP 366 Ca 0.55 -0.18 -0.29 0.00 0.71 0.00 0.00 52.55 53.34 1qqc s ASP 366 Cb -0.27 -1.91 -0.10 0.00 1.01 0.00 0.00 42.92 41.65 1qqc s ASP 366 CO 0.81 0.00 1.11 -0.69 0.21 0.00 0.00 175.17 176.60 1qqc s VAL 367 N 1.40 3.47 0.13 -1.27 1.01 0.37 -4.44 120.40 121.09 1qqc s VAL 367 Ca 0.05 1.48 -0.14 0.00 0.00 0.00 0.00 61.98 63.37 1qqc s VAL 367 Cb -0.15 -3.94 -0.07 0.00 0.00 0.00 0.00 36.38 32.22 1qqc s VAL 367 CO 0.03 0.35 0.54 0.00 0.00 0.00 0.00 175.10 176.02 1qqc s ALA 368 N -1.12 3.59 0.82 5.51 0.00 -1.26 -4.74 121.76 124.56 1qqc s ALA 368 Ca 0.45 -0.14 -0.11 0.00 0.00 0.00 0.00 51.96 52.15 1qqc s ALA 368 Cb -0.32 -2.51 0.08 0.00 0.00 0.00 0.00 23.12 20.37 1qqc s ALA 368 CO 0.41 0.46 1.09 -2.14 0.00 0.00 0.00 175.76 175.58 1qqc s PRO 369 N -1.88 1.93 0.42 0.00 0.02 -1.26 -4.64 135.00 129.58 1qqc s PRO 369 Ca 0.37 0.78 0.02 0.00 0.02 0.00 0.00 61.00 62.19 1qqc s PRO 369 Cb -0.15 -1.89 -0.00 0.00 0.02 0.00 0.00 34.50 32.47 1qqc s PRO 369 CO 0.19 -1.77 0.61 -0.80 -0.33 0.00 0.00 177.00 174.91 1qqc s ASN 370 N -3.69 5.87 0.85 2.53 0.01 -1.26 -4.87 114.94 114.37 1qqc s ASN 370 Ca 0.61 0.15 -0.11 0.00 -0.71 0.00 0.00 52.86 52.80 1qqc s ASN 370 Cb -0.16 -1.45 0.10 0.00 0.41 0.00 0.00 41.25 40.16 1qqc s ASN 370 CO 0.55 -0.63 1.09 -0.54 -1.51 0.00 0.00 177.10 176.07 1qqc s LYS 371 N -4.45 1.66 0.33 -0.60 1.02 -1.26 -4.60 119.74 111.84 1qqc s LYS 371 Ca 0.47 0.79 -0.27 0.00 0.02 0.00 0.00 55.97 56.98 1qqc s LYS 371 Cb -0.10 -1.86 -0.09 0.00 -0.52 0.00 0.00 37.83 35.26 1qqc s LYS 371 CO 0.36 -1.95 1.03 -2.14 -0.92 0.00 0.00 175.35 171.73 1qqc s PRO 372 N -5.01 4.47 0.66 -1.68 0.02 -1.26 -5.06 135.00 127.14 1qqc s PRO 372 Ca 0.62 1.56 -0.04 0.00 0.02 0.00 0.00 61.00 63.17 1qqc s PRO 372 Cb -0.17 -2.88 0.14 0.00 0.02 0.00 0.00 34.50 31.62 1qqc s PRO 372 CO 0.56 0.13 0.90 -0.40 -0.33 0.00 0.00 177.00 177.86 1qqc n ASP 373 N 0.62 0.82 -0.26 2.53 3.85 -1.26 -4.72 116.55 118.13 1qqc n ASP 373 Ca 0.02 -1.79 0.05 0.00 -0.71 0.00 0.00 54.79 52.36 1qqc n ASP 373 Cb 0.48 -0.62 0.15 0.00 -1.35 0.00 0.00 41.12 39.77 1qqc n ASP 373 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1qqc h GLU 374 N 0.00 0.07 0.02 0.11 5.08 -1.98 -1.37 114.58 116.52 1qqc h GLU 374 Ca -0.30 -0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 57.91 1qqc h GLU 374 Cb 1.00 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.25 1qqc h GLU 374 CO 0.28 0.05 -0.61 0.00 -1.00 0.00 0.00 179.01 177.73 1qqc h ARG 375 N 0.08 0.38 -0.32 2.33 3.08 -1.99 -2.22 114.38 115.73 1qqc h ARG 375 Ca 0.40 -0.43 0.04 0.00 0.07 0.00 0.00 59.98 60.07 1qqc h ARG 375 Cb 0.70 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.84 1qqc h ARG 375 CO -0.69 1.11 0.07 0.93 -1.07 0.00 0.00 179.97 180.32 1qqc h GLU 376 N -0.17 0.18 0.00 0.04 5.08 -1.90 0.34 114.58 118.15 1qqc h GLU 376 Ca -0.08 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1qqc h GLU 376 Cb 1.34 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.55 1qqc h GLU 376 CO 0.12 0.12 -0.09 1.25 -1.00 0.00 0.00 179.01 179.40 1qqc h LEU 377 N 0.18 0.00 -0.19 1.33 5.85 -1.33 -2.24 115.31 118.91 1qqc h LEU 377 Ca 0.15 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 1qqc h LEU 377 Cb 0.16 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1qqc h LEU 377 CO -0.19 0.09 -0.06 0.00 -0.34 0.00 0.00 178.44 177.94 1qqc h ALA 378 N 1.91 0.26 0.39 1.25 0.00 -0.32 -3.25 119.26 119.50 1qqc h ALA 378 Ca -0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1qqc h ALA 378 Cb 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1qqc h ALA 378 CO 0.01 0.05 -0.19 0.00 0.00 0.00 0.00 179.25 179.12 1qqc h ARG 379 N 0.08 -0.51 0.00 0.00 3.08 -0.69 -3.09 114.38 113.25 1qqc h ARG 379 Ca 0.05 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1qqc h ARG 379 Cb 0.52 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1qqc h ARG 379 CO 0.02 -0.33 0.00 0.54 -1.07 0.00 0.00 179.97 179.13 1qqc n ARG 380 N -5.31 0.00 0.00 0.04 1.74 -0.90 -2.27 116.66 109.95 1qqc n ARG 380 Ca -0.11 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.09 1qqc n ARG 380 Cb 0.23 -1.23 0.16 0.00 -1.02 0.00 0.00 32.46 30.60 1qqc n ARG 380 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1qqc n THR 381 N -0.53 0.00 -2.61 0.55 -2.24 -1.17 -4.69 114.28 103.59 1qqc n THR 381 Ca 0.00 -0.41 -0.41 0.00 -2.27 0.00 0.00 64.05 60.95 1qqc n THR 381 Cb 0.00 1.27 -0.03 0.00 -2.10 0.00 0.00 70.33 69.47 1qqc n THR 381 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1qqc s GLU 382 N -2.09 3.23 1.13 -0.78 2.12 -0.96 -4.99 118.70 116.35 1qqc s GLU 382 Ca 0.28 -0.47 -0.14 0.00 0.36 0.00 0.00 54.97 55.00 1qqc s GLU 382 Cb 0.20 -4.34 0.21 0.00 0.26 0.00 0.00 34.13 30.46 1qqc s GLU 382 CO 0.36 -2.10 0.69 -1.13 -0.54 0.00 0.00 175.26 172.54 1qqc n SER 383 N 9.01 -1.79 -0.10 -1.70 3.41 -1.26 -5.04 113.62 116.15 1qqc n SER 383 Ca 0.06 -0.08 -0.17 0.00 -0.26 0.00 0.00 58.87 58.43 1qqc n SER 383 Cb 0.49 -1.19 -0.07 0.00 -0.26 0.00 0.00 64.21 63.19 1qqc n SER 383 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1qqc n TYR 384 N -4.69 0.45 -3.82 7.33 4.01 -1.26 -5.25 117.16 113.92 1qqc n TYR 384 Ca 0.03 0.20 0.00 0.00 -0.16 0.00 0.00 57.90 57.97 1qqc n TYR 384 Cb 0.56 -0.84 0.00 0.00 -0.31 0.00 0.00 39.34 38.75 1qqc n TYR 384 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1qqc n ALA 385 N -3.97 0.00 -2.01 -0.72 0.00 -1.26 -5.23 120.51 107.31 1qqc n ALA 385 Ca -0.28 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 52.94 1qqc n ALA 385 Cb 0.60 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.15 1qqc n ALA 385 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1qqc s LYS 390 N -1.48 1.77 0.50 0.00 1.02 -1.26 -5.29 119.74 115.00 1qqc s LYS 390 Ca 0.00 -1.40 -0.23 0.00 0.02 0.00 0.00 55.97 54.37 1qqc s LYS 390 Cb 0.00 -2.43 -0.06 0.00 -0.52 0.00 0.00 37.83 34.82 1qqc s LYS 390 CO 0.00 -1.35 1.29 -1.21 -0.92 0.00 0.00 175.35 173.16 1qqc s GLU 391 N -5.02 3.42 0.33 1.68 0.41 -1.26 -4.79 118.70 113.47 1qqc s GLU 391 Ca 0.66 2.09 -0.26 0.00 -0.41 0.00 0.00 54.97 57.04 1qqc s GLU 391 Cb -0.04 -2.36 -0.09 0.00 -1.78 0.00 0.00 34.13 29.85 1qqc s GLU 391 CO 0.43 -0.92 0.99 -2.14 -0.49 0.00 0.00 175.26 173.14 1qqc s PRO 392 N -2.77 4.51 0.85 0.39 0.02 -1.26 -4.94 135.00 131.78 1qqc s PRO 392 Ca 0.67 1.46 -0.13 0.00 0.02 0.00 0.00 61.00 63.02 1qqc s PRO 392 Cb -0.36 -2.83 0.07 0.00 0.02 0.00 0.00 34.50 31.40 1qqc s PRO 392 CO 0.44 0.18 0.94 0.39 -0.33 0.00 0.00 177.00 178.62 1qqc n GLU 393 N 0.56 -0.02 -4.20 5.54 -0.58 -0.61 -4.99 120.64 116.35 1qqc n GLU 393 Ca 0.02 0.06 -0.24 0.00 -0.42 0.00 0.00 57.16 56.59 1qqc n GLU 393 Cb 0.49 -2.22 -0.06 0.00 -0.57 0.00 0.00 31.44 29.07 1qqc n GLU 393 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1qqc s LYS 394 N -3.92 2.57 0.04 3.49 1.02 -1.26 -4.46 119.74 117.22 1qqc s LYS 394 Ca 0.68 -1.19 0.00 0.00 0.02 0.00 0.00 55.97 55.48 1qqc s LYS 394 Cb -0.27 -2.38 0.00 0.00 -0.52 0.00 0.00 37.83 34.66 1qqc s LYS 394 CO 0.56 0.41 0.00 0.41 -0.92 0.00 0.00 175.35 175.81 1qqc n GLY 395 N -0.77 -2.32 3.64 -3.33 0.00 -1.26 -4.97 105.19 96.18 1qqc n GLY 395 Ca -0.08 -2.04 -0.35 0.00 0.00 0.00 0.00 46.02 43.55 1qqc n GLY 395 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qqc s LEU 396 N 0.00 3.82 0.29 0.99 1.98 -1.26 -4.39 118.68 120.11 1qqc s LEU 396 Ca 0.00 0.10 0.05 0.00 -2.89 0.00 0.00 54.13 51.38 1qqc s LEU 396 Cb 0.00 -1.96 -0.06 0.00 0.66 0.00 0.00 46.19 44.83 1qqc s LEU 396 CO 0.00 0.19 0.01 0.26 -1.89 0.00 0.00 176.35 174.92 1qqc s TRP 397 N 0.27 1.89 0.12 5.38 0.52 -0.86 -5.01 118.94 121.24 1qqc s TRP 397 Ca 0.04 -0.87 -0.03 0.00 0.02 0.00 0.00 56.10 55.26 1qqc s TRP 397 Cb -0.12 -1.17 -0.03 0.00 -1.15 0.00 0.00 33.47 30.99 1qqc s TRP 397 CO 0.00 0.09 0.08 -1.83 0.02 0.00 0.00 176.95 175.31 1qqc s GLU 398 N -3.83 0.88 -0.81 4.98 -1.05 -1.26 -2.31 118.70 115.30 1qqc s GLU 398 Ca 0.33 -1.33 -0.02 0.00 -0.15 0.00 0.00 54.97 53.81 1qqc s GLU 398 Cb 0.07 0.26 -0.01 0.00 -0.44 0.00 0.00 34.13 34.00 1qqc s GLU 398 CO 0.13 -0.25 0.74 0.09 0.95 0.00 0.00 175.26 176.92 1qqc n ASN 399 N -0.06 -7.43 -4.36 0.83 3.02 -0.92 -4.89 115.26 101.44 1qqc n ASN 399 Ca -0.08 -0.25 -0.33 0.00 -0.03 0.00 0.00 54.58 53.89 1qqc n ASN 399 Cb 0.63 -5.14 -0.14 0.00 -0.61 0.00 0.00 39.78 34.52 1qqc n ASN 399 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1qqc s ILE 400 N -3.09 3.04 0.12 2.41 1.01 0.02 -4.56 121.20 120.16 1qqc s ILE 400 Ca 0.10 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.12 1qqc s ILE 400 Cb -0.02 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1qqc s ILE 400 CO 0.76 0.52 0.16 -0.69 0.00 0.00 0.00 174.94 175.69 1qqc s VAL 401 N 0.39 4.81 -0.17 2.92 1.01 -0.27 0.33 120.40 129.42 1qqc s VAL 401 Ca -0.10 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1qqc s VAL 401 Cb -0.16 -3.40 0.03 0.00 0.00 0.00 0.00 36.38 32.84 1qqc s VAL 401 CO 0.05 0.00 -0.15 -0.47 0.00 0.00 0.00 175.10 174.53 1qqc s TYR 402 N -1.60 2.45 -0.27 5.22 5.04 -1.07 -1.10 117.35 126.02 1qqc s TYR 402 Ca 0.32 -1.46 -0.10 0.00 -2.44 0.00 0.00 57.07 53.39 1qqc s TYR 402 Cb -0.11 -1.72 -0.04 0.00 0.35 0.00 0.00 41.96 40.43 1qqc s TYR 402 CO 0.25 -0.74 0.16 -0.51 -1.34 0.00 0.00 175.55 173.37 1qqc s LEU 403 N 1.39 3.88 0.10 6.97 1.43 -0.29 -2.45 118.68 129.71 1qqc s LEU 403 Ca 0.04 -0.11 -0.10 0.00 -1.03 0.00 0.00 54.13 52.93 1qqc s LEU 403 Cb -0.14 -2.06 -0.06 0.00 0.03 0.00 0.00 46.19 43.97 1qqc s LEU 403 CO -0.11 -0.06 0.42 -0.62 0.23 0.00 0.00 176.35 176.22 1qqc s ASP 404 N 1.71 6.65 -0.18 2.29 2.15 -0.28 -2.14 116.67 126.87 1qqc s ASP 404 Ca 0.07 0.82 -0.08 0.00 0.43 0.00 0.00 52.55 53.78 1qqc s ASP 404 Cb -0.16 -2.19 -0.04 0.00 -0.30 0.00 0.00 42.92 40.23 1qqc s ASP 404 CO 0.09 0.14 0.10 -0.31 -0.17 0.00 0.00 175.17 175.02 1qqc s TYR 405 N -1.45 3.35 -0.44 -5.34 4.12 -1.26 0.15 117.35 116.49 1qqc s TYR 405 Ca 0.35 0.24 -0.20 0.00 0.02 0.00 0.00 57.07 57.48 1qqc s TYR 405 Cb -0.14 -2.09 0.03 0.00 -1.52 0.00 0.00 41.96 38.24 1qqc s TYR 405 CO 0.19 0.29 0.59 0.21 0.02 0.00 0.00 175.55 176.84 1qqc s LYS 406 N 0.17 3.21 -1.35 -0.62 2.20 -0.49 -4.47 119.74 118.38 1qqc s LYS 406 Ca 0.07 -0.54 -0.07 0.00 -0.36 0.00 0.00 55.97 55.07 1qqc s LYS 406 Cb -0.12 -3.97 0.02 0.00 -1.51 0.00 0.00 37.83 32.25 1qqc s LYS 406 CO -0.00 -1.00 1.06 0.43 -0.36 0.00 0.00 175.35 175.48 1qqc n SER 407 N 6.08 -4.66 -0.10 1.43 7.64 -1.26 -4.32 113.62 118.43 1qqc n SER 407 Ca -0.04 -0.63 -0.03 0.00 1.01 0.00 0.00 58.87 59.18 1qqc n SER 407 Cb 0.47 -4.74 -0.03 0.00 -1.01 0.00 0.00 64.21 58.91 1qqc n SER 407 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1qqc h LEU 408 N -2.34 -0.59 0.49 -3.43 5.85 -1.95 -0.94 115.31 112.40 1qqc h LEU 408 Ca -0.58 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.20 1qqc h LEU 408 Cb 1.36 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.65 1qqc h LEU 408 CO 0.57 -0.07 -0.24 1.88 -0.34 0.00 0.00 178.44 180.24 1qqc h TYR 409 N -0.02 -0.61 -0.29 1.25 0.05 -1.93 -1.63 116.97 113.78 1qqc h TYR 409 Ca 0.04 -0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.89 1qqc h TYR 409 Cb 0.12 0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 1qqc h TYR 409 CO -0.90 -0.29 0.25 -1.00 -1.05 0.00 0.00 178.16 175.17 1qqc h PRO 410 N -0.90 0.00 -0.20 4.88 0.13 -1.87 0.47 132.00 134.51 1qqc h PRO 410 Ca -0.07 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.04 1qqc h PRO 410 Cb 0.59 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 1qqc h PRO 410 CO 0.11 0.00 0.06 1.03 -0.23 0.00 0.00 178.00 178.97 1qqc h SER 411 N 0.00 0.30 -0.21 1.44 0.87 -0.93 -2.40 113.55 112.63 1qqc h SER 411 Ca 0.14 -0.22 -0.11 0.00 -1.23 0.00 0.00 61.79 60.37 1qqc h SER 411 Cb 0.64 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.51 1qqc h SER 411 CO -0.00 0.44 -0.25 0.40 -0.53 0.00 0.00 176.83 176.89 1qqc h ILE 412 N 0.14 1.27 -0.43 2.23 2.04 -0.24 -1.70 117.51 120.84 1qqc h ILE 412 Ca 0.06 -1.35 0.01 0.00 1.00 0.00 0.00 64.86 64.59 1qqc h ILE 412 Cb 0.25 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1qqc h ILE 412 CO -0.00 0.44 0.26 0.40 0.00 0.00 0.00 178.15 179.25 1qqc h ILE 413 N 0.59 1.07 0.24 -0.67 2.04 -0.79 -1.39 117.51 118.61 1qqc h ILE 413 Ca 0.08 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1qqc h ILE 413 Cb 0.74 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1qqc h ILE 413 CO 0.06 0.10 -0.12 0.40 0.00 0.00 0.00 178.15 178.59 1qqc h ILE 414 N 0.53 0.76 -0.72 -0.67 2.04 -1.34 -1.56 117.51 116.56 1qqc h ILE 414 Ca 0.17 -0.80 0.11 0.00 1.00 0.00 0.00 64.86 65.34 1qqc h ILE 414 Cb -0.02 1.17 -0.08 0.00 -0.74 0.00 0.00 36.82 37.15 1qqc h ILE 414 CO -0.06 0.16 0.32 0.74 0.00 0.00 0.00 178.15 179.30 1qqc h THR 415 N -0.78 0.76 -0.02 -0.27 2.02 -1.24 -2.17 112.91 111.21 1qqc h THR 415 Ca -0.03 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.97 1qqc h THR 415 Cb 0.51 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1qqc h THR 415 CO 0.06 0.10 -0.01 1.41 0.37 0.00 0.00 175.52 177.44 1qqc n HIS 416 N -4.93 0.00 -3.47 3.16 8.25 -0.53 -4.98 115.22 112.72 1qqc n HIS 416 Ca 0.12 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.40 1qqc n HIS 416 Cb 0.33 -0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.51 1qqc n HIS 416 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1qqc n ASN 417 N 0.70 -3.12 -4.59 0.41 5.15 -0.64 -4.86 115.26 108.31 1qqc n ASN 417 Ca 0.17 -0.72 -0.43 0.00 -0.60 0.00 0.00 54.58 53.00 1qqc n ASN 417 Cb 0.47 -4.76 -0.04 0.00 -0.53 0.00 0.00 39.78 34.91 1qqc n ASN 417 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1qqc s VAL 418 N -3.45 4.61 0.09 3.44 1.01 -0.87 -4.73 120.40 120.50 1qqc s VAL 418 Ca 0.14 0.98 -0.19 0.00 0.00 0.00 0.00 61.98 62.91 1qqc s VAL 418 Cb -0.03 -4.31 0.04 0.00 0.00 0.00 0.00 36.38 32.08 1qqc s VAL 418 CO 0.76 -0.57 0.46 -0.55 0.00 0.00 0.00 175.10 175.20 1qqc s SER 419 N 1.95 -0.34 0.51 3.32 0.15 -1.26 -4.59 113.70 113.45 1qqc s SER 419 Ca 0.35 -0.09 0.20 0.00 0.70 0.00 0.00 55.95 57.12 1qqc s SER 419 Cb -0.12 0.48 1.32 0.00 -1.71 0.00 0.00 66.02 66.00 1qqc s SER 419 CO 0.20 -0.79 2.11 -0.65 1.20 0.00 0.00 173.24 175.31 1qqc h PRO 420 N 2.57 0.00 -0.05 5.44 0.11 -1.93 -2.05 132.00 136.09 1qqc h PRO 420 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1qqc h PRO 420 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1qqc h PRO 420 CO 0.44 0.07 0.00 -0.40 -0.21 0.00 0.00 178.00 177.90 1qqc n ASP 421 N -4.21 0.80 0.00 -2.05 5.75 -1.26 -3.54 116.55 112.04 1qqc n ASP 421 Ca -0.03 -1.43 0.00 0.00 -0.01 0.00 0.00 54.79 53.32 1qqc n ASP 421 Cb 0.16 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 1qqc n ASP 421 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1qqc n THR 422 N -0.31 0.04 -1.94 2.12 -2.24 -0.79 -4.68 114.28 106.49 1qqc n THR 422 Ca 0.18 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 61.08 1qqc n THR 422 Cb 0.21 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.52 1qqc n THR 422 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1qqc s LEU 423 N -0.04 4.36 -0.70 3.22 0.20 -1.11 -1.32 118.68 123.29 1qqc s LEU 423 Ca 0.00 2.49 -0.19 0.00 0.69 0.00 0.00 54.13 57.12 1qqc s LEU 423 Cb 0.00 -3.57 0.03 0.00 -0.43 0.00 0.00 46.19 42.22 1qqc s LEU 423 CO 0.00 -0.87 0.37 0.59 -0.29 0.00 0.00 176.35 176.14 1qqc n ASN 424 N 5.39 -2.17 -4.80 3.68 3.02 0.63 -4.88 115.26 116.12 1qqc n ASN 424 Ca 0.15 -0.75 -0.36 0.00 -0.03 0.00 0.00 54.58 53.60 1qqc n ASN 424 Cb 0.40 -0.90 -0.06 0.00 -0.61 0.00 0.00 39.78 38.61 1qqc n ASN 424 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1qqc s ARG 425 N -6.39 4.37 0.25 3.52 0.52 -1.26 -5.03 118.95 114.94 1qqc s ARG 425 Ca 0.27 1.05 -0.30 0.00 -0.52 0.00 0.00 55.73 56.23 1qqc s ARG 425 Cb -0.15 -2.81 -0.09 0.00 0.52 0.00 0.00 34.95 32.41 1qqc s ARG 425 CO 0.56 0.33 0.99 -1.21 0.02 0.00 0.00 175.30 175.99 1qqc s GLU 426 N -2.07 4.78 -0.79 3.54 2.02 -1.26 -3.56 118.70 121.36 1qqc s GLU 426 Ca 0.47 1.59 0.00 0.00 0.02 0.00 0.00 54.97 57.05 1qqc s GLU 426 Cb -0.17 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.81 1qqc s GLU 426 CO 0.22 0.41 0.00 0.41 0.02 0.00 0.00 175.26 176.32 1qqc n GLY 427 N 1.41 0.94 3.71 -1.39 0.00 -1.26 -4.98 105.19 103.63 1qqc n GLY 427 Ca -0.02 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 1qqc n GLY 427 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qqc h ARG 429 N 6.87 0.00 -3.87 0.00 2.47 -1.94 -3.46 114.38 114.45 1qqc h ARG 429 Ca -0.42 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 57.93 1qqc h ARG 429 Cb 1.21 0.00 -0.34 0.00 -1.65 0.00 0.00 29.97 29.19 1qqc h ARG 429 CO 0.86 0.49 -0.76 -2.00 0.56 0.00 0.00 179.97 179.12 1qqc s GLU 430 N -2.78 0.55 0.10 0.04 2.12 -1.26 -5.11 118.70 112.37 1qqc s GLU 430 Ca -0.02 -0.01 -0.23 0.00 0.36 0.00 0.00 54.97 55.07 1qqc s GLU 430 Cb 0.08 -0.64 0.06 0.00 0.26 0.00 0.00 34.13 33.89 1qqc s GLU 430 CO 0.81 -0.10 0.55 1.52 -0.54 0.00 0.00 175.26 177.50 1qqc s TYR 431 N 0.94 -0.47 0.20 5.30 -0.85 -1.26 -0.82 117.35 120.39 1qqc s TYR 431 Ca -0.11 0.38 0.05 0.00 -0.52 0.00 0.00 57.07 56.87 1qqc s TYR 431 Cb -0.14 0.44 -0.04 0.00 0.38 0.00 0.00 41.96 42.60 1qqc s TYR 431 CO -0.01 -0.75 0.20 -0.51 -1.52 0.00 0.00 175.55 172.97 1qqc s ASP 432 N -2.39 5.72 -0.13 -0.18 -0.00 -0.93 -4.92 116.67 113.85 1qqc s ASP 432 Ca -0.02 -0.10 0.02 0.00 -0.00 0.00 0.00 52.55 52.45 1qqc s ASP 432 Cb -0.00 -1.54 0.00 0.00 -0.00 0.00 0.00 42.92 41.38 1qqc s ASP 432 CO -0.07 0.02 -0.20 -0.69 -0.00 0.00 0.00 175.17 174.22 1qqc s VAL 433 N -1.90 2.28 -0.06 -1.27 1.01 -1.26 -1.81 120.40 117.39 1qqc s VAL 433 Ca 0.32 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 1qqc s VAL 433 Cb -0.09 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1qqc s VAL 433 CO 0.25 0.54 1.47 0.00 0.00 0.00 0.00 175.10 177.36 1qqc s ALA 434 N 0.63 3.62 0.00 5.51 0.00 0.18 -4.94 121.76 126.75 1qqc s ALA 434 Ca -0.11 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.66 1qqc s ALA 434 Cb -0.16 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.30 1qqc s ALA 434 CO 0.03 -1.16 0.00 -2.30 0.00 0.00 0.00 175.76 172.33 1qqc n PRO 435 N 6.32 0.00 0.15 0.00 -0.02 -1.26 -0.96 135.00 139.23 1qqc n PRO 435 Ca 0.15 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.76 1qqc n PRO 435 Cb 0.43 0.00 0.38 0.00 -0.02 0.00 0.00 33.50 34.30 1qqc n PRO 435 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1qqc h GLN 436 N 0.00 0.00 -0.68 -0.52 4.20 -1.94 -3.29 115.11 112.88 1qqc h GLN 436 Ca 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 1qqc h GLN 436 Cb 0.00 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 1qqc h GLN 436 CO 0.00 0.00 0.13 0.28 -0.67 0.00 0.00 178.83 178.57 1qqc n VAL 437 N -2.53 2.78 -0.01 -0.54 0.31 -1.18 -4.98 118.33 112.18 1qqc n VAL 437 Ca 0.04 -1.46 0.00 0.00 -0.01 0.00 0.00 64.34 62.91 1qqc n VAL 437 Cb 0.41 -0.33 0.00 0.00 -0.91 0.00 0.00 33.84 33.01 1qqc n VAL 437 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qqc n GLY 438 N 0.25 0.00 3.76 2.92 0.00 -0.13 -4.81 105.19 107.17 1qqc n GLY 438 Ca 0.33 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.94 1qqc n GLY 438 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qqc s HIS 439 N -0.01 2.87 -0.22 1.61 3.76 -1.26 -4.59 115.29 117.45 1qqc s HIS 439 Ca 0.00 1.03 -0.09 0.00 -0.15 0.00 0.00 55.06 55.85 1qqc s HIS 439 Cb 0.00 -3.91 -0.05 0.00 1.11 0.00 0.00 32.58 29.74 1qqc s HIS 439 CO 0.00 -2.88 0.12 1.03 -0.85 0.00 0.00 174.74 172.16 1qqc s ARG 440 N -0.90 4.01 -0.22 1.40 0.52 -1.26 -0.65 118.95 121.85 1qqc s ARG 440 Ca 0.58 -0.31 -0.04 0.00 -0.52 0.00 0.00 55.73 55.44 1qqc s ARG 440 Cb -0.44 -3.42 -0.01 0.00 0.52 0.00 0.00 34.95 31.60 1qqc s ARG 440 CO 0.49 0.11 -0.05 -0.06 0.02 0.00 0.00 175.30 175.82 1qqc s PHE 441 N 0.87 2.95 0.27 -0.53 0.40 -0.75 -0.27 117.98 120.93 1qqc s PHE 441 Ca 0.06 -0.94 -0.29 0.00 -0.60 0.00 0.00 56.93 55.15 1qqc s PHE 441 Cb -0.13 -2.10 -0.10 0.00 0.51 0.00 0.00 43.02 41.20 1qqc s PHE 441 CO 0.03 -0.55 1.33 0.00 0.70 0.00 0.00 175.22 176.73 1qqc n LYS 443 N 1.69 1.81 0.00 0.00 5.02 -0.00 -4.64 118.16 122.03 1qqc n LYS 443 Ca 0.03 -2.75 0.10 0.00 -2.02 0.00 0.00 58.31 53.68 1qqc n LYS 443 Cb 0.42 -1.63 0.46 0.00 -0.02 0.00 0.00 35.03 34.26 1qqc n LYS 443 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1qqc n ASP 444 N -1.13 0.00 -3.53 4.39 8.00 -1.26 -4.83 116.55 118.19 1qqc n ASP 444 Ca 0.19 0.48 -0.10 0.00 0.71 0.00 0.00 54.79 56.06 1qqc n ASP 444 Cb 0.74 -0.49 -0.04 0.00 -0.02 0.00 0.00 41.12 41.31 1qqc n ASP 444 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1qqc s PHE 445 N -2.98 -0.39 0.38 1.24 -0.12 -1.26 -5.13 117.98 109.71 1qqc s PHE 445 Ca 0.11 0.46 -0.28 0.00 -0.05 0.00 0.00 56.93 57.17 1qqc s PHE 445 Cb 0.14 0.49 -0.11 0.00 -0.63 0.00 0.00 43.02 42.92 1qqc s PHE 445 CO 0.39 -0.48 1.48 -2.14 -0.05 0.00 0.00 175.22 174.42 1qqc s PRO 446 N -2.18 4.11 0.26 1.99 0.02 -1.26 -4.99 135.00 132.95 1qqc s PRO 446 Ca 0.01 2.55 -0.20 0.00 0.02 0.00 0.00 61.00 63.38 1qqc s PRO 446 Cb -0.01 -2.96 -0.09 0.00 0.02 0.00 0.00 34.50 31.46 1qqc s PRO 446 CO -0.03 -0.53 0.76 0.20 -0.33 0.00 0.00 177.00 177.07 1qqc s GLY 447 N -0.17 2.57 0.06 0.52 0.00 -1.26 -4.96 107.32 104.08 1qqc s GLY 447 Ca 0.53 0.19 -0.14 0.00 0.00 0.00 0.00 44.72 45.30 1qqc s GLY 447 CO 0.62 0.53 1.24 -2.75 0.00 0.00 0.00 173.10 172.74 1qqc h PHE 448 N 3.09 -0.76 0.10 1.90 3.57 -1.94 -1.92 116.94 120.97 1qqc h PHE 448 Ca -0.48 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1qqc h PHE 448 Cb 1.19 0.36 -0.01 0.00 2.79 0.00 0.00 35.95 40.28 1qqc h PHE 448 CO 0.63 -0.21 -0.10 0.82 -2.23 0.00 0.00 178.31 177.22 1qqc h ILE 449 N -0.15 0.77 -0.77 1.41 5.03 -1.95 -3.11 117.51 118.75 1qqc h ILE 449 Ca 0.04 0.00 0.18 0.00 -0.12 0.00 0.00 64.86 64.95 1qqc h ILE 449 Cb 0.25 0.77 -0.13 0.00 -3.03 0.00 0.00 36.82 34.68 1qqc h ILE 449 CO -0.29 0.00 0.04 -0.65 -0.68 0.00 0.00 178.15 176.57 1qqc h PRO 450 N -0.22 0.12 -0.26 2.37 0.11 -1.77 -0.19 132.00 132.15 1qqc h PRO 450 Ca 0.01 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.12 1qqc h PRO 450 Cb 0.21 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.28 1qqc h PRO 450 CO -0.03 0.08 0.14 0.77 -0.21 0.00 0.00 178.00 178.74 1qqc h SER 451 N 0.12 0.21 -0.61 -2.05 0.02 -1.32 0.68 113.55 110.61 1qqc h SER 451 Ca 0.43 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.35 1qqc h SER 451 Cb 0.76 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.24 1qqc h SER 451 CO -0.66 0.16 0.26 -0.07 -1.14 0.00 0.00 176.83 175.38 1qqc h LEU 452 N 0.29 0.83 -0.73 5.07 3.38 -1.14 -1.06 115.31 121.95 1qqc h LEU 452 Ca 0.11 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1qqc h LEU 452 Cb 0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1qqc h LEU 452 CO -0.07 0.76 0.25 -0.07 0.09 0.00 0.00 178.44 179.40 1qqc h LEU 453 N 0.85 1.04 -0.59 1.67 3.38 -0.80 -1.15 115.31 119.70 1qqc h LEU 453 Ca 0.21 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1qqc h LEU 453 Cb 0.18 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1qqc h LEU 453 CO -0.02 0.96 0.34 1.23 0.09 0.00 0.00 178.44 181.04 1qqc h GLY 454 N 1.07 0.87 1.47 0.83 0.00 -0.57 -1.81 103.07 104.92 1qqc h GLY 454 Ca 0.24 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 47.11 1qqc h GLY 454 CO -0.01 0.37 -0.10 -0.55 0.00 0.00 0.00 176.54 176.25 1qqc h ASP 455 N 0.80 0.62 0.18 0.19 3.32 -0.86 -3.03 116.42 117.64 1qqc h ASP 455 Ca 0.21 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1qqc h ASP 455 Cb 0.01 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1qqc h ASP 455 CO -0.04 0.76 -0.09 -0.07 -1.72 0.00 0.00 179.24 178.08 1qqc h LEU 456 N 0.59 -0.21 -0.57 1.55 3.38 -0.67 -2.86 115.31 116.52 1qqc h LEU 456 Ca 0.11 -0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.00 1qqc h LEU 456 Cb 0.52 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.27 1qqc h LEU 456 CO 0.03 0.02 0.29 -0.07 0.09 0.00 0.00 178.44 178.80 1qqc h LEU 457 N -0.43 0.40 -0.71 1.67 3.38 -1.30 -0.74 115.31 117.58 1qqc h LEU 457 Ca -0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1qqc h LEU 457 Cb 0.33 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1qqc h LEU 457 CO 0.04 0.27 0.00 1.05 0.09 0.00 0.00 178.44 179.89 1qqc h GLU 458 N 0.54 0.00 -0.03 1.13 4.11 -1.60 -2.46 114.58 116.27 1qqc h GLU 458 Ca 0.26 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.55 1qqc h GLU 458 Cb 0.19 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.45 1qqc h GLU 458 CO -0.19 0.00 -0.54 1.49 0.07 0.00 0.00 179.01 179.84 1qqc h GLU 459 N 0.00 0.41 -0.97 1.06 4.22 -0.93 -2.58 114.58 115.79 1qqc h GLU 459 Ca 0.00 -0.41 0.08 0.00 0.08 0.00 0.00 59.36 59.11 1qqc h GLU 459 Cb 0.50 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.79 1qqc h GLU 459 CO 0.00 1.07 0.61 -0.09 -2.18 0.00 0.00 179.01 178.42 1qqc h ARG 460 N -0.09 1.05 0.00 1.92 2.43 -0.84 -1.21 114.38 117.65 1qqc h ARG 460 Ca -0.06 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 58.98 1qqc h ARG 460 Cb 1.23 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 1qqc h ARG 460 CO 0.11 0.70 -0.31 1.96 -1.51 0.00 0.00 179.97 180.92 1qqc h GLN 461 N 1.09 0.00 -0.01 0.20 4.20 -1.38 -1.79 115.11 117.42 1qqc h GLN 461 Ca 0.43 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.96 1qqc h GLN 461 Cb 0.24 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1qqc h GLN 461 CO -0.19 0.31 -0.81 0.87 -0.67 0.00 0.00 178.83 178.33 1qqc h LYS 462 N 0.00 0.17 -0.12 1.46 1.57 -0.83 -2.77 116.57 116.04 1qqc h LYS 462 Ca -0.00 -0.17 -0.14 0.00 -1.87 0.00 0.00 60.65 58.47 1qqc h LYS 462 Cb 0.60 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1qqc h LYS 462 CO 0.04 0.89 -0.52 0.28 -0.57 0.00 0.00 179.45 179.57 1qqc h VAL 463 N 0.10 1.34 -0.41 0.50 2.07 -1.07 -2.74 116.25 116.05 1qqc h VAL 463 Ca -0.03 -1.77 -0.10 0.00 0.82 0.00 0.00 66.70 65.62 1qqc h VAL 463 Cb 1.42 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 1qqc h VAL 463 CO 0.12 0.53 -0.12 0.11 0.02 0.00 0.00 177.57 178.23 1qqc h LYS 464 N 0.27 0.81 -0.57 1.57 1.57 -1.22 0.12 116.57 119.12 1qqc h LYS 464 Ca 0.01 -0.32 0.01 0.00 -1.87 0.00 0.00 60.65 58.48 1qqc h LYS 464 Cb 1.00 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.24 1qqc h LYS 464 CO 0.09 0.94 0.36 0.87 -0.57 0.00 0.00 179.45 181.14 1qqc h LYS 465 N 0.62 0.71 -0.46 3.15 1.57 -1.44 -0.08 116.57 120.65 1qqc h LYS 465 Ca 0.10 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 1qqc h LYS 465 Cb 0.66 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1qqc h LYS 465 CO 0.05 0.47 0.05 -0.22 -0.57 0.00 0.00 179.45 179.22 1qqc h LYS 466 N 0.73 0.73 -0.05 3.15 3.64 -1.24 -2.08 116.57 121.45 1qqc h LYS 466 Ca 0.22 -0.17 -0.14 0.00 -1.27 0.00 0.00 60.65 59.29 1qqc h LYS 466 Cb -0.04 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1qqc h LYS 466 CO -0.07 0.71 -0.58 1.98 -2.27 0.00 0.00 179.45 179.22 1qqc h MET 467 N 0.69 0.17 -0.00 1.90 4.05 0.03 -2.62 114.93 119.15 1qqc h MET 467 Ca 0.15 -0.11 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1qqc h MET 467 Cb 0.36 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.17 1qqc h MET 467 CO 0.01 0.71 -0.12 1.63 0.23 0.00 0.00 176.91 179.37 1qqc n LYS 468 N -3.87 0.35 -0.00 0.39 5.02 -0.12 -3.81 118.16 116.12 1qqc n LYS 468 Ca -0.02 -0.09 0.05 0.00 -2.02 0.00 0.00 58.31 56.23 1qqc n LYS 468 Cb 0.60 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.05 1qqc n LYS 468 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qqc n ALA 469 N -1.25 3.11 -2.10 7.82 0.00 -0.82 -5.01 120.51 122.27 1qqc n ALA 469 Ca 0.11 -0.27 -0.32 0.00 0.00 0.00 0.00 53.44 52.96 1qqc n ALA 469 Cb 0.30 -0.36 -0.05 0.00 0.00 0.00 0.00 19.45 19.34 1qqc n ALA 469 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1qqc s THR 470 N -2.07 4.68 -0.31 0.00 -1.32 -1.00 -5.00 115.64 110.61 1qqc s THR 470 Ca 0.02 0.90 0.07 0.00 -1.21 0.00 0.00 61.69 61.48 1qqc s THR 470 Cb 0.07 -3.66 -0.08 0.00 -1.51 0.00 0.00 72.50 67.32 1qqc s THR 470 CO 0.41 -0.36 0.29 0.55 -2.21 0.00 0.00 174.62 173.30 1qqc n VAL 471 N -0.82 0.00 -2.90 5.08 3.14 -1.26 -4.94 118.33 116.63 1qqc n VAL 471 Ca 0.04 -0.31 -0.42 0.00 -2.96 0.00 0.00 64.34 60.69 1qqc n VAL 471 Cb 0.54 0.93 -0.04 0.00 -1.06 0.00 0.00 33.84 34.21 1qqc n VAL 471 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1qqc s ASP 472 N -1.80 6.85 0.37 6.55 -1.08 -1.26 -4.96 116.67 121.34 1qqc s ASP 472 Ca 0.02 1.05 0.16 0.00 -0.52 0.00 0.00 52.55 53.27 1qqc s ASP 472 Cb 0.05 -2.44 1.07 0.00 -1.46 0.00 0.00 42.92 40.14 1qqc s ASP 472 CO 0.30 -0.48 1.72 1.55 0.52 0.00 0.00 175.17 178.78 1qqc h PRO 473 N 7.60 0.40 -0.12 4.34 0.13 -1.99 -0.60 132.00 141.77 1qqc h PRO 473 Ca -0.25 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 64.73 1qqc h PRO 473 Cb 1.10 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1qqc h PRO 473 CO 0.86 0.26 -0.44 0.82 -0.23 0.00 0.00 178.00 179.27 1qqc h ILE 474 N 0.41 1.37 -0.27 -3.56 2.04 -2.00 -2.57 117.51 112.93 1qqc h ILE 474 Ca 0.66 -1.76 -0.15 0.00 1.00 0.00 0.00 64.86 64.61 1qqc h ILE 474 Cb 1.56 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.77 1qqc h ILE 474 CO -0.42 0.53 -0.45 -0.08 0.00 0.00 0.00 178.15 177.73 1qqc h GLU 475 N 0.11 0.70 -0.73 2.37 4.81 -1.76 -2.67 114.58 117.41 1qqc h GLU 475 Ca -0.02 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 58.85 1qqc h GLU 475 Cb 1.08 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 1qqc h GLU 475 CO 0.09 1.00 0.48 -0.09 -0.73 0.00 0.00 179.01 179.77 1qqc h ARG 476 N 0.56 0.86 -0.20 1.92 2.43 -1.15 -0.60 114.38 118.20 1qqc h ARG 476 Ca 0.04 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 59.01 1qqc h ARG 476 Cb 1.00 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1qqc h ARG 476 CO 0.09 0.57 -0.45 -0.22 -1.51 0.00 0.00 179.97 178.45 1qqc h LYS 477 N 0.88 0.66 0.01 0.20 3.64 -1.34 -2.08 116.57 118.54 1qqc h LYS 477 Ca 0.29 -0.44 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1qqc h LYS 477 Cb 0.06 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1qqc h LYS 477 CO -0.08 1.06 -0.01 1.25 -2.27 0.00 0.00 179.45 179.40 1qqc h LEU 478 N 0.35 -0.02 -1.78 5.20 5.85 -1.08 -2.01 115.31 121.82 1qqc h LEU 478 Ca -0.00 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1qqc h LEU 478 Cb 1.06 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1qqc h LEU 478 CO 0.10 0.07 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.13 1qqc h LEU 479 N -0.10 0.04 -0.26 2.25 3.38 -1.18 -1.76 115.31 117.69 1qqc h LEU 479 Ca -0.00 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1qqc h LEU 479 Cb 0.10 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1qqc h LEU 479 CO 0.00 0.12 -0.07 -0.78 0.09 0.00 0.00 178.44 177.81 1qqc h ASP 480 N 0.05 0.51 -0.40 -0.43 3.58 -0.87 -1.57 116.42 117.29 1qqc h ASP 480 Ca 0.01 -0.37 -0.07 0.00 0.42 0.00 0.00 57.03 57.02 1qqc h ASP 480 Cb 0.16 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 1qqc h ASP 480 CO 0.01 0.76 -0.03 1.88 -2.88 0.00 0.00 179.24 178.98 1qqc h TYR 481 N 0.25 0.80 -0.96 0.28 -1.99 -0.83 -1.91 116.97 112.61 1qqc h TYR 481 Ca 0.07 -0.15 0.12 0.00 2.00 0.00 0.00 58.73 60.76 1qqc h TYR 481 Cb 0.54 -0.20 -0.08 0.00 2.00 0.00 0.00 36.73 38.98 1qqc h TYR 481 CO 0.05 0.82 0.59 -0.09 -0.00 0.00 0.00 178.16 179.54 1qqc h ARG 482 N 0.55 0.91 -0.68 4.88 2.43 -1.33 -1.42 114.38 119.72 1qqc h ARG 482 Ca 0.11 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 1qqc h ARG 482 Cb 0.53 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 1qqc h ARG 482 CO 0.03 0.60 0.11 0.37 -1.51 0.00 0.00 179.97 179.57 1qqc h GLN 483 N 0.94 1.13 -0.08 0.20 -0.00 -0.87 -3.04 115.11 113.39 1qqc h GLN 483 Ca 0.48 -0.30 -0.14 0.00 -0.00 0.00 0.00 58.65 58.68 1qqc h GLN 483 Cb 0.47 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.81 1qqc h GLN 483 CO -0.27 1.02 -0.58 0.00 0.00 0.00 0.00 178.83 179.01 1qqc h ARG 484 N 1.05 0.26 -0.61 1.69 3.08 -0.53 -3.20 114.38 116.12 1qqc h ARG 484 Ca 0.21 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 1qqc h ARG 484 Cb 0.44 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1qqc h ARG 484 CO 0.01 0.77 0.15 0.00 -1.07 0.00 0.00 179.97 179.83 1qqc h ALA 485 N 1.19 0.81 -0.37 0.04 0.00 -1.23 -1.49 119.26 118.21 1qqc h ALA 485 Ca -0.00 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1qqc h ALA 485 Cb 1.08 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1qqc h ALA 485 CO 0.09 0.52 0.25 0.82 0.00 0.00 0.00 179.25 180.93 1qqc h ILE 486 N 0.90 1.02 -0.01 0.00 2.04 -1.53 -1.20 117.51 118.73 1qqc h ILE 486 Ca 0.19 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 1qqc h ILE 486 Cb 0.36 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1qqc h ILE 486 CO 0.00 0.07 -0.01 0.50 0.00 0.00 0.00 178.15 178.71 1qqc h LYS 487 N 0.38 0.02 -0.60 2.37 3.64 -1.37 -0.99 116.57 120.01 1qqc h LYS 487 Ca 0.15 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.59 1qqc h LYS 487 Cb 0.14 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.90 1qqc h LYS 487 CO -0.03 0.50 0.28 0.82 -2.27 0.00 0.00 179.45 178.75 1qqc h ILE 488 N -0.46 0.88 0.28 2.00 5.03 -0.78 -0.62 117.51 123.83 1qqc h ILE 488 Ca 0.00 -0.18 -0.01 0.00 -0.12 0.00 0.00 64.86 64.55 1qqc h ILE 488 Cb 0.50 0.32 0.00 0.00 -3.03 0.00 0.00 36.82 34.60 1qqc h ILE 488 CO 0.00 0.09 -0.14 0.25 -0.68 0.00 0.00 178.15 177.68 1qqc h LEU 489 N 0.52 -0.32 -0.85 1.44 5.85 -1.24 -3.13 115.31 117.58 1qqc h LEU 489 Ca 0.28 -0.12 0.15 0.00 0.84 0.00 0.00 57.88 59.04 1qqc h LEU 489 Cb 0.26 0.08 -0.10 0.00 0.37 0.00 0.00 40.66 41.28 1qqc h LEU 489 CO -0.23 -0.06 0.43 0.00 -0.34 0.00 0.00 178.44 178.24 1qqc h ALA 490 N 0.06 1.29 0.00 1.25 0.00 -0.85 0.48 119.26 121.50 1qqc h ALA 490 Ca -0.04 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1qqc h ALA 490 Cb 0.43 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1qqc h ALA 490 CO 0.06 -0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.28 1qqc n ASN 491 N -4.89 0.17 -0.00 0.00 3.02 -0.27 -3.07 115.26 110.22 1qqc n ASN 491 Ca 0.17 -1.87 0.08 0.00 -0.03 0.00 0.00 54.58 52.93 1qqc n ASN 491 Cb 0.46 -0.09 -0.10 0.00 -0.61 0.00 0.00 39.78 39.44 1qqc n ASN 491 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1qqc n SER 492 N -0.40 0.90 -0.15 6.41 7.64 0.16 -4.58 113.62 123.60 1qqc n SER 492 Ca 0.00 -0.62 -0.07 0.00 1.01 0.00 0.00 58.87 59.19 1qqc n SER 492 Cb 0.04 1.21 0.02 0.00 -1.01 0.00 0.00 64.21 64.47 1qqc n SER 492 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1qqc h TYR 493 N 0.00 0.56 0.03 1.43 -1.99 -1.60 -1.90 116.97 113.51 1qqc h TYR 493 Ca 0.00 0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.77 1qqc h TYR 493 Cb 0.47 -0.19 -0.04 0.00 2.00 0.00 0.00 36.73 38.97 1qqc h TYR 493 CO 0.00 0.35 -0.27 -0.92 -0.00 0.00 0.00 178.16 177.32 1qqc h TYR 494 N 0.61 -0.72 -0.13 4.88 3.20 -1.82 -1.55 116.97 121.43 1qqc h TYR 494 Ca 0.18 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 1qqc h TYR 494 Cb -0.04 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1qqc h TYR 494 CO -0.05 -0.36 -0.01 0.78 -1.64 0.00 0.00 178.16 176.88 1qqc h GLY 495 N -0.43 0.20 0.95 1.82 0.00 -1.81 -2.76 103.07 101.03 1qqc h GLY 495 Ca 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1qqc h GLY 495 CO -0.21 0.09 0.17 -1.82 0.00 0.00 0.00 176.54 174.77 1qqc h TYR 496 N 0.19 0.52 -0.99 5.60 3.20 -0.47 -2.47 116.97 122.55 1qqc h TYR 496 Ca 0.05 -0.03 0.26 0.00 3.14 0.00 0.00 58.73 62.15 1qqc h TYR 496 Cb 0.14 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.19 1qqc h TYR 496 CO 0.00 0.45 0.68 1.88 -1.64 0.00 0.00 178.16 179.53 1qqc h TYR 497 N 0.44 0.29 -0.70 -3.82 0.99 -1.06 0.32 116.97 113.43 1qqc h TYR 497 Ca 0.12 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.86 1qqc h TYR 497 Cb 0.12 -0.09 0.00 0.00 1.00 0.00 0.00 36.73 37.77 1qqc h TYR 497 CO -0.01 0.05 0.00 0.00 -0.00 0.00 0.00 178.16 178.19 1qqc n ALA 498 N -2.62 2.38 -2.57 3.88 0.00 -1.01 -1.74 120.51 118.82 1qqc n ALA 498 Ca 0.22 -1.27 -0.43 0.00 0.00 0.00 0.00 53.44 51.96 1qqc n ALA 498 Cb 0.94 -0.91 -0.02 0.00 0.00 0.00 0.00 19.45 19.45 1qqc n ALA 498 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1qqc s TYR 499 N -1.05 2.82 0.32 0.00 5.04 0.11 -4.93 117.35 119.65 1qqc s TYR 499 Ca 0.48 0.80 0.09 0.00 -2.44 0.00 0.00 57.07 56.00 1qqc s TYR 499 Cb 0.25 -4.27 0.90 0.00 0.35 0.00 0.00 41.96 39.18 1qqc s TYR 499 CO 0.33 -1.29 1.69 0.00 -1.34 0.00 0.00 175.55 174.93 1qqc h ALA 500 N 9.21 1.70 -0.15 3.97 0.00 -1.86 0.11 119.26 132.24 1qqc h ALA 500 Ca -0.23 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1qqc h ALA 500 Cb 1.07 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1qqc h ALA 500 CO 1.10 -0.41 0.00 -1.71 0.00 0.00 0.00 179.25 178.23 1qqc n ASN 501 N -5.02 1.20 -4.73 0.00 2.85 -1.26 -4.71 115.26 103.59 1qqc n ASN 501 Ca 0.27 -1.71 -0.41 0.00 -0.11 0.00 0.00 54.58 52.61 1qqc n ASN 501 Cb 0.80 -0.10 -0.04 0.00 1.24 0.00 0.00 39.78 41.68 1qqc n ASN 501 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1qqc s ALA 502 N -1.81 3.29 0.08 5.20 0.00 0.39 -4.68 121.76 124.23 1qqc s ALA 502 Ca 0.27 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 52.71 1qqc s ALA 502 Cb 0.14 -3.34 -0.11 0.00 0.00 0.00 0.00 23.12 19.81 1qqc s ALA 502 CO 0.22 -0.18 1.62 0.00 0.00 0.00 0.00 175.76 177.41 1qqc h ARG 503 N 5.84 0.20 -1.27 0.00 3.08 -1.88 -2.98 114.38 117.37 1qqc h ARG 503 Ca -0.43 -0.04 -0.33 0.00 0.07 0.00 0.00 59.98 59.26 1qqc h ARG 503 Cb 1.21 -0.03 -0.16 0.00 0.08 0.00 0.00 29.97 31.07 1qqc h ARG 503 CO 0.74 0.29 0.43 0.91 -1.07 0.00 0.00 179.97 181.27 1qqc n TRP 504 N -4.89 1.72 -1.64 3.04 8.01 -1.26 -4.68 117.44 117.73 1qqc n TRP 504 Ca -0.05 -1.74 -0.41 0.00 -1.31 0.00 0.00 57.50 53.99 1qqc n TRP 504 Cb 0.11 -0.86 0.02 0.00 -2.01 0.00 0.00 31.31 28.57 1qqc n TRP 504 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.69 177.66 1qqc n TYR 505 N -0.06 1.43 -3.14 -5.99 9.36 -1.13 -4.83 117.16 112.81 1qqc n TYR 505 Ca 0.33 0.53 0.03 0.00 3.32 0.00 0.00 57.90 62.11 1qqc n TYR 505 Cb 0.82 -2.26 -0.00 0.00 -0.63 0.00 0.00 39.34 37.26 1qqc n TYR 505 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1qqc h ARG 507 N 7.22 0.31 -0.17 0.00 2.43 -1.96 -2.51 114.38 119.70 1qqc h ARG 507 Ca 0.01 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.01 1qqc h ARG 507 Cb 1.19 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 1qqc h ARG 507 CO 0.08 0.51 -0.22 0.93 -1.51 0.00 0.00 179.97 179.76 1qqc h GLU 508 N 0.28 0.31 -0.03 0.20 3.07 -1.95 -2.37 114.58 114.08 1qqc h GLU 508 Ca 0.05 -0.10 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 1qqc h GLU 508 Cb 0.52 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.40 1qqc h GLU 508 CO 0.03 0.52 -0.04 0.00 -1.40 0.00 0.00 179.01 178.12 1qqc h ALA 510 N 0.51 -0.73 -0.98 0.00 0.00 -1.39 -0.41 119.26 116.25 1qqc h ALA 510 Ca 0.00 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.90 1qqc h ALA 510 Cb 0.57 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 1qqc h ALA 510 CO 0.01 -0.95 0.63 0.93 0.00 0.00 0.00 179.25 179.87 1qqc h GLU 511 N -0.70 1.02 -0.05 0.00 5.08 -1.55 -1.85 114.58 116.53 1qqc h GLU 511 Ca -0.02 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1qqc h GLU 511 Cb 0.64 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1qqc h GLU 511 CO -0.07 0.67 0.01 0.77 -1.00 0.00 0.00 179.01 179.39 1qqc h SER 512 N 1.05 0.08 -0.55 1.42 0.02 -1.16 -0.70 113.55 113.71 1qqc h SER 512 Ca 0.46 -0.23 0.07 0.00 -0.84 0.00 0.00 61.79 61.25 1qqc h SER 512 Cb 0.35 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 1qqc h SER 512 CO -0.21 0.29 0.37 0.58 -1.14 0.00 0.00 176.83 176.71 1qqc h VAL 513 N -0.14 0.96 -0.15 2.27 2.07 -0.70 -0.92 116.25 119.63 1qqc h VAL 513 Ca 0.02 -0.16 -0.19 0.00 0.82 0.00 0.00 66.70 67.19 1qqc h VAL 513 Cb 0.24 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1qqc h VAL 513 CO 0.00 0.08 -0.67 0.74 0.02 0.00 0.00 177.57 177.75 1qqc h THR 514 N 0.46 1.32 -0.25 2.57 2.02 -1.06 -2.42 112.91 115.55 1qqc h THR 514 Ca 0.24 -1.95 -0.09 0.00 0.77 0.00 0.00 66.41 65.39 1qqc h THR 514 Cb 0.37 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1qqc h THR 514 CO -0.07 0.60 -0.20 0.00 0.37 0.00 0.00 175.52 176.23 1qqc h ALA 515 N 0.82 0.36 -0.43 6.16 0.00 -0.02 -2.98 119.26 123.16 1qqc h ALA 515 Ca -0.02 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1qqc h ALA 515 Cb 1.25 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1qqc h ALA 515 CO 0.13 0.29 0.01 -1.49 0.00 0.00 0.00 179.25 178.19 1qqc h TRP 516 N 0.28 0.72 -0.75 0.00 6.55 -1.28 -2.56 115.95 118.91 1qqc h TRP 516 Ca 0.05 -0.09 0.07 0.00 0.95 0.00 0.00 58.89 59.87 1qqc h TRP 516 Cb 0.74 -0.20 -0.06 0.00 -0.86 0.00 0.00 29.16 28.77 1qqc h TRP 516 CO 0.07 0.68 0.43 0.78 -1.05 0.00 0.00 178.44 179.35 1qqc h GLY 517 N 0.93 1.14 2.00 1.49 0.00 -1.33 -1.80 103.07 105.50 1qqc h GLY 517 Ca 0.13 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 47.04 1qqc h GLY 517 CO 0.01 0.16 -0.62 3.21 0.00 0.00 0.00 176.54 179.30 1qqc h ARG 518 N 0.76 0.00 -0.19 4.80 3.08 -1.33 -2.69 114.38 118.81 1qqc h ARG 518 Ca 0.35 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.34 1qqc h ARG 518 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1qqc h ARG 518 CO -0.21 0.62 -0.10 0.37 -1.07 0.00 0.00 179.97 179.57 1qqc h GLN 519 N 0.00 0.41 -0.64 0.04 4.15 -1.05 -1.78 115.11 116.24 1qqc h GLN 519 Ca -0.01 -0.18 -0.03 0.00 0.77 0.00 0.00 58.65 59.21 1qqc h GLN 519 Cb 1.21 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.86 1qqc h GLN 519 CO 0.08 0.71 0.30 1.88 -1.93 0.00 0.00 178.83 179.87 1qqc h TYR 520 N 0.09 0.93 -0.14 3.99 -1.99 -1.31 -1.50 116.97 117.04 1qqc h TYR 520 Ca 0.04 -0.05 -0.09 0.00 2.00 0.00 0.00 58.73 60.63 1qqc h TYR 520 Cb 0.60 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 1qqc h TYR 520 CO 0.07 0.70 -0.31 0.82 -0.00 0.00 0.00 178.16 179.44 1qqc h ILE 521 N 0.88 1.27 0.07 -2.88 2.04 -1.50 -2.06 117.51 115.32 1qqc h ILE 521 Ca 0.22 -1.29 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 1qqc h ILE 521 Cb 0.13 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 1qqc h ILE 521 CO -0.03 0.39 -0.03 -0.33 0.00 0.00 0.00 178.15 178.15 1qqc h GLU 522 N 0.24 -0.09 -0.07 2.37 4.39 -0.93 -2.26 114.58 118.23 1qqc h GLU 522 Ca 0.03 0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.62 1qqc h GLU 522 Cb 0.68 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 1qqc h GLU 522 CO 0.05 0.10 -0.49 1.79 -1.16 0.00 0.00 179.01 179.30 1qqc h THR 523 N -0.27 1.35 -0.19 1.13 1.35 -1.20 -2.59 112.91 112.49 1qqc h THR 523 Ca -0.01 -1.72 -0.04 0.00 -0.55 0.00 0.00 66.41 64.09 1qqc h THR 523 Cb 0.23 1.85 -0.01 0.00 -1.73 0.00 0.00 68.15 68.49 1qqc h THR 523 CO 0.02 0.50 -0.05 0.74 -0.25 0.00 0.00 175.52 176.48 1qqc h THR 524 N 0.14 1.29 0.00 6.82 2.02 -1.35 -2.17 112.91 119.65 1qqc h THR 524 Ca 0.00 -1.02 0.00 0.00 0.77 0.00 0.00 66.41 66.16 1qqc h THR 524 Cb 0.92 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.91 1qqc h THR 524 CO 0.07 0.31 0.00 0.24 0.37 0.00 0.00 175.52 176.51 1qqc h MET 525 N 0.08 0.00 0.10 6.66 2.07 -1.37 -2.53 114.93 119.94 1qqc h MET 525 Ca 0.05 0.00 -0.29 0.00 -2.07 0.00 0.00 59.70 57.39 1qqc h MET 525 Cb 0.49 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.21 1qqc h MET 525 CO 0.02 0.00 -1.43 -0.09 1.07 0.00 0.00 176.91 176.48 1qqc h ARG 526 N 0.00 0.21 0.43 1.72 2.43 -1.15 -3.24 114.38 114.79 1qqc h ARG 526 Ca 0.00 -0.36 -0.02 0.00 -0.81 0.00 0.00 59.98 58.79 1qqc h ARG 526 Cb 0.29 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1qqc h ARG 526 CO 0.00 1.08 -0.21 0.93 -1.51 0.00 0.00 179.97 180.26 1qqc h GLU 527 N 0.06 -0.56 -0.37 0.20 4.39 -0.99 -2.18 114.58 115.13 1qqc h GLU 527 Ca -0.20 0.04 0.10 0.00 0.34 0.00 0.00 59.36 59.64 1qqc h GLU 527 Cb 1.98 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 30.74 1qqc h GLU 527 CO 0.16 -0.27 0.26 0.97 -1.16 0.00 0.00 179.01 178.97 1qqc h ILE 528 N -0.82 0.84 0.07 3.13 2.10 -1.64 -0.20 117.51 120.99 1qqc h ILE 528 Ca -0.06 -0.02 -0.11 0.00 1.08 0.00 0.00 64.86 65.75 1qqc h ILE 528 Cb 0.55 0.78 0.01 0.00 -1.09 0.00 0.00 36.82 37.07 1qqc h ILE 528 CO 0.10 0.01 -0.50 -0.33 -1.08 0.00 0.00 178.15 176.35 1qqc h GLU 529 N 0.05 0.15 0.00 2.19 5.08 -1.56 -2.49 114.58 118.00 1qqc h GLU 529 Ca 0.17 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1qqc h GLU 529 Cb 0.62 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1qqc h GLU 529 CO -0.01 1.13 -0.11 0.93 -1.00 0.00 0.00 179.01 179.94 1qqc h GLU 530 N -0.67 0.00 0.00 2.33 5.08 -1.21 -3.12 114.58 116.99 1qqc h GLU 530 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1qqc h GLU 530 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1qqc h GLU 530 CO 0.07 0.00 -0.16 1.63 -1.00 0.00 0.00 179.01 179.55 1qqc n LYS 531 N -2.57 5.38 0.00 2.33 5.02 -0.10 -4.78 118.16 123.43 1qqc n LYS 531 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1qqc n LYS 531 Cb 0.47 -0.55 0.00 0.00 -0.02 0.00 0.00 35.03 34.94 1qqc n LYS 531 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1qqc n PHE 532 N -1.00 0.00 -1.11 2.13 3.01 -1.05 -5.03 117.46 114.42 1qqc n PHE 532 Ca 0.00 -0.07 -0.04 0.00 1.01 0.00 0.00 57.45 58.35 1qqc n PHE 532 Cb 0.00 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.45 1qqc n PHE 532 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1qqc n GLY 533 N -0.07 0.65 3.93 1.37 0.00 -1.11 -4.97 105.19 104.99 1qqc n GLY 533 Ca 0.00 -0.43 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 1qqc n GLY 533 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1qqc s PHE 534 N -2.00 2.45 -0.15 1.61 0.40 -0.97 -4.69 117.98 114.63 1qqc s PHE 534 Ca 0.00 0.36 -0.04 0.00 -0.60 0.00 0.00 56.93 56.65 1qqc s PHE 534 Cb 0.00 -3.42 0.05 0.00 0.51 0.00 0.00 43.02 40.17 1qqc s PHE 534 CO 0.00 -1.78 0.06 0.21 0.70 0.00 0.00 175.22 174.42 1qqc s LYS 535 N -5.42 0.26 0.12 0.44 2.20 -0.13 -4.39 119.74 112.82 1qqc s LYS 535 Ca 0.64 -0.10 -0.31 0.00 -0.36 0.00 0.00 55.97 55.85 1qqc s LYS 535 Cb -0.08 -1.65 -0.07 0.00 -1.51 0.00 0.00 37.83 34.51 1qqc s LYS 535 CO 0.47 -0.58 1.29 0.08 -0.36 0.00 0.00 175.35 176.24 1qqc s VAL 536 N 2.05 3.56 -0.10 4.02 1.01 -1.26 -3.20 120.40 126.48 1qqc s VAL 536 Ca 0.02 1.17 0.12 0.00 0.00 0.00 0.00 61.98 63.29 1qqc s VAL 536 Cb -0.15 -3.75 -0.17 0.00 0.00 0.00 0.00 36.38 32.30 1qqc s VAL 536 CO -0.08 0.12 0.11 0.18 0.00 0.00 0.00 175.10 175.43 1qqc n LEU 537 N 3.52 0.00 -3.60 3.92 4.77 -0.40 -4.81 117.00 120.39 1qqc n LEU 537 Ca 0.09 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.91 1qqc n LEU 537 Cb 0.44 0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.70 1qqc n LEU 537 CO 0.57 0.24 0.39 -0.47 -1.33 0.00 0.00 177.39 176.79 1qqc s TYR 538 N -2.48 -0.70 -0.00 -1.77 5.04 -1.22 -1.57 117.35 114.64 1qqc s TYR 538 Ca -0.06 1.54 0.01 0.00 -2.44 0.00 0.00 57.07 56.13 1qqc s TYR 538 Cb 0.05 0.31 -0.00 0.00 0.35 0.00 0.00 41.96 42.66 1qqc s TYR 538 CO 0.54 -0.45 -0.05 0.00 -1.34 0.00 0.00 175.55 174.25 1qqc s ALA 539 N -0.24 0.39 0.55 3.97 0.00 -1.26 -1.14 121.76 124.02 1qqc s ALA 539 Ca -0.04 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 51.72 1qqc s ALA 539 Cb -0.03 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.02 1qqc s ALA 539 CO 0.04 0.09 0.21 -0.25 0.00 0.00 0.00 175.76 175.85 1qqc n ASP 540 N 2.91 3.14 0.28 0.00 8.00 -0.29 -4.83 116.55 125.76 1qqc n ASP 540 Ca -0.13 -3.13 0.13 0.00 0.71 0.00 0.00 54.79 52.37 1qqc n ASP 540 Cb 0.58 0.17 0.84 0.00 -0.02 0.00 0.00 41.12 42.68 1qqc n ASP 540 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1qqc h THR 541 N 0.98 0.62 0.00 -3.53 2.02 -2.01 -3.38 112.91 107.60 1qqc h THR 541 Ca -0.40 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1qqc h THR 541 Cb 1.31 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.80 1qqc h THR 541 CO 0.64 0.03 -0.20 0.47 0.37 0.00 0.00 175.52 176.84 1qqc n ASP 542 N -3.92 0.71 -3.38 4.18 9.92 -1.26 -4.96 116.55 117.84 1qqc n ASP 542 Ca -0.03 0.11 -0.12 0.00 -0.53 0.00 0.00 54.79 54.22 1qqc n ASP 542 Cb 0.11 -0.35 0.01 0.00 -0.64 0.00 0.00 41.12 40.26 1qqc n ASP 542 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1qqc n GLY 543 N 2.69 2.65 3.44 0.44 0.00 -1.26 -4.15 105.19 109.01 1qqc n GLY 543 Ca -0.03 -2.22 -0.15 0.00 0.00 0.00 0.00 46.02 43.63 1qqc n GLY 543 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1qqc s PHE 544 N -1.16 -0.54 -0.06 1.61 -0.12 -0.91 -1.14 117.98 115.66 1qqc s PHE 544 Ca 0.19 0.65 -0.13 0.00 -0.05 0.00 0.00 56.93 57.59 1qqc s PHE 544 Cb -0.01 0.43 -0.05 0.00 -0.63 0.00 0.00 43.02 42.75 1qqc s PHE 544 CO 0.12 -0.69 0.33 -0.06 -0.05 0.00 0.00 175.22 174.86 1qqc s PHE 545 N -2.40 3.65 0.21 3.49 0.08 -0.30 -1.14 117.98 121.56 1qqc s PHE 545 Ca -0.05 0.81 -0.16 0.00 0.12 0.00 0.00 56.93 57.65 1qqc s PHE 545 Cb -0.01 -2.22 0.02 0.00 -0.57 0.00 0.00 43.02 40.24 1qqc s PHE 545 CO -0.01 0.58 0.49 0.00 -0.10 0.00 0.00 175.22 176.19 1qqc s ALA 546 N -0.75 -0.68 0.21 5.36 0.00 -0.25 -1.28 121.76 124.36 1qqc s ALA 546 Ca 0.20 -0.46 -0.23 0.00 0.00 0.00 0.00 51.96 51.48 1qqc s ALA 546 Cb -0.15 0.89 0.05 0.00 0.00 0.00 0.00 23.12 23.91 1qqc s ALA 546 CO 0.09 -0.81 0.88 -0.08 0.00 0.00 0.00 175.76 175.85 1qqc s THR 547 N -3.92 0.00 -0.31 0.00 -1.32 -1.19 -1.12 115.64 107.78 1qqc s THR 547 Ca 0.13 -0.79 -0.04 0.00 -1.21 0.00 0.00 61.69 59.78 1qqc s THR 547 Cb -0.01 -2.10 0.04 0.00 -1.51 0.00 0.00 72.50 68.93 1qqc s THR 547 CO 0.01 0.00 0.04 -0.63 -2.21 0.00 0.00 174.62 171.82 1qqc s ILE 548 N -3.37 3.34 -0.03 5.08 1.01 -1.26 -0.96 121.20 125.01 1qqc s ILE 548 Ca 0.13 -1.19 -0.35 0.00 0.00 0.00 0.00 60.65 59.24 1qqc s ILE 548 Cb -0.03 -2.86 -0.13 0.00 0.01 0.00 0.00 42.46 39.44 1qqc s ILE 548 CO 0.05 -0.08 1.75 -0.81 0.00 0.00 0.00 174.94 175.85 1qqc n PRO 549 N 4.72 2.00 -1.60 2.79 -0.04 -1.26 -2.72 135.00 138.89 1qqc n PRO 549 Ca -0.13 0.73 -0.03 0.00 -0.04 0.00 0.00 63.50 64.02 1qqc n PRO 549 Cb 0.45 -2.53 -0.01 0.00 -0.04 0.00 0.00 33.50 31.37 1qqc n PRO 549 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qqc n GLY 550 N 4.00 0.42 3.57 0.55 0.00 -1.26 -5.06 105.19 107.42 1qqc n GLY 550 Ca 0.21 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 45.14 1qqc n GLY 550 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qqc s ALA 551 N -2.14 2.96 0.53 4.61 0.00 -1.10 -5.11 121.76 121.51 1qqc s ALA 551 Ca 0.00 -1.56 -0.22 0.00 0.00 0.00 0.00 51.96 50.18 1qqc s ALA 551 Cb 0.00 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.38 1qqc s ALA 551 CO 0.00 0.40 1.36 -3.47 0.00 0.00 0.00 175.76 174.05 1qqc n ASP 552 N -0.24 2.74 -0.30 0.00 -0.08 -1.26 -4.83 116.55 112.60 1qqc n ASP 552 Ca -0.09 1.00 0.03 0.00 -1.51 0.00 0.00 54.79 54.22 1qqc n ASP 552 Cb 0.57 -1.58 0.18 0.00 2.34 0.00 0.00 41.12 42.63 1qqc n ASP 552 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1qqc h ALA 553 N 1.54 1.20 0.00 -1.67 0.00 -1.99 0.77 119.26 119.12 1qqc h ALA 553 Ca -0.51 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 1qqc h ALA 553 Cb 1.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1qqc h ALA 553 CO 0.57 0.09 -0.35 0.93 0.00 0.00 0.00 179.25 180.50 1qqc h GLU 554 N 0.79 0.00 -0.04 0.00 4.39 -2.00 -2.03 114.58 115.70 1qqc h GLU 554 Ca 0.41 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 60.00 1qqc h GLU 554 Cb 0.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1qqc h GLU 554 CO -0.26 0.35 -0.47 1.15 -1.16 0.00 0.00 179.01 178.62 1qqc h THR 555 N 0.00 1.34 0.17 1.13 2.02 -1.24 -2.17 112.91 114.16 1qqc h THR 555 Ca -0.00 -1.64 -0.27 0.00 0.77 0.00 0.00 66.41 65.27 1qqc h THR 555 Cb 0.87 1.84 0.03 0.00 -1.74 0.00 0.00 68.15 69.15 1qqc h THR 555 CO 0.05 0.48 -1.16 0.58 0.37 0.00 0.00 175.52 175.83 1qqc h VAL 556 N 0.07 1.36 -0.53 3.16 2.07 -0.81 -2.64 116.25 118.94 1qqc h VAL 556 Ca 0.00 -2.55 -0.02 0.00 0.82 0.00 0.00 66.70 64.95 1qqc h VAL 556 Cb 0.86 2.98 -0.02 0.00 -1.52 0.00 0.00 31.29 33.59 1qqc h VAL 556 CO 0.07 0.75 0.25 0.11 0.02 0.00 0.00 177.57 178.77 1qqc h LYS 557 N -0.00 0.76 -0.19 1.57 1.57 -1.34 -1.82 116.57 117.12 1qqc h LYS 557 Ca -0.19 -0.11 -0.15 0.00 -1.87 0.00 0.00 60.65 58.32 1qqc h LYS 557 Cb 1.89 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 34.07 1qqc h LYS 557 CO 0.22 0.63 -0.46 -0.91 -0.57 0.00 0.00 179.45 178.37 1qqc h ASN 558 N 0.70 0.73 -0.20 0.86 2.35 -1.50 -2.86 115.58 115.66 1qqc h ASN 558 Ca 0.18 -0.57 -0.02 0.00 -0.55 0.00 0.00 56.30 55.34 1qqc h ASN 558 Cb 0.13 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 1qqc h ASN 558 CO -0.02 1.16 0.07 0.50 -1.65 0.00 0.00 177.43 177.49 1qqc h LYS 559 N 0.32 0.39 -0.01 0.81 1.63 -1.43 -1.50 116.57 116.78 1qqc h LYS 559 Ca -0.00 -0.05 -0.12 0.00 -0.85 0.00 0.00 60.65 59.63 1qqc h LYS 559 Cb 1.07 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.61 1qqc h LYS 559 CO 0.10 0.36 -0.54 0.00 -3.45 0.00 0.00 179.45 175.92 1qqc h ALA 560 N 1.69 1.08 -0.15 5.00 0.00 -1.27 -2.55 119.26 123.07 1qqc h ALA 560 Ca 0.09 -0.49 -0.20 0.00 0.00 0.00 0.00 54.91 54.31 1qqc h ALA 560 Cb 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1qqc h ALA 560 CO -0.00 0.68 -0.70 0.87 0.00 0.00 0.00 179.25 180.10 1qqc h LYS 561 N 0.03 0.63 -0.48 0.00 1.79 -1.06 -2.39 116.57 115.09 1qqc h LYS 561 Ca -0.00 -0.48 -0.04 0.00 -2.18 0.00 0.00 60.65 57.95 1qqc h LYS 561 Cb 0.97 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.68 1qqc h LYS 561 CO 0.07 1.10 0.13 0.93 -1.08 0.00 0.00 179.45 180.60 1qqc h GLU 562 N 0.45 0.71 0.06 3.15 5.08 -1.19 -2.82 114.58 120.03 1qqc h GLU 562 Ca -0.03 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1qqc h GLU 562 Cb 1.29 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1qqc h GLU 562 CO 0.13 0.64 -0.03 0.35 -1.00 0.00 0.00 179.01 179.10 1qqc h PHE 563 N 0.70 -0.08 -0.15 4.33 3.57 -1.33 -3.27 116.94 120.71 1qqc h PHE 563 Ca 0.16 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.68 1qqc h PHE 563 Cb 0.24 0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.96 1qqc h PHE 563 CO 0.01 0.19 -0.38 -0.07 -2.23 0.00 0.00 178.31 175.83 1qqc h LEU 564 N -0.35 -1.21 -2.46 0.59 3.38 -1.18 -0.42 115.31 113.66 1qqc h LEU 564 Ca -0.01 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1qqc h LEU 564 Cb 0.30 0.48 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1qqc h LEU 564 CO 0.01 -0.32 0.00 -0.46 0.09 0.00 0.00 178.44 177.77 1qqc n ASN 565 N -4.52 3.30 0.00 -0.43 0.23 -1.14 -1.87 115.26 110.82 1qqc n ASN 565 Ca -0.04 -1.88 0.00 0.00 -0.53 0.00 0.00 54.58 52.13 1qqc n ASN 565 Cb 0.25 -0.63 0.00 0.00 -2.08 0.00 0.00 39.78 37.32 1qqc n ASN 565 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1qqc n TYR 566 N 0.98 0.00 0.03 -2.53 9.36 -0.26 -4.79 117.16 119.95 1qqc n TYR 566 Ca 0.00 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.08 1qqc n TYR 566 Cb 0.42 0.00 -0.14 0.00 -0.63 0.00 0.00 39.34 38.99 1qqc n TYR 566 CO 0.00 0.00 0.00 0.97 0.22 0.00 0.00 176.86 178.05 1qqc h ILE 567 N 0.00 1.07 -0.46 2.97 6.09 -0.57 -3.36 117.51 123.24 1qqc h ILE 567 Ca 0.00 -2.78 -0.05 0.00 -1.37 0.00 0.00 64.86 60.65 1qqc h ILE 567 Cb 0.69 2.65 -0.02 0.00 0.47 0.00 0.00 36.82 40.61 1qqc h ILE 567 CO 0.00 0.76 0.09 0.78 -3.07 0.00 0.00 178.15 176.71 1qqc h ASN 568 N 0.04 0.73 0.57 2.19 -0.26 -1.70 -0.96 115.58 116.19 1qqc h ASN 568 Ca -0.25 -0.25 0.00 0.00 -0.56 0.00 0.00 56.30 55.24 1qqc h ASN 568 Cb 1.99 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 39.06 1qqc h ASN 568 CO 0.13 0.79 0.00 -0.65 -1.06 0.00 0.00 177.43 176.64 1qqc h PRO 569 N 0.63 0.00 0.00 0.81 0.11 -1.84 -1.72 132.00 129.98 1qqc h PRO 569 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1qqc h PRO 569 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1qqc h PRO 569 CO 0.01 0.00 -0.76 0.54 -0.21 0.00 0.00 178.00 177.58 1qqc n ARG 570 N -2.51 0.25 -3.15 1.05 1.74 -0.66 -4.89 116.66 108.49 1qqc n ARG 570 Ca 0.01 0.04 -0.39 0.00 -0.77 0.00 0.00 57.85 56.74 1qqc n ARG 570 Cb 0.19 -1.63 -0.05 0.00 -1.02 0.00 0.00 32.46 29.95 1qqc n ARG 570 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1qqc s LEU 571 N -3.96 4.39 0.49 0.55 1.43 -0.45 -5.06 118.68 116.06 1qqc s LEU 571 Ca 0.06 1.18 -0.20 0.00 -1.03 0.00 0.00 54.13 54.14 1qqc s LEU 571 Cb 0.14 -2.98 -0.08 0.00 0.03 0.00 0.00 46.19 43.29 1qqc s LEU 571 CO 0.75 0.04 1.03 -2.16 0.23 0.00 0.00 176.35 176.24 1qqc s PRO 572 N 0.09 3.80 4.27 1.29 0.04 -1.26 -4.88 135.00 138.34 1qqc s PRO 572 Ca 0.33 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.70 1qqc s PRO 572 Cb -0.18 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.26 1qqc s PRO 572 CO 0.18 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.20 1qqc n GLY 573 N -0.35 0.89 0.60 0.56 0.00 -1.26 -3.92 105.19 101.70 1qqc n GLY 573 Ca 0.09 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.42 1qqc n GLY 573 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qqc n LEU 574 N 0.00 2.16 -4.77 0.99 4.32 -1.26 -4.99 117.00 113.44 1qqc n LEU 574 Ca 0.00 -0.75 -0.39 0.00 -0.02 0.00 0.00 56.01 54.85 1qqc n LEU 574 Cb 0.00 -0.01 -0.03 0.00 -1.62 0.00 0.00 43.42 41.76 1qqc n LEU 574 CO 0.00 0.38 0.85 -1.48 -1.22 0.00 0.00 177.39 175.92 1qqc s LEU 575 N -2.32 4.32 0.04 2.23 0.05 -1.25 -5.01 118.68 116.74 1qqc s LEU 575 Ca 0.23 2.37 -0.12 0.00 0.05 0.00 0.00 54.13 56.66 1qqc s LEU 575 Cb 0.19 -3.87 0.01 0.00 -2.05 0.00 0.00 46.19 40.48 1qqc s LEU 575 CO 0.48 -0.51 0.27 -1.61 -0.55 0.00 0.00 176.35 174.43 1qqc s GLU 576 N -2.01 0.77 -0.11 1.48 2.02 -1.26 -4.86 118.70 114.73 1qqc s GLU 576 Ca 0.52 -0.55 -0.08 0.00 0.02 0.00 0.00 54.97 54.88 1qqc s GLU 576 Cb -0.32 0.33 -0.04 0.00 0.10 0.00 0.00 34.13 34.20 1qqc s GLU 576 CO 0.41 -0.24 0.18 -0.51 0.02 0.00 0.00 175.26 175.12 1qqc s LEU 577 N -2.08 4.39 -0.06 1.80 1.43 -1.26 -1.39 118.68 121.52 1qqc s LEU 577 Ca -0.05 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.61 1qqc s LEU 577 Cb -0.01 -2.15 0.01 0.00 0.03 0.00 0.00 46.19 44.07 1qqc s LEU 577 CO -0.04 0.38 -0.12 -0.70 0.23 0.00 0.00 176.35 176.11 1qqc s GLU 578 N -0.95 1.59 0.23 1.70 2.12 0.40 -4.94 118.70 118.85 1qqc s GLU 578 Ca 0.16 -0.39 -0.31 0.00 0.36 0.00 0.00 54.97 54.78 1qqc s GLU 578 Cb -0.13 -1.33 -0.13 0.00 0.26 0.00 0.00 34.13 32.80 1qqc s GLU 578 CO 0.05 0.04 1.47 0.98 -0.54 0.00 0.00 175.26 177.25 1qqc n TYR 579 N 3.76 2.29 -0.02 5.30 9.36 -1.26 -1.12 117.16 135.46 1qqc n TYR 579 Ca -0.23 0.37 -0.04 0.00 3.32 0.00 0.00 57.90 61.33 1qqc n TYR 579 Cb 0.52 -2.50 -0.02 0.00 -0.63 0.00 0.00 39.34 36.71 1qqc n TYR 579 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 1qqc n GLU 580 N 2.30 0.10 -3.90 2.98 0.00 -1.03 -4.83 120.64 116.26 1qqc n GLU 580 Ca 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 57.16 57.30 1qqc n GLU 580 Cb 0.32 -0.80 0.02 0.00 0.00 0.00 0.00 31.44 30.98 1qqc n GLU 580 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1qqc s GLY 581 N -4.87 0.05 0.00 8.31 0.00 -1.24 -5.01 107.32 104.56 1qqc s GLY 581 Ca -0.06 -0.23 0.03 0.00 0.00 0.00 0.00 44.72 44.46 1qqc s GLY 581 CO 0.09 3.14 -0.08 -0.12 0.00 0.00 0.00 173.10 176.12 1qqc s PHE 582 N -2.15 0.73 0.00 1.90 5.36 -1.26 -2.59 117.98 119.98 1qqc s PHE 582 Ca 0.23 -0.20 0.03 0.00 -0.96 0.00 0.00 56.93 56.04 1qqc s PHE 582 Cb -0.02 -0.46 -0.01 0.00 -0.34 0.00 0.00 43.02 42.19 1qqc s PHE 582 CO 0.04 -0.02 -0.11 0.71 -1.46 0.00 0.00 175.22 174.39 1qqc s TYR 583 N -0.40 0.94 0.08 10.12 1.51 0.15 -4.31 117.35 125.45 1qqc s TYR 583 Ca 0.01 -0.22 -0.11 0.00 -1.01 0.00 0.00 57.07 55.74 1qqc s TYR 583 Cb -0.04 -0.59 -0.23 0.00 -0.11 0.00 0.00 41.96 40.99 1qqc s TYR 583 CO -0.00 -0.01 1.18 -0.09 -1.11 0.00 0.00 175.55 175.51 1qqc h ARG 584 N 5.64 0.55 -3.21 -0.62 2.43 -1.33 0.11 114.38 117.96 1qqc h ARG 584 Ca -0.33 -0.69 -0.09 0.00 -0.81 0.00 0.00 59.98 58.07 1qqc h ARG 584 Cb 1.18 0.22 -0.17 0.00 -0.42 0.00 0.00 29.97 30.78 1qqc h ARG 584 CO 0.48 1.29 -0.20 1.03 -1.51 0.00 0.00 179.97 181.06 1qqc s ARG 585 N -3.09 0.84 -0.15 0.20 0.52 -1.24 -2.17 118.95 113.86 1qqc s ARG 585 Ca -0.08 -0.45 -0.34 0.00 -0.52 0.00 0.00 55.73 54.34 1qqc s ARG 585 Cb 0.07 0.37 0.13 0.00 0.52 0.00 0.00 34.95 36.04 1qqc s ARG 585 CO 0.91 -0.28 1.19 0.20 0.02 0.00 0.00 175.30 177.34 1qqc s GLY 586 N -2.03 -0.32 -0.06 -3.53 0.00 -0.98 -1.85 107.32 98.56 1qqc s GLY 586 Ca -0.05 1.40 -0.07 0.00 0.00 0.00 0.00 44.72 46.00 1qqc s GLY 586 CO -0.03 0.45 0.19 -0.11 0.00 0.00 0.00 173.10 173.60 1qqc s PHE 587 N -2.49 -0.17 -0.19 1.90 -0.12 -0.99 -2.03 117.98 113.90 1qqc s PHE 587 Ca 0.10 0.40 -0.01 0.00 -0.05 0.00 0.00 56.93 57.37 1qqc s PHE 587 Cb -0.00 0.05 0.00 0.00 -0.63 0.00 0.00 43.02 42.45 1qqc s PHE 587 CO -0.05 -0.14 -0.13 -0.06 -0.05 0.00 0.00 175.22 174.79 1qqc s PHE 588 N -0.19 2.84 -0.17 3.49 0.40 -1.26 -2.53 117.98 120.55 1qqc s PHE 588 Ca -0.03 -1.23 -0.24 0.00 -0.60 0.00 0.00 56.93 54.83 1qqc s PHE 588 Cb -0.03 -1.97 -0.21 0.00 0.51 0.00 0.00 43.02 41.32 1qqc s PHE 588 CO 0.01 -0.62 0.44 0.28 0.70 0.00 0.00 175.22 176.02 1qqc h VAL 589 N 5.78 1.25 -1.08 -0.44 2.07 -1.30 -3.43 116.25 119.09 1qqc h VAL 589 Ca -0.41 -2.19 0.00 0.00 0.82 0.00 0.00 66.70 64.92 1qqc h VAL 589 Cb 1.16 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.55 1qqc h VAL 589 CO 0.61 0.42 0.00 0.35 0.02 0.00 0.00 177.57 178.97 1qqc n THR 590 N -4.52 0.00 0.24 2.57 -2.24 -1.18 -4.92 114.28 104.23 1qqc n THR 590 Ca -0.21 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.68 1qqc n THR 590 Cb 0.57 0.00 0.56 0.00 -2.10 0.00 0.00 70.33 69.36 1qqc n THR 590 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1qqc n LYS 591 N 0.00 0.16 -1.68 -0.78 5.02 -1.26 -3.53 118.16 116.09 1qqc n LYS 591 Ca 0.00 0.57 -0.03 0.00 -2.02 0.00 0.00 58.31 56.83 1qqc n LYS 591 Cb 0.00 -1.94 0.01 0.00 -0.02 0.00 0.00 35.03 33.08 1qqc n LYS 591 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1qqc n LYS 592 N -2.27 0.49 -3.81 1.97 5.02 -1.26 -5.04 118.16 113.26 1qqc n LYS 592 Ca -0.00 -1.54 -0.22 0.00 -2.02 0.00 0.00 58.31 54.53 1qqc n LYS 592 Cb 0.10 0.15 -0.17 0.00 -0.02 0.00 0.00 35.03 35.09 1qqc n LYS 592 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1qqc s LYS 593 N -0.38 0.61 0.19 1.97 1.02 -1.23 -4.14 119.74 117.77 1qqc s LYS 593 Ca 0.12 0.09 -0.24 0.00 0.02 0.00 0.00 55.97 55.97 1qqc s LYS 593 Cb 0.22 -0.94 0.05 0.00 -0.52 0.00 0.00 37.83 36.64 1qqc s LYS 593 CO -0.07 -0.28 0.90 1.52 -0.92 0.00 0.00 175.35 176.51 1qqc s TYR 594 N 1.84 -0.14 -0.09 3.18 -0.85 -1.05 -0.84 117.35 119.41 1qqc s TYR 594 Ca 0.03 -0.21 -0.05 0.00 -0.52 0.00 0.00 57.07 56.32 1qqc s TYR 594 Cb -0.12 0.66 0.04 0.00 0.38 0.00 0.00 41.96 42.91 1qqc s TYR 594 CO -0.05 -0.93 0.22 0.00 -1.52 0.00 0.00 175.55 173.27 1qqc s ALA 595 N -3.41 -0.50 0.06 9.51 0.00 -1.05 -0.83 121.76 125.54 1qqc s ALA 595 Ca 0.12 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.93 1qqc s ALA 595 Cb -0.03 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 1qqc s ALA 595 CO 0.04 -0.16 -0.06 0.14 0.00 0.00 0.00 175.76 175.72 1qqc s VAL 596 N 0.92 0.48 -0.09 0.00 -7.23 0.80 -2.35 120.40 112.93 1qqc s VAL 596 Ca -0.07 -1.55 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 1qqc s VAL 596 Cb -0.08 -1.19 0.02 0.00 0.56 0.00 0.00 36.38 35.69 1qqc s VAL 596 CO -0.06 -0.72 -0.08 -0.51 -0.31 0.00 0.00 175.10 173.42 1qqc s ILE 597 N -2.82 0.96 0.96 -0.62 2.07 -0.77 -0.33 121.20 120.64 1qqc s ILE 597 Ca 0.02 -0.29 -0.16 0.00 -1.41 0.00 0.00 60.65 58.80 1qqc s ILE 597 Cb -0.00 -0.96 0.23 0.00 0.13 0.00 0.00 42.46 41.86 1qqc s ILE 597 CO -0.04 0.34 1.11 -0.90 -1.91 0.00 0.00 174.94 173.55 1qqc n ASP 598 N 4.56 -0.67 0.16 4.50 3.85 -0.53 -1.07 116.55 127.35 1qqc n ASP 598 Ca -0.16 -1.31 0.01 0.00 -0.71 0.00 0.00 54.79 52.62 1qqc n ASP 598 Cb 0.51 -0.91 0.32 0.00 -1.35 0.00 0.00 41.12 39.68 1qqc n ASP 598 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1qqc h GLU 599 N 0.00 0.04 -0.15 0.11 5.08 -1.91 -2.44 114.58 115.32 1qqc h GLU 599 Ca -0.38 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1qqc h GLU 599 Cb 1.08 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1qqc h GLU 599 CO 0.26 0.44 0.00 -1.91 -1.00 0.00 0.00 179.01 176.80 1qqc n GLU 600 N -4.06 0.97 -1.04 2.33 2.13 -1.26 -4.85 120.64 114.87 1qqc n GLU 600 Ca -0.02 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.79 1qqc n GLU 600 Cb 0.44 -1.07 -0.01 0.00 0.27 0.00 0.00 31.44 31.07 1qqc n GLU 600 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1qqc n ASP 601 N -0.42 -3.95 -4.72 4.31 9.92 -0.92 -5.02 116.55 115.75 1qqc n ASP 601 Ca 0.00 0.03 -0.41 0.00 -0.53 0.00 0.00 54.79 53.88 1qqc n ASP 601 Cb 0.04 -1.57 -0.04 0.00 -0.64 0.00 0.00 41.12 38.91 1qqc n ASP 601 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1qqc s LYS 602 N -1.02 4.63 -0.17 -1.24 2.47 -1.26 -4.81 119.74 118.33 1qqc s LYS 602 Ca 0.00 1.50 -0.07 0.00 -1.56 0.00 0.00 55.97 55.85 1qqc s LYS 602 Cb 0.00 -3.38 -0.04 0.00 -1.46 0.00 0.00 37.83 32.95 1qqc s LYS 602 CO 0.00 0.10 0.04 0.42 0.16 0.00 0.00 175.35 176.07 1qqc s ILE 603 N 0.28 4.60 0.03 5.43 1.01 -1.26 -1.45 121.20 129.84 1qqc s ILE 603 Ca 0.49 -0.10 0.07 0.00 0.00 0.00 0.00 60.65 61.11 1qqc s ILE 603 Cb -0.24 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.15 1qqc s ILE 603 CO 0.30 0.47 -0.20 -0.89 0.00 0.00 0.00 174.94 174.62 1qqc s THR 604 N 0.34 1.60 0.04 2.92 2.01 0.55 -4.98 115.64 118.12 1qqc s THR 604 Ca 0.02 -1.11 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 1qqc s THR 604 Cb -0.13 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 1qqc s THR 604 CO 0.01 0.24 -0.03 0.42 -0.69 0.00 0.00 174.62 174.56 1qqc s THR 605 N -0.74 0.21 -0.10 -0.82 -4.23 -1.26 -0.14 115.64 108.55 1qqc s THR 605 Ca 0.07 -1.45 -0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1qqc s THR 605 Cb -0.08 -1.01 0.02 0.00 1.34 0.00 0.00 72.50 72.77 1qqc s THR 605 CO 0.01 -0.78 -0.06 -0.60 -0.54 0.00 0.00 174.62 172.65 1qqc s ARG 606 N -2.89 1.37 -1.44 3.99 3.52 -0.01 -4.82 118.95 118.67 1qqc s ARG 606 Ca -0.02 -0.20 0.00 0.00 -0.13 0.00 0.00 55.73 55.38 1qqc s ARG 606 Cb 0.00 -1.47 0.00 0.00 -1.56 0.00 0.00 34.95 31.92 1qqc s ARG 606 CO -0.06 -0.26 0.00 0.41 -0.81 0.00 0.00 175.30 174.58 1qqc n GLY 607 N 4.93 -0.16 0.00 8.12 0.00 -1.26 -2.52 105.19 114.30 1qqc n GLY 607 Ca -0.12 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1qqc n GLY 607 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qqc n LEU 608 N -2.33 0.78 -4.67 0.99 4.77 -1.26 -4.88 117.00 110.40 1qqc n LEU 608 Ca -0.19 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.49 1qqc n LEU 608 Cb 0.64 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.96 1qqc n LEU 608 CO 0.23 0.13 0.68 -1.61 -1.33 0.00 0.00 177.39 175.49 1qqc s GLU 609 N -1.87 -0.81 -0.23 3.23 2.02 -1.26 -4.94 118.70 114.85 1qqc s GLU 609 Ca 0.00 -0.16 -0.29 0.00 0.02 0.00 0.00 54.97 54.54 1qqc s GLU 609 Cb 0.00 -1.65 -0.03 0.00 0.10 0.00 0.00 34.13 32.55 1qqc s GLU 609 CO 0.00 -3.42 1.71 0.42 0.02 0.00 0.00 175.26 173.99 1qqc s ILE 610 N -3.22 3.57 -2.68 -1.63 1.01 -1.26 -4.86 121.20 112.13 1qqc s ILE 610 Ca 0.72 0.63 0.25 0.00 0.00 0.00 0.00 60.65 62.25 1qqc s ILE 610 Cb -0.08 -3.61 0.29 0.00 0.01 0.00 0.00 42.46 39.06 1qqc s ILE 610 CO 0.55 -0.28 1.41 0.52 0.00 0.00 0.00 174.94 177.14 1qqc n VAL 611 N 6.65 0.00 -0.40 2.92 0.31 -1.26 -4.98 118.33 121.57 1qqc n VAL 611 Ca 0.20 -0.38 -0.27 0.00 -0.01 0.00 0.00 64.34 63.89 1qqc n VAL 611 Cb 0.45 1.11 0.24 0.00 -0.91 0.00 0.00 33.84 34.72 1qqc n VAL 611 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1qqc n ARG 612 N 0.74 -3.42 0.00 5.55 1.74 -1.26 -4.97 116.66 115.04 1qqc n ARG 612 Ca 0.15 -1.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.22 1qqc n ARG 612 Cb 0.50 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1qqc n ARG 612 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1qqc n ARG 613 N -4.13 3.78 -0.83 5.56 1.74 -1.26 -4.70 116.66 116.81 1qqc n ARG 613 Ca 0.08 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.13 1qqc n ARG 613 Cb 0.52 -0.56 0.19 0.00 -1.02 0.00 0.00 32.46 31.59 1qqc n ARG 613 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1qqc n ASP 614 N -0.88 2.46 -4.73 0.55 8.00 -1.26 -4.61 116.55 116.09 1qqc n ASP 614 Ca 0.00 -3.83 -0.33 0.00 0.71 0.00 0.00 54.79 51.35 1qqc n ASP 614 Cb 0.00 -0.60 0.10 0.00 -0.02 0.00 0.00 41.12 40.60 1qqc n ASP 614 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1qqc s TRP 615 N -3.28 2.15 0.30 1.24 1.48 -1.26 -4.83 118.94 114.74 1qqc s TRP 615 Ca 0.44 1.63 0.07 0.00 -1.06 0.00 0.00 56.10 57.17 1qqc s TRP 615 Cb 0.40 -3.31 -0.06 0.00 -1.16 0.00 0.00 33.47 29.34 1qqc s TRP 615 CO -0.02 -2.33 -0.04 -1.54 -4.06 0.00 0.00 176.95 168.95 1qqc s SER 616 N -2.53 2.90 0.06 -2.66 1.04 -1.26 -4.43 113.70 106.81 1qqc s SER 616 Ca 0.69 -1.23 -0.32 0.00 0.48 0.00 0.00 55.95 55.57 1qqc s SER 616 Cb -0.24 -0.19 -0.18 0.00 0.10 0.00 0.00 66.02 65.50 1qqc s SER 616 CO 0.49 -0.37 1.52 -0.08 0.98 0.00 0.00 173.24 175.78 1qqc h GLU 617 N 2.20 -0.89 -0.33 4.02 4.57 -1.67 -2.77 114.58 119.71 1qqc h GLU 617 Ca -0.41 0.06 0.10 0.00 -1.18 0.00 0.00 59.36 57.93 1qqc h GLU 617 Cb 1.24 0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 30.02 1qqc h GLU 617 CO 0.69 -0.57 0.25 0.97 -1.18 0.00 0.00 179.01 179.16 1qqc h ILE 618 N -0.99 0.78 -0.00 2.32 2.10 -1.61 -0.62 117.51 119.49 1qqc h ILE 618 Ca -0.09 0.00 -0.18 0.00 1.08 0.00 0.00 64.86 65.67 1qqc h ILE 618 Cb 0.73 0.82 -0.02 0.00 -1.09 0.00 0.00 36.82 37.26 1qqc h ILE 618 CO 0.15 0.00 -0.82 0.00 -1.08 0.00 0.00 178.15 176.41 1qqc h ALA 619 N 1.81 0.62 0.01 0.18 0.00 -1.83 -2.78 119.26 117.27 1qqc h ALA 619 Ca 0.16 -0.71 -0.22 0.00 0.00 0.00 0.00 54.91 54.14 1qqc h ALA 619 Cb 0.66 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1qqc h ALA 619 CO -0.00 0.93 -1.06 -0.22 0.00 0.00 0.00 179.25 178.90 1qqc h LYS 620 N 0.07 0.01 -0.15 0.00 3.64 -0.87 -3.12 116.57 116.14 1qqc h LYS 620 Ca -0.03 -0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.13 1qqc h LYS 620 Cb 1.43 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.26 1qqc h LYS 620 CO 0.12 0.98 -0.73 1.49 -2.27 0.00 0.00 179.45 179.04 1qqc h GLU 621 N 0.00 0.70 -0.43 1.90 4.81 -1.26 -3.06 114.58 117.24 1qqc h GLU 621 Ca -0.03 -0.54 -0.14 0.00 -0.13 0.00 0.00 59.36 58.51 1qqc h GLU 621 Cb 1.79 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 31.27 1qqc h GLU 621 CO 0.13 1.16 -0.27 1.15 -0.73 0.00 0.00 179.01 180.45 1qqc h THR 622 N 0.49 1.27 -0.14 0.32 2.02 -1.56 -2.22 112.91 113.09 1qqc h THR 622 Ca -0.04 -1.44 -0.04 0.00 0.77 0.00 0.00 66.41 65.66 1qqc h THR 622 Cb 1.33 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 1qqc h THR 622 CO 0.14 0.49 -0.11 -0.61 0.37 0.00 0.00 175.52 175.81 1qqc h GLN 623 N 0.79 0.22 -0.10 6.66 4.15 -1.61 -1.36 115.11 123.85 1qqc h GLN 623 Ca 0.09 -0.04 -0.17 0.00 0.77 0.00 0.00 58.65 59.30 1qqc h GLN 623 Cb 0.86 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.51 1qqc h GLN 623 CO 0.08 0.33 -0.65 0.00 -1.93 0.00 0.00 178.83 176.66 1qqc h ALA 624 N 1.69 0.69 -0.07 3.38 0.00 -1.41 -2.51 119.26 121.03 1qqc h ALA 624 Ca 0.04 -0.57 -0.17 0.00 0.00 0.00 0.00 54.91 54.22 1qqc h ALA 624 Cb 0.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1qqc h ALA 624 CO 0.02 0.74 -0.67 0.00 0.00 0.00 0.00 179.25 179.33 1qqc h ARG 625 N 0.28 0.31 -0.24 0.00 3.08 -0.79 -2.46 114.38 114.56 1qqc h ARG 625 Ca -0.02 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 1qqc h ARG 625 Cb 1.20 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 1qqc h ARG 625 CO 0.11 0.87 -0.00 0.28 -1.07 0.00 0.00 179.97 180.16 1qqc h VAL 626 N 0.22 1.26 0.00 2.04 2.07 -1.20 -2.42 116.25 118.22 1qqc h VAL 626 Ca -0.02 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1qqc h VAL 626 Cb 1.22 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1qqc h VAL 626 CO 0.11 0.28 -0.16 -0.07 0.02 0.00 0.00 177.57 177.75 1qqc h LEU 627 N 0.19 0.00 0.12 2.57 3.38 -1.42 -2.83 115.31 117.33 1qqc h LEU 627 Ca 0.07 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.74 1qqc h LEU 627 Cb 0.42 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.19 1qqc h LEU 627 CO 0.01 0.16 -1.27 -0.33 0.09 0.00 0.00 178.44 177.10 1qqc h GLU 628 N 0.00 0.47 -0.51 1.13 5.08 -1.25 -1.96 114.58 117.55 1qqc h GLU 628 Ca -0.00 -0.70 -0.09 0.00 -1.00 0.00 0.00 59.36 57.57 1qqc h GLU 628 Cb 0.40 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1qqc h GLU 628 CO 0.02 1.32 -0.03 0.00 -1.00 0.00 0.00 179.01 179.31 1qqc h ALA 629 N 0.40 0.97 0.17 3.43 0.00 -1.30 -0.21 119.26 122.72 1qqc h ALA 629 Ca -0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1qqc h ALA 629 Cb 1.96 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1qqc h ALA 629 CO 0.23 0.62 -0.08 0.82 0.00 0.00 0.00 179.25 180.84 1qqc h ILE 630 N 0.82 0.55 0.17 0.00 2.04 -1.59 0.98 117.51 120.49 1qqc h ILE 630 Ca 0.15 -1.09 -0.24 0.00 1.00 0.00 0.00 64.86 64.67 1qqc h ILE 630 Cb 0.54 0.97 0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1qqc h ILE 630 CO 0.03 0.16 -1.09 -0.07 0.00 0.00 0.00 178.15 177.18 1qqc h LEU 631 N -0.97 0.57 0.19 1.44 3.38 -1.41 -1.04 115.31 117.46 1qqc h LEU 631 Ca -0.02 -0.94 -0.31 0.00 0.09 0.00 0.00 57.88 56.71 1qqc h LEU 631 Cb 0.43 -0.19 0.02 0.00 0.09 0.00 0.00 40.66 41.02 1qqc h LEU 631 CO 0.04 1.52 -1.37 0.50 0.09 0.00 0.00 178.44 179.22 1qqc h LYS 632 N -0.21 0.39 0.00 1.13 3.64 -1.21 -3.39 116.57 116.92 1qqc h LYS 632 Ca -0.20 -0.67 0.00 0.00 -1.27 0.00 0.00 60.65 58.51 1qqc h LYS 632 Cb 1.82 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 33.89 1qqc h LYS 632 CO 0.18 1.32 -0.64 0.72 -2.27 0.00 0.00 179.45 178.76 1qqc n HIS 633 N -3.61 0.00 -3.55 1.91 8.25 -0.93 -5.03 115.22 112.26 1qqc n HIS 633 Ca -0.13 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.13 1qqc n HIS 633 Cb 1.06 -0.01 0.07 0.00 1.12 0.00 0.00 29.99 32.24 1qqc n HIS 633 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qqc n GLY 634 N 1.32 -0.41 2.75 -1.41 0.00 -0.39 -4.95 105.19 102.09 1qqc n GLY 634 Ca 0.02 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1qqc n GLY 634 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qqc s ASP 635 N -4.01 3.96 0.07 1.61 -1.08 0.23 -4.98 116.67 112.47 1qqc s ASP 635 Ca 0.20 -2.06 -0.19 0.00 -0.52 0.00 0.00 52.55 49.98 1qqc s ASP 635 Cb -0.09 -1.00 -0.10 0.00 -1.46 0.00 0.00 42.92 40.27 1qqc s ASP 635 CO 0.75 -0.36 1.45 0.58 0.52 0.00 0.00 175.17 178.12 1qqc h VAL 636 N 6.03 1.29 0.00 1.11 2.07 -1.90 -2.95 116.25 121.90 1qqc h VAL 636 Ca -0.08 -1.09 -0.00 0.00 0.82 0.00 0.00 66.70 66.35 1qqc h VAL 636 Cb 0.98 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1qqc h VAL 636 CO 0.48 0.34 -0.01 -0.33 0.02 0.00 0.00 177.57 178.07 1qqc h GLU 637 N 0.17 0.00 0.02 1.57 5.08 -1.97 -1.47 114.58 117.99 1qqc h GLU 637 Ca 0.06 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.20 1qqc h GLU 637 Cb 0.54 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1qqc h GLU 637 CO 0.03 0.01 -0.98 1.49 -1.00 0.00 0.00 179.01 178.55 1qqc h GLU 638 N 0.00 0.09 0.03 2.33 4.57 -1.90 -2.54 114.58 117.15 1qqc h GLU 638 Ca -0.00 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1qqc h GLU 638 Cb 0.19 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1qqc h GLU 638 CO 0.00 0.99 -0.01 0.00 -1.18 0.00 0.00 179.01 178.81 1qqc h ALA 639 N 0.96 -0.04 -0.89 2.92 0.00 -1.18 -1.65 119.26 119.37 1qqc h ALA 639 Ca -0.04 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.82 1qqc h ALA 639 Cb 1.69 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.42 1qqc h ALA 639 CO 0.14 -0.36 0.58 0.28 0.00 0.00 0.00 179.25 179.88 1qqc h VAL 640 N -0.36 0.93 -0.24 0.00 2.07 -1.52 -1.51 116.25 115.63 1qqc h VAL 640 Ca -0.00 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 1qqc h VAL 640 Cb 0.33 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1qqc h VAL 640 CO 0.01 0.15 -0.11 -0.09 0.02 0.00 0.00 177.57 177.55 1qqc h ARG 641 N 0.84 0.49 -0.73 1.57 2.43 -1.26 -3.08 114.38 114.64 1qqc h ARG 641 Ca 0.43 -0.21 0.14 0.00 -0.81 0.00 0.00 59.98 59.52 1qqc h ARG 641 Cb 0.50 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.98 1qqc h ARG 641 CO -0.19 0.76 0.49 0.82 -1.51 0.00 0.00 179.97 180.34 1qqc h ILE 642 N 0.21 0.82 0.00 1.20 2.04 -0.30 -1.07 117.51 120.41 1qqc h ILE 642 Ca 0.05 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1qqc h ILE 642 Cb 0.61 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1qqc h ILE 642 CO 0.03 0.08 -0.08 0.58 0.00 0.00 0.00 178.15 178.77 1qqc h VAL 643 N 0.44 0.16 0.12 1.67 2.07 -1.38 -2.88 116.25 116.45 1qqc h VAL 643 Ca 0.35 -0.86 -0.32 0.00 0.82 0.00 0.00 66.70 66.69 1qqc h VAL 643 Cb 0.77 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1qqc h VAL 643 CO -0.11 0.07 -1.62 0.11 0.02 0.00 0.00 177.57 176.04 1qqc h LYS 644 N 0.00 0.25 0.37 1.57 1.57 -1.22 -3.05 116.57 116.06 1qqc h LYS 644 Ca -0.00 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 1qqc h LYS 644 Cb 0.74 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1qqc h LYS 644 CO 0.01 1.10 -0.30 1.49 -0.57 0.00 0.00 179.45 181.18 1qqc h GLU 645 N 0.07 -0.65 -0.84 3.15 4.81 -1.42 -1.41 114.58 118.28 1qqc h GLU 645 Ca -0.28 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.07 1qqc h GLU 645 Cb 2.03 0.15 -0.06 0.00 0.63 0.00 0.00 28.75 31.49 1qqc h GLU 645 CO 0.15 -0.43 0.51 0.28 -0.73 0.00 0.00 179.01 178.78 1qqc h VAL 646 N -0.68 1.00 0.00 0.32 2.07 -1.63 -0.93 116.25 116.41 1qqc h VAL 646 Ca -0.03 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1qqc h VAL 646 Cb 0.59 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1qqc h VAL 646 CO -0.01 0.17 0.00 0.71 0.02 0.00 0.00 177.57 178.45 1qqc h THR 647 N 0.91 0.00 0.05 2.57 1.35 -1.40 -1.92 112.91 114.48 1qqc h THR 647 Ca 0.38 -0.58 -0.10 0.00 -0.55 0.00 0.00 66.41 65.56 1qqc h THR 647 Cb 0.22 1.53 0.01 0.00 -1.73 0.00 0.00 68.15 68.18 1qqc h THR 647 CO -0.19 0.00 -0.42 -0.08 -0.25 0.00 0.00 175.52 174.58 1qqc h GLU 648 N 0.00 0.19 -0.54 4.72 4.57 -0.07 -1.80 114.58 121.66 1qqc h GLU 648 Ca 0.00 -0.27 -0.04 0.00 -1.18 0.00 0.00 59.36 57.86 1qqc h GLU 648 Cb 0.63 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 1qqc h GLU 648 CO 0.00 1.08 0.17 0.87 -1.18 0.00 0.00 179.01 179.95 1qqc h LYS 649 N -0.56 0.83 0.00 1.92 1.57 -1.27 -1.37 116.57 117.70 1qqc h LYS 649 Ca -0.07 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 1qqc h LYS 649 Cb 1.26 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1qqc h LYS 649 CO 0.08 0.76 0.00 1.25 -0.57 0.00 0.00 179.45 180.97 1qqc h LEU 650 N 0.74 0.00 0.00 2.94 5.85 -1.42 -0.17 115.31 123.25 1qqc h LEU 650 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1qqc h LEU 650 Cb 0.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1qqc h LEU 650 CO -0.01 0.00 -1.03 -0.24 -0.34 0.00 0.00 178.44 176.83 1qqc n SER 651 N -2.75 0.62 -1.67 1.25 2.88 -0.68 -3.87 113.62 109.41 1qqc n SER 651 Ca 0.01 -0.28 -0.16 0.00 -1.33 0.00 0.00 58.87 57.10 1qqc n SER 651 Cb 0.24 0.83 0.14 0.00 -0.75 0.00 0.00 64.21 64.66 1qqc n SER 651 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1qqc n ARG 652 N -1.90 2.42 -3.85 -1.46 1.74 -0.58 -4.95 116.66 108.08 1qqc n ARG 652 Ca 0.02 -3.42 -0.24 0.00 -0.77 0.00 0.00 57.85 53.44 1qqc n ARG 652 Cb 0.42 -2.04 -0.07 0.00 -1.02 0.00 0.00 32.46 29.75 1qqc n ARG 652 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1qqc n HIS 653 N -1.00 -0.93 -0.02 -1.55 8.25 -1.07 -4.80 115.22 114.10 1qqc n HIS 653 Ca 0.43 0.46 0.04 0.00 -0.26 0.00 0.00 57.72 58.40 1qqc n HIS 653 Cb 1.01 -2.00 -0.10 0.00 1.12 0.00 0.00 29.99 30.01 1qqc n HIS 653 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1qqc n GLU 654 N -3.61 0.76 -1.84 -0.41 1.02 -0.17 -5.01 120.64 111.38 1qqc n GLU 654 Ca -0.21 -0.10 -0.42 0.00 -0.02 0.00 0.00 57.16 56.42 1qqc n GLU 654 Cb 0.50 -1.32 -0.03 0.00 -0.02 0.00 0.00 31.44 30.57 1qqc n GLU 654 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1qqc s VAL 655 N -2.80 2.41 -0.30 2.62 1.01 -1.24 -4.88 120.40 117.21 1qqc s VAL 655 Ca -0.05 0.26 -0.33 0.00 0.00 0.00 0.00 61.98 61.85 1qqc s VAL 655 Cb 0.08 -3.17 -0.10 0.00 0.00 0.00 0.00 36.38 33.19 1qqc s VAL 655 CO 0.56 0.02 2.17 -2.65 0.00 0.00 0.00 175.10 175.20 1qqc n PRO 656 N 4.15 1.36 0.07 2.72 -0.02 -1.26 -4.78 135.00 137.25 1qqc n PRO 656 Ca 0.15 0.38 0.01 0.00 -2.02 0.00 0.00 63.50 62.03 1qqc n PRO 656 Cb 0.37 -2.66 0.07 0.00 -0.02 0.00 0.00 33.50 31.27 1qqc n PRO 656 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1qqc n PRO 657 N 8.19 0.02 -0.04 0.52 -0.02 -1.26 -1.50 135.00 140.91 1qqc n PRO 657 Ca 0.37 0.30 -0.15 0.00 -2.02 0.00 0.00 63.50 62.00 1qqc n PRO 657 Cb 0.29 -2.01 -0.07 0.00 -0.02 0.00 0.00 33.50 31.68 1qqc n PRO 657 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1qqc h GLU 658 N 0.00 0.60 0.00 -0.52 5.08 -2.02 -3.13 114.58 114.59 1qqc h GLU 658 Ca 0.00 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1qqc h GLU 658 Cb 0.88 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1qqc h GLU 658 CO 0.00 1.06 0.00 1.63 -1.00 0.00 0.00 179.01 180.70 1qqc n LYS 659 N -4.20 0.65 0.00 2.33 5.02 -0.56 -3.09 118.16 118.31 1qqc n LYS 659 Ca -0.07 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.32 1qqc n LYS 659 Cb 0.59 -1.36 -0.03 0.00 -0.02 0.00 0.00 35.03 34.20 1qqc n LYS 659 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1qqc n LEU 660 N -0.86 1.68 -4.77 -0.35 4.77 -1.18 -1.37 117.00 114.92 1qqc n LEU 660 Ca 0.11 -0.69 -0.39 0.00 -0.03 0.00 0.00 56.01 55.01 1qqc n LEU 660 Cb 0.05 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1qqc n LEU 660 CO 0.08 0.33 0.92 -0.69 -1.33 0.00 0.00 177.39 176.70 1qqc s VAL 661 N -2.48 2.75 0.06 4.08 1.01 -1.18 -4.72 120.40 119.92 1qqc s VAL 661 Ca 0.15 0.63 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1qqc s VAL 661 Cb 0.16 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1qqc s VAL 661 CO 0.61 0.06 -0.07 -0.51 0.00 0.00 0.00 175.10 175.19 1qqc s ILE 662 N -1.34 0.52 -0.14 2.22 2.07 -0.71 -4.19 121.20 119.62 1qqc s ILE 662 Ca 0.60 -1.41 0.02 0.00 -1.41 0.00 0.00 60.65 58.45 1qqc s ILE 662 Cb -0.35 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.25 1qqc s ILE 662 CO 0.44 -0.61 -0.19 -0.31 -1.91 0.00 0.00 174.94 172.36 1qqc s TYR 663 N -2.34 2.46 0.01 3.50 1.51 -1.26 -1.56 117.35 119.67 1qqc s TYR 663 Ca -0.02 -1.28 -0.00 0.00 -1.01 0.00 0.00 57.07 54.75 1qqc s TYR 663 Cb -0.03 -1.71 0.00 0.00 -0.11 0.00 0.00 41.96 40.10 1qqc s TYR 663 CO -0.02 -0.62 0.01 0.39 -1.11 0.00 0.00 175.55 174.19 1qqc n GLU 664 N 4.27 -3.18 -0.35 -0.62 1.02 0.85 -4.45 120.64 118.18 1qqc n GLU 664 Ca -0.20 2.32 0.00 0.00 -0.02 0.00 0.00 57.16 59.26 1qqc n GLU 664 Cb 0.51 -3.10 0.00 0.00 -0.02 0.00 0.00 31.44 28.83 1qqc n GLU 664 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qqc n GLY 677 N 1.92 0.00 0.26 0.62 0.00 -1.26 -4.81 105.19 101.92 1qqc n GLY 677 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1qqc n GLY 677 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qqc h PRO 678 N 0.12 0.89 -0.23 1.61 0.13 -1.77 -3.04 132.00 129.72 1qqc h PRO 678 Ca 0.00 -0.40 -0.04 0.00 -0.87 0.00 0.00 66.00 64.69 1qqc h PRO 678 Cb 0.00 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.10 1qqc h PRO 678 CO 0.00 1.05 0.01 0.45 -0.23 0.00 0.00 178.00 179.28 1qqc h HIS 679 N 0.72 0.43 -0.45 1.56 3.86 -1.93 -2.23 115.15 117.11 1qqc h HIS 679 Ca 0.09 -0.07 0.13 0.00 -1.16 0.00 0.00 60.37 59.36 1qqc h HIS 679 Cb 0.80 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 1qqc h HIS 679 CO 0.06 0.57 0.42 0.28 0.86 0.00 0.00 177.93 180.12 1qqc h VAL 680 N 0.17 0.46 0.15 2.45 2.07 -1.97 -1.67 116.25 117.91 1qqc h VAL 680 Ca 0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 1qqc h VAL 680 Cb 0.39 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1qqc h VAL 680 CO 0.01 0.00 -0.07 0.00 0.02 0.00 0.00 177.57 177.53 1qqc h ALA 681 N 1.57 -0.20 -0.58 1.67 0.00 -1.30 -3.28 119.26 117.13 1qqc h ALA 681 Ca 0.21 -0.16 0.17 0.00 0.00 0.00 0.00 54.91 55.13 1qqc h ALA 681 Cb 1.06 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1qqc h ALA 681 CO -0.00 -0.22 0.50 0.28 0.00 0.00 0.00 179.25 179.80 1qqc h VAL 682 N -0.99 0.50 0.00 0.00 2.07 -0.89 0.27 116.25 117.21 1qqc h VAL 682 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1qqc h VAL 682 Cb 0.39 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1qqc h VAL 682 CO 0.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.62 1qqc n ALA 683 N -2.51 2.14 -0.11 1.67 0.00 -0.73 -2.95 120.51 118.01 1qqc n ALA 683 Ca 0.11 -0.11 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1qqc n ALA 683 Cb 0.72 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 1qqc n ALA 683 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1qqc n LYS 684 N -1.12 0.56 0.00 0.00 5.02 0.96 -2.88 118.16 120.70 1qqc n LYS 684 Ca 0.12 0.23 0.07 0.00 -2.02 0.00 0.00 58.31 56.72 1qqc n LYS 684 Cb 0.10 -1.46 0.43 0.00 -0.02 0.00 0.00 35.03 34.08 1qqc n LYS 684 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1qqc n ARG 685 N -4.36 0.56 -0.09 1.97 1.74 -1.24 -1.79 116.66 113.45 1qqc n ARG 685 Ca -0.33 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.63 1qqc n ARG 685 Cb 0.69 -1.41 -0.08 0.00 -1.02 0.00 0.00 32.46 30.65 1qqc n ARG 685 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1qqc n LEU 686 N -0.91 2.92 0.00 0.55 7.94 -1.15 -4.16 117.00 122.19 1qqc n LEU 686 Ca 0.11 -0.08 0.07 0.00 -1.11 0.00 0.00 56.01 55.00 1qqc n LEU 686 Cb 0.05 -0.60 0.40 0.00 0.53 0.00 0.00 43.42 43.80 1qqc n LEU 686 CO 0.08 0.77 0.63 0.00 -1.11 0.00 0.00 177.39 177.77 1qqc n ALA 687 N -3.03 2.20 -0.09 1.96 0.00 -0.86 -2.11 120.51 118.58 1qqc n ALA 687 Ca -0.30 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 52.86 1qqc n ALA 687 Cb 0.82 -1.22 -0.12 0.00 0.00 0.00 0.00 19.45 18.93 1qqc n ALA 687 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qqc h ALA 688 N 2.92 0.19 0.00 0.00 0.00 -1.51 -3.28 119.26 117.58 1qqc h ALA 688 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.90 1qqc h ALA 688 Cb 0.00 0.55 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1qqc h ALA 688 CO 0.00 0.52 0.00 0.54 0.00 0.00 0.00 179.25 180.31 1qqc n ARG 689 N -4.48 0.35 -1.95 0.00 1.74 -0.98 -4.71 116.66 106.64 1qqc n ARG 689 Ca -0.26 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.76 1qqc n ARG 689 Cb 0.62 -1.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.05 1qqc n ARG 689 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qqc n GLY 690 N -0.14 0.25 3.35 -0.13 0.00 -1.23 -5.01 105.19 102.27 1qqc n GLY 690 Ca 0.00 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 1qqc n GLY 690 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qqc s ILE 691 N -2.29 4.11 0.49 -0.61 -1.09 -0.89 -5.01 121.20 115.90 1qqc s ILE 691 Ca 0.00 -0.79 -0.15 0.00 -2.23 0.00 0.00 60.65 57.49 1qqc s ILE 691 Cb 0.00 -3.20 -0.07 0.00 -1.58 0.00 0.00 42.46 37.61 1qqc s ILE 691 CO 0.00 -0.04 0.92 -0.54 -1.23 0.00 0.00 174.94 174.06 1qqc s LYS 692 N 1.50 3.89 -0.05 2.79 1.02 -1.26 -3.29 119.74 124.34 1qqc s LYS 692 Ca 0.02 0.80 0.00 0.00 0.02 0.00 0.00 55.97 56.82 1qqc s LYS 692 Cb -0.18 -2.21 0.02 0.00 -0.52 0.00 0.00 37.83 34.95 1qqc s LYS 692 CO 0.04 -0.21 -0.02 -1.50 -0.92 0.00 0.00 175.35 172.73 1qqc s ILE 693 N -2.57 0.40 0.00 2.17 2.07 -1.26 -5.04 121.20 116.96 1qqc s ILE 693 Ca 0.56 -0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.80 1qqc s ILE 693 Cb -0.10 -0.47 0.00 0.00 0.13 0.00 0.00 42.46 42.02 1qqc s ILE 693 CO 0.32 0.21 0.00 0.54 -1.91 0.00 0.00 174.94 174.10 1qqc n ARG 694 N 4.34 3.75 0.27 3.50 1.74 -1.26 -5.06 116.66 123.95 1qqc n ARG 694 Ca -0.21 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.02 1qqc n ARG 694 Cb 0.50 0.00 0.77 0.00 -1.02 0.00 0.00 32.46 32.72 1qqc n ARG 694 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1qqc h PRO 695 N 0.00 0.00 -1.72 5.56 0.13 -2.05 -3.34 132.00 130.59 1qqc h PRO 695 Ca 0.00 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.42 1qqc h PRO 695 Cb 0.00 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 30.82 1qqc h PRO 695 CO 0.00 0.08 0.55 0.41 -0.23 0.00 0.00 178.00 178.81 1qqc n GLY 696 N -0.52 5.72 3.68 1.56 0.00 -1.26 -5.04 105.19 109.33 1qqc n GLY 696 Ca -0.01 -2.54 -0.28 0.00 0.00 0.00 0.00 46.02 43.19 1qqc n GLY 696 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qqc s THR 697 N -5.13 1.95 -0.43 2.61 2.01 -1.25 -4.79 115.64 110.59 1qqc s THR 697 Ca 0.53 -1.91 -0.28 0.00 0.31 0.00 0.00 61.69 60.33 1qqc s THR 697 Cb 0.44 -2.85 0.01 0.00 0.01 0.00 0.00 72.50 70.10 1qqc s THR 697 CO -0.30 0.00 1.48 -0.69 -0.69 0.00 0.00 174.62 174.42 1qqc s VAL 698 N -2.71 3.81 -0.39 3.82 1.01 -1.26 -4.95 120.40 119.73 1qqc s VAL 698 Ca 0.32 0.80 0.02 0.00 0.00 0.00 0.00 61.98 63.12 1qqc s VAL 698 Cb 0.07 -4.16 0.12 0.00 0.00 0.00 0.00 36.38 32.40 1qqc s VAL 698 CO 0.17 -0.79 0.16 -0.51 0.00 0.00 0.00 175.10 174.13 1qqc s ILE 699 N 5.85 1.61 -0.28 2.22 2.07 -1.26 -5.02 121.20 126.38 1qqc s ILE 699 Ca 0.62 -2.28 -0.06 0.00 -1.41 0.00 0.00 60.65 57.52 1qqc s ILE 699 Cb -0.14 -2.16 0.01 0.00 0.13 0.00 0.00 42.46 40.29 1qqc s ILE 699 CO 0.31 -0.75 0.07 -0.94 -1.91 0.00 0.00 174.94 171.72 1qqc s SER 700 N 0.75 5.05 0.01 4.50 1.04 -1.25 -0.11 113.70 123.69 1qqc s SER 700 Ca 0.14 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1qqc s SER 700 Cb -0.21 -1.87 -0.00 0.00 0.10 0.00 0.00 66.02 64.04 1qqc s SER 700 CO -0.09 -0.16 0.01 0.00 0.98 0.00 0.00 173.24 173.97 1qqc n TYR 701 N 4.86 -0.02 -3.74 5.02 0.18 -0.60 -3.20 117.16 119.66 1qqc n TYR 701 Ca -0.15 -0.08 -0.12 0.00 1.88 0.00 0.00 57.90 59.42 1qqc n TYR 701 Cb 0.48 0.01 -0.11 0.00 -0.38 0.00 0.00 39.34 39.34 1qqc n TYR 701 CO 0.00 0.00 0.00 -1.50 -2.08 0.00 0.00 176.86 173.28 1qqc s ILE 702 N -1.93 -0.01 0.09 -3.48 2.07 -1.10 -1.74 121.20 115.10 1qqc s ILE 702 Ca 0.01 0.03 -0.26 0.00 -1.41 0.00 0.00 60.65 59.02 1qqc s ILE 702 Cb 0.00 -0.52 -0.06 0.00 0.13 0.00 0.00 42.46 42.01 1qqc s ILE 702 CO 0.01 0.01 0.81 -0.69 -1.91 0.00 0.00 174.94 173.17 1qqc s VAL 703 N 0.52 4.59 0.47 4.00 1.01 -1.26 -3.00 120.40 126.73 1qqc s VAL 703 Ca -0.03 1.75 0.05 0.00 0.00 0.00 0.00 61.98 63.75 1qqc s VAL 703 Cb -0.04 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 1qqc s VAL 703 CO -0.03 0.39 0.12 -0.76 0.00 0.00 0.00 175.10 174.82 1qqc s LEU 704 N -0.31 2.72 -0.14 3.92 1.43 0.33 -2.60 118.68 124.04 1qqc s LEU 704 Ca 0.40 -1.37 -0.21 0.00 -1.03 0.00 0.00 54.13 51.91 1qqc s LEU 704 Cb -0.22 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.94 1qqc s LEU 704 CO 0.25 -0.72 0.63 -0.75 0.23 0.00 0.00 176.35 176.00 1qqc s LYS 705 N -3.91 4.31 0.16 1.70 2.20 -1.26 -4.17 119.74 118.78 1qqc s LYS 705 Ca 0.26 0.69 -0.07 0.00 -0.36 0.00 0.00 55.97 56.50 1qqc s LYS 705 Cb 0.04 -3.51 -0.02 0.00 -1.51 0.00 0.00 37.83 32.83 1qqc s LYS 705 CO 0.15 -0.07 0.23 0.20 -0.36 0.00 0.00 175.35 175.49 1qqc s GLY 706 N 0.96 0.68 0.00 5.54 0.00 -1.26 -4.98 107.32 108.26 1qqc s GLY 706 Ca 0.31 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.95 1qqc s GLY 706 CO 0.13 -0.99 0.08 -1.55 0.00 0.00 0.00 173.10 170.76 1qqc n PRO 707 N -0.20 0.13 0.00 2.90 -0.04 -1.26 -4.75 135.00 131.78 1qqc n PRO 707 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1qqc n PRO 707 Cb 0.63 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.94 1qqc n PRO 707 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qqc n GLY 708 N 0.56 4.32 3.37 0.55 0.00 -1.26 -5.14 105.19 107.60 1qqc n GLY 708 Ca 0.00 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.76 1qqc n GLY 708 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qqc n ARG 709 N 0.00 0.26 0.15 1.61 5.12 -1.26 -4.82 116.66 117.72 1qqc n ARG 709 Ca 0.00 0.11 0.11 0.00 -1.93 0.00 0.00 57.85 56.14 1qqc n ARG 709 Cb 0.00 -1.50 0.56 0.00 -1.16 0.00 0.00 32.46 30.36 1qqc n ARG 709 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1qqc n VAL 710 N -1.95 1.00 -2.21 1.55 0.31 -1.26 -3.24 118.33 112.52 1qqc n VAL 710 Ca 0.09 0.61 -0.00 0.00 -0.01 0.00 0.00 64.34 65.03 1qqc n VAL 710 Cb 0.49 -1.60 0.08 0.00 -0.91 0.00 0.00 33.84 31.91 1qqc n VAL 710 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qqc n GLY 711 N -0.98 3.20 0.31 2.92 0.00 -1.26 -4.65 105.19 104.73 1qqc n GLY 711 Ca -0.01 -1.29 0.03 0.00 0.00 0.00 0.00 46.02 44.75 1qqc n GLY 711 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qqc n ASP 712 N -0.37 2.19 -3.97 1.61 9.92 -1.20 -4.39 116.55 120.34 1qqc n ASP 712 Ca 0.16 -1.77 -0.31 0.00 -0.53 0.00 0.00 54.79 52.34 1qqc n ASP 712 Cb 0.92 -0.09 -0.15 0.00 -0.64 0.00 0.00 41.12 41.17 1qqc n ASP 712 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1qqc s ARG 713 N -0.85 1.52 0.18 -1.24 3.52 -1.26 -4.32 118.95 116.50 1qqc s ARG 713 Ca 0.11 -1.99 0.04 0.00 -0.13 0.00 0.00 55.73 53.76 1qqc s ARG 713 Cb 0.06 -3.10 -0.05 0.00 -1.56 0.00 0.00 34.95 30.30 1qqc s ARG 713 CO 0.08 -0.99 -0.06 0.00 -0.81 0.00 0.00 175.30 173.52 1qqc s ALA 714 N 0.67 1.60 0.05 6.12 0.00 -1.26 -0.51 121.76 128.42 1qqc s ALA 714 Ca 0.12 -1.61 -0.11 0.00 0.00 0.00 0.00 51.96 50.37 1qqc s ALA 714 Cb -0.21 0.25 0.01 0.00 0.00 0.00 0.00 23.12 23.17 1qqc s ALA 714 CO -0.07 -0.17 0.23 0.96 0.00 0.00 0.00 175.76 176.71 1qqc s ILE 715 N -3.38 0.10 0.29 0.00 -4.36 -1.16 -4.15 121.20 108.55 1qqc s ILE 715 Ca 0.22 -0.84 -0.29 0.00 -0.26 0.00 0.00 60.65 59.48 1qqc s ILE 715 Cb 0.04 -0.96 -0.13 0.00 1.25 0.00 0.00 42.46 42.66 1qqc s ILE 715 CO 0.04 -0.46 1.17 -2.65 0.24 0.00 0.00 174.94 173.28 1qqc n PRO 716 N 0.58 1.70 0.26 0.37 -0.02 -1.26 -2.72 135.00 133.91 1qqc n PRO 716 Ca -0.18 0.60 0.18 0.00 -2.02 0.00 0.00 63.50 62.07 1qqc n PRO 716 Cb 0.59 -2.09 0.88 0.00 -0.02 0.00 0.00 33.50 32.87 1qqc n PRO 716 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1qqc h PHE 717 N 2.58 0.00 0.49 6.00 3.57 -1.83 -2.11 116.94 125.64 1qqc h PHE 717 Ca -0.43 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 1qqc h PHE 717 Cb 1.31 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 1qqc h PHE 717 CO 0.50 0.00 -0.42 -0.44 -2.23 0.00 0.00 178.31 175.72 1qqc h ASP 718 N 0.00 -1.13 -0.46 0.41 3.32 -1.88 -3.30 116.42 113.38 1qqc h ASP 718 Ca 0.05 0.08 -0.47 0.00 0.02 0.00 0.00 57.03 56.72 1qqc h ASP 718 Cb 0.57 0.36 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 1qqc h ASP 718 CO -0.00 -0.58 1.59 -0.62 -1.72 0.00 0.00 179.24 177.92 1qqc n GLU 719 N -4.98 1.99 -3.67 3.56 1.02 -0.79 -4.87 120.64 112.89 1qqc n GLU 719 Ca -0.11 -2.56 -0.14 0.00 -0.02 0.00 0.00 57.16 54.33 1qqc n GLU 719 Cb 0.40 -3.54 -0.14 0.00 -0.02 0.00 0.00 31.44 28.14 1qqc n GLU 719 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1qqc s PHE 720 N 8.34 -0.35 -0.10 -0.32 5.36 -1.25 -4.78 117.98 124.88 1qqc s PHE 720 Ca 0.63 0.86 0.02 0.00 -0.96 0.00 0.00 56.93 57.48 1qqc s PHE 720 Cb 0.03 -0.08 0.01 0.00 -0.34 0.00 0.00 43.02 42.65 1qqc s PHE 720 CO 0.11 -0.32 -0.16 0.34 -1.46 0.00 0.00 175.22 173.74 1qqc s ASP 721 N 2.22 2.40 0.00 6.13 2.15 -1.26 -5.01 116.67 123.30 1qqc s ASP 721 Ca 0.00 -0.42 0.00 0.00 0.43 0.00 0.00 52.55 52.56 1qqc s ASP 721 Cb -0.12 -1.09 0.00 0.00 -0.30 0.00 0.00 42.92 41.42 1qqc s ASP 721 CO -0.08 0.04 0.06 -0.81 -0.17 0.00 0.00 175.17 174.22 1qqc n PRO 722 N 4.03 0.12 0.00 4.34 -0.04 -1.26 -1.48 135.00 140.70 1qqc n PRO 722 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1qqc n PRO 722 Cb 0.52 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.92 1qqc n PRO 722 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qqc n ALA 723 N 0.36 0.00 -0.01 0.55 0.00 -1.26 -4.89 120.51 115.26 1qqc n ALA 723 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1qqc n ALA 723 Cb 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 1qqc n ALA 723 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1qqc n LYS 724 N 0.00 0.65 -4.32 0.00 4.81 -0.55 -5.01 118.16 113.74 1qqc n LYS 724 Ca 0.00 -0.04 -0.18 0.00 -0.87 0.00 0.00 58.31 57.21 1qqc n LYS 724 Cb 0.09 -1.14 -0.15 0.00 0.02 0.00 0.00 35.03 33.86 1qqc n LYS 724 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1qqc s HIS 725 N -2.36 0.75 0.45 5.64 3.76 -0.72 -4.97 115.29 117.83 1qqc s HIS 725 Ca -0.02 -0.15 0.06 0.00 -0.15 0.00 0.00 55.06 54.80 1qqc s HIS 725 Cb 0.03 -0.49 -0.03 0.00 1.11 0.00 0.00 32.58 33.20 1qqc s HIS 725 CO 0.24 -0.03 0.18 1.03 -0.85 0.00 0.00 174.74 175.31 1qqc s ARG 726 N -0.12 2.21 -0.08 1.40 1.81 -1.26 -4.59 118.95 118.31 1qqc s ARG 726 Ca 0.02 -1.97 0.02 0.00 -1.72 0.00 0.00 55.73 52.08 1qqc s ARG 726 Cb -0.04 -1.92 -0.02 0.00 -0.45 0.00 0.00 34.95 32.52 1qqc s ARG 726 CO -0.00 -0.23 -0.13 1.52 -0.68 0.00 0.00 175.30 175.78 1qqc s TYR 727 N -2.67 2.76 -0.85 -0.53 -0.85 -1.26 -4.09 117.35 109.86 1qqc s TYR 727 Ca 0.35 -0.33 -0.26 0.00 -0.52 0.00 0.00 57.07 56.30 1qqc s TYR 727 Cb 0.03 -1.72 -0.16 0.00 0.38 0.00 0.00 41.96 40.49 1qqc s TYR 727 CO 0.19 0.04 2.36 -3.47 -1.52 0.00 0.00 175.55 173.16 1qqc n ASP 728 N 2.79 1.71 -0.31 -0.18 -0.08 -1.07 -4.71 116.55 114.70 1qqc n ASP 728 Ca -0.18 -1.68 0.12 0.00 -1.51 0.00 0.00 54.79 51.54 1qqc n ASP 728 Cb 0.52 -1.68 0.35 0.00 2.34 0.00 0.00 41.12 42.65 1qqc n ASP 728 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1qqc h ALA 729 N 12.51 1.77 0.00 -1.67 0.00 -1.91 -1.93 119.26 128.02 1qqc h ALA 729 Ca 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1qqc h ALA 729 Cb 1.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1qqc h ALA 729 CO 1.00 -0.05 -0.33 1.49 0.00 0.00 0.00 179.25 181.37 1qqc h GLU 730 N 0.75 0.00 -0.45 0.00 4.81 -1.86 -2.63 114.58 115.20 1qqc h GLU 730 Ca 0.49 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.69 1qqc h GLU 730 Cb 0.76 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 1qqc h GLU 730 CO -0.26 0.33 0.16 -0.92 -0.73 0.00 0.00 179.01 177.59 1qqc h TYR 731 N 0.00 0.70 -0.35 0.92 3.20 -1.61 -1.42 116.97 118.41 1qqc h TYR 731 Ca -0.00 -0.06 -0.15 0.00 3.14 0.00 0.00 58.73 61.65 1qqc h TYR 731 Cb 1.00 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.06 1qqc h TYR 731 CO 0.00 0.62 -0.39 1.88 -1.64 0.00 0.00 178.16 178.63 1qqc h TYR 732 N 0.58 1.06 -0.45 -3.82 -1.99 -1.55 0.53 116.97 111.32 1qqc h TYR 732 Ca 0.15 -0.33 -0.10 0.00 2.00 0.00 0.00 58.73 60.44 1qqc h TYR 732 Cb 0.23 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 38.73 1qqc h TYR 732 CO 0.01 1.14 -0.14 0.82 -0.00 0.00 0.00 178.16 179.99 1qqc h ILE 733 N 0.67 1.26 0.00 -2.88 2.04 -1.39 0.19 117.51 117.41 1qqc h ILE 733 Ca 0.05 -1.24 -0.14 0.00 1.00 0.00 0.00 64.86 64.53 1qqc h ILE 733 Cb 0.98 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1qqc h ILE 733 CO 0.09 0.42 -1.31 1.21 0.00 0.00 0.00 178.15 178.57 1qqc n GLU 734 N -4.15 0.53 -0.19 2.37 4.07 -0.54 -2.79 120.64 119.95 1qqc n GLU 734 Ca 0.01 0.34 -0.09 0.00 -0.06 0.00 0.00 57.16 57.36 1qqc n GLU 734 Cb 0.39 -1.54 0.01 0.00 -0.06 0.00 0.00 31.44 30.25 1qqc n GLU 734 CO 0.00 0.00 0.00 -0.97 -0.06 0.00 0.00 177.13 176.10 1qqc h ASN 735 N -1.00 0.88 0.00 4.31 -1.24 -1.04 -3.40 115.58 114.08 1qqc h ASN 735 Ca -0.22 -0.27 0.00 0.00 0.71 0.00 0.00 56.30 56.52 1qqc h ASN 735 Cb 1.08 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.90 1qqc h ASN 735 CO -0.13 0.93 -0.79 1.67 -1.29 0.00 0.00 177.43 177.82 1qqc n GLN 736 N -4.34 0.44 0.04 6.67 7.27 -1.19 -4.66 117.38 121.61 1qqc n GLN 736 Ca 0.02 0.21 -0.12 0.00 0.07 0.00 0.00 57.00 57.17 1qqc n GLN 736 Cb 0.28 -1.31 -0.08 0.00 2.41 0.00 0.00 30.24 31.54 1qqc n GLN 736 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1qqc h VAL 737 N -0.84 1.08 0.16 1.69 2.07 -0.78 -3.27 116.25 116.36 1qqc h VAL 737 Ca 0.00 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1qqc h VAL 737 Cb 0.79 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1qqc h VAL 737 CO 0.00 0.09 -0.08 -0.07 0.02 0.00 0.00 177.57 177.53 1qqc h LEU 738 N -0.19 -0.18 0.00 2.57 3.38 -1.74 -2.57 115.31 116.59 1qqc h LEU 738 Ca -0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1qqc h LEU 738 Cb 0.17 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1qqc h LEU 738 CO 0.01 0.12 0.00 -0.81 0.09 0.00 0.00 178.44 177.84 1qqc n PRO 739 N -5.06 0.07 0.00 1.13 -0.04 -1.26 -0.80 135.00 129.04 1qqc n PRO 739 Ca -0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.47 1qqc n PRO 739 Cb 0.21 -1.23 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 1qqc n PRO 739 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qqc n ALA 740 N -0.73 3.88 -0.22 0.55 0.00 -0.97 -4.51 120.51 118.51 1qqc n ALA 740 Ca 0.01 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1qqc n ALA 740 Cb 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1qqc n ALA 740 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1qqc n VAL 741 N -0.60 0.00 -0.12 0.00 0.24 0.02 -4.69 118.33 113.18 1qqc n VAL 741 Ca 0.07 -0.03 -0.05 0.00 -2.04 0.00 0.00 64.34 62.28 1qqc n VAL 741 Cb 0.38 1.22 0.03 0.00 -1.47 0.00 0.00 33.84 34.01 1qqc n VAL 741 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1qqc h GLU 742 N 0.00 0.25 -0.70 7.34 5.08 -1.22 -2.73 114.58 122.59 1qqc h GLU 742 Ca 0.00 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1qqc h GLU 742 Cb 0.11 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1qqc h GLU 742 CO 0.00 0.16 0.26 -0.09 -1.00 0.00 0.00 179.01 178.34 1qqc h ARG 743 N 0.25 1.05 -0.06 2.33 9.65 -1.88 -0.58 114.38 125.15 1qqc h ARG 743 Ca 0.19 -0.19 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1qqc h ARG 743 Cb 0.21 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.62 1qqc h ARG 743 CO -0.23 0.87 0.02 0.82 2.80 0.00 0.00 179.97 184.25 1qqc h ILE 744 N 1.02 1.16 0.00 1.20 2.04 -1.88 -3.05 117.51 118.01 1qqc h ILE 744 Ca 0.23 -0.49 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 1qqc h ILE 744 Cb 0.23 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1qqc h ILE 744 CO -0.02 0.14 -0.20 -0.07 0.00 0.00 0.00 178.15 178.00 1qqc h LEU 745 N -0.10 0.00 -2.14 1.44 3.38 -1.42 -2.83 115.31 113.65 1qqc h LEU 745 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1qqc h LEU 745 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1qqc h LEU 745 CO -0.00 0.20 -0.03 -0.09 0.09 0.00 0.00 178.44 178.61 1qqc h ARG 746 N 0.00 0.00 0.00 1.13 1.12 -0.99 -0.53 114.38 115.11 1qqc h ARG 746 Ca -0.00 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.85 1qqc h ARG 746 Cb 0.89 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.84 1qqc h ARG 746 CO 0.03 0.03 -0.09 0.00 -3.11 0.00 0.00 179.97 176.83 1qqc h ALA 747 N 1.97 0.94 -0.65 2.80 0.00 -1.46 -3.18 119.26 119.68 1qqc h ALA 747 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1qqc h ALA 747 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1qqc h ALA 747 CO 0.00 0.11 0.00 1.19 0.00 0.00 0.00 179.25 180.56 1qqc n PHE 748 N -3.12 1.39 -0.14 0.00 3.01 -0.25 -4.72 117.46 113.62 1qqc n PHE 748 Ca 0.04 -0.60 0.00 0.00 1.01 0.00 0.00 57.45 57.90 1qqc n PHE 748 Cb 0.56 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 1qqc n PHE 748 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1qqc n GLY 749 N 1.17 0.57 3.97 1.37 0.00 -1.13 -5.09 105.19 106.05 1qqc n GLY 749 Ca 0.25 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 1qqc n GLY 749 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qqc s TYR 750 N -2.28 3.34 0.27 1.61 1.51 -0.94 -5.01 117.35 115.86 1qqc s TYR 750 Ca 0.00 -0.02 0.03 0.00 -1.01 0.00 0.00 57.07 56.07 1qqc s TYR 750 Cb 0.00 -1.78 -0.06 0.00 -0.11 0.00 0.00 41.96 40.01 1qqc s TYR 750 CO 0.00 0.22 0.03 1.03 -1.11 0.00 0.00 175.55 175.72 1qqc s ARG 751 N -4.11 1.48 0.22 -0.62 0.52 -1.26 -3.75 118.95 111.42 1qqc s ARG 751 Ca 0.39 -1.79 -0.07 0.00 -0.52 0.00 0.00 55.73 53.74 1qqc s ARG 751 Cb -0.09 -0.67 0.35 0.00 0.52 0.00 0.00 34.95 35.06 1qqc s ARG 751 CO 0.31 -0.16 1.24 0.36 0.02 0.00 0.00 175.30 177.07 1qqc n LYS 752 N -0.53 -0.08 0.22 3.54 2.85 -1.26 -0.96 118.16 121.93 1qqc n LYS 752 Ca -0.03 1.24 0.11 0.00 -1.05 0.00 0.00 58.31 58.58 1qqc n LYS 752 Cb 0.65 -1.85 0.68 0.00 -0.65 0.00 0.00 35.03 33.87 1qqc n LYS 752 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1qqc h GLU 753 N 0.00 0.00 -0.91 -1.58 5.08 -2.03 -2.38 114.58 112.75 1qqc h GLU 753 Ca 0.37 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.58 1qqc h GLU 753 Cb 0.57 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.73 1qqc h GLU 753 CO -0.82 0.00 0.19 -0.25 -1.00 0.00 0.00 179.01 177.14 1qqc n ASP 754 N -4.42 3.39 0.00 1.42 8.00 -0.14 -3.95 116.55 120.85 1qqc n ASP 754 Ca -0.01 -2.67 0.00 0.00 0.71 0.00 0.00 54.79 52.82 1qqc n ASP 754 Cb 0.18 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 1qqc n ASP 754 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1qqc n LEU 755 N -0.06 0.00 -0.33 0.64 4.77 -0.90 -4.94 117.00 116.18 1qqc n LEU 755 Ca 0.23 -0.12 0.15 0.00 -0.03 0.00 0.00 56.01 56.24 1qqc n LEU 755 Cb 0.94 0.00 0.66 0.00 -2.33 0.00 0.00 43.42 42.69 1qqc n LEU 755 CO 0.25 0.00 0.94 0.54 -1.33 0.00 0.00 177.39 177.79