#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cwc s LYS 2 N 0.00 0.41 -0.17 0.00 3.01 -1.26 -4.75 119.74 116.97 3cwc s LYS 2 Ca 0.00 1.12 0.01 0.00 -1.01 0.00 0.00 55.97 56.09 3cwc s LYS 2 Cb 0.00 0.42 0.03 0.00 -1.01 0.00 0.00 37.83 37.27 3cwc s LYS 2 CO 0.00 -0.22 -0.14 0.42 0.51 0.00 0.00 175.35 175.91 3cwc s ILE 3 N 2.51 1.71 -0.20 2.17 1.01 -0.11 -0.26 121.20 128.03 3cwc s ILE 3 Ca -0.04 -0.83 -0.09 0.00 0.00 0.00 0.00 60.65 59.69 3cwc s ILE 3 Cb -0.11 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 3cwc s ILE 3 CO -0.15 0.38 0.10 -0.69 0.00 0.00 0.00 174.94 174.59 3cwc s VAL 4 N 1.41 5.04 -0.34 2.92 1.01 -0.36 -1.99 120.40 128.09 3cwc s VAL 4 Ca 0.03 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 3cwc s VAL 4 Cb -0.14 -3.30 0.06 0.00 0.00 0.00 0.00 36.38 33.01 3cwc s VAL 4 CO -0.10 0.43 0.09 -0.63 0.00 0.00 0.00 175.10 174.88 3cwc s ILE 5 N 0.52 3.28 -0.47 2.22 1.01 0.48 -1.02 121.20 127.22 3cwc s ILE 5 Ca 0.05 -1.51 0.08 0.00 0.00 0.00 0.00 60.65 59.27 3cwc s ILE 5 Cb -0.12 -2.98 0.26 0.00 0.01 0.00 0.00 42.46 39.63 3cwc s ILE 5 CO 0.00 -0.29 0.62 0.00 0.00 0.00 0.00 174.94 175.27 3cwc n ALA 6 N 4.67 2.98 -2.61 9.38 0.00 0.65 -0.78 120.51 134.80 3cwc n ALA 6 Ca -0.10 -3.86 -0.24 0.00 0.00 0.00 0.00 53.44 49.24 3cwc n ALA 6 Cb 0.43 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 19.03 3cwc n ALA 6 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3cwc s PRO 7 N -1.76 3.41 0.81 0.00 0.04 -1.26 -4.39 135.00 131.86 3cwc s PRO 7 Ca 0.37 -0.38 -0.08 0.00 0.04 0.00 0.00 61.00 60.95 3cwc s PRO 7 Cb 0.18 -2.65 0.14 0.00 0.04 0.00 0.00 34.50 32.21 3cwc s PRO 7 CO -0.08 0.09 1.13 0.34 0.04 0.00 0.00 177.00 178.52 3cwc s ASP 8 N -4.07 3.98 0.85 6.66 -1.08 0.09 -1.12 116.67 121.99 3cwc s ASP 8 Ca 0.41 0.09 -0.13 0.00 -0.52 0.00 0.00 52.55 52.41 3cwc s ASP 8 Cb -0.10 -0.41 0.11 0.00 -1.46 0.00 0.00 42.92 41.06 3cwc s ASP 8 CO 0.36 -2.14 1.20 -0.94 0.52 0.00 0.00 175.17 174.17 3cwc s SER 9 N -4.74 4.09 -0.33 -0.34 1.04 -1.26 -4.42 113.70 107.73 3cwc s SER 9 Ca 0.68 0.72 -0.13 0.00 0.48 0.00 0.00 55.95 57.70 3cwc s SER 9 Cb -0.06 -1.14 -0.02 0.00 0.10 0.00 0.00 66.02 64.90 3cwc s SER 9 CO 0.48 -2.16 0.24 -0.31 0.98 0.00 0.00 173.24 172.46 3cwc s TYR 10 N -3.58 3.23 0.18 5.02 1.51 0.35 -0.58 117.35 123.47 3cwc s TYR 10 Ca 0.64 -0.16 -0.32 0.00 -1.01 0.00 0.00 57.07 56.22 3cwc s TYR 10 Cb -0.10 -2.47 -0.11 0.00 -0.11 0.00 0.00 41.96 39.16 3cwc s TYR 10 CO 0.50 -0.34 1.78 0.15 -1.11 0.00 0.00 175.55 176.53 3cwc s LYS 11 N 1.73 4.13 -0.47 -0.62 -0.14 -0.76 -0.84 119.74 122.77 3cwc s LYS 11 Ca 0.06 2.62 0.00 0.00 -1.36 0.00 0.00 55.97 57.29 3cwc s LYS 11 Cb -0.17 -3.29 0.00 0.00 -1.68 0.00 0.00 37.83 32.69 3cwc s LYS 11 CO 0.11 -0.80 0.00 0.39 -0.76 0.00 0.00 175.35 174.29 3cwc n GLU 12 N 4.69 -0.92 0.00 1.68 -0.58 -1.26 -4.66 120.64 119.59 3cwc n GLU 12 Ca 0.17 0.51 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 3cwc n GLU 12 Cb 0.36 -4.36 0.00 0.00 -0.57 0.00 0.00 31.44 26.87 3cwc n GLU 12 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3cwc n SER 13 N -0.21 0.29 -4.76 1.62 2.88 -0.02 -1.93 113.62 111.48 3cwc n SER 13 Ca -0.04 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.09 3cwc n SER 13 Cb 0.30 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.74 3cwc n SER 13 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3cwc s LEU 14 N 0.00 4.39 0.90 2.46 1.43 -1.18 -4.75 118.68 121.94 3cwc s LEU 14 Ca 0.00 2.76 -0.11 0.00 -1.03 0.00 0.00 54.13 55.75 3cwc s LEU 14 Cb 0.00 -3.64 0.14 0.00 0.03 0.00 0.00 46.19 42.71 3cwc s LEU 14 CO 0.00 -0.67 1.10 -0.94 0.23 0.00 0.00 176.35 176.08 3cwc s SER 15 N -0.12 3.24 0.24 2.29 1.04 -1.26 -0.50 113.70 118.63 3cwc s SER 15 Ca 0.53 1.81 -0.06 0.00 0.48 0.00 0.00 55.95 58.72 3cwc s SER 15 Cb -0.42 -2.41 0.42 0.00 0.10 0.00 0.00 66.02 63.71 3cwc s SER 15 CO 0.52 -2.83 1.70 0.00 0.98 0.00 0.00 173.24 173.60 3cwc h ALA 16 N -1.68 0.91 -0.71 5.32 0.00 -1.87 -0.32 119.26 120.91 3cwc h ALA 16 Ca -0.47 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 3cwc h ALA 16 Cb 1.27 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 3cwc h ALA 16 CO 0.49 -0.31 0.22 1.25 0.00 0.00 0.00 179.25 180.90 3cwc h LEU 17 N 0.29 1.03 -0.83 0.00 5.85 -1.91 -1.73 115.31 118.01 3cwc h LEU 17 Ca 0.39 -0.21 -0.10 0.00 0.84 0.00 0.00 57.88 58.80 3cwc h LEU 17 Cb 0.64 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3cwc h LEU 17 CO -0.47 0.96 -0.23 -0.33 -0.34 0.00 0.00 178.44 178.03 3cwc h GLU 18 N 1.04 0.62 -0.27 1.25 5.08 -1.56 0.82 114.58 121.56 3cwc h GLU 18 Ca 0.23 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3cwc h GLU 18 Cb 0.30 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3cwc h GLU 18 CO -0.01 0.80 0.17 0.28 -1.00 0.00 0.00 179.01 179.26 3cwc h VAL 19 N 0.54 1.08 -0.44 3.13 2.07 -0.97 -1.66 116.25 120.01 3cwc h VAL 19 Ca 0.08 -0.17 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 3cwc h VAL 19 Cb 0.69 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 3cwc h VAL 19 CO 0.05 0.08 -0.02 0.00 0.02 0.00 0.00 177.57 177.70 3cwc h ALA 20 N 1.08 1.15 -0.33 1.67 0.00 -0.87 -1.03 119.26 120.92 3cwc h ALA 20 Ca 0.10 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 3cwc h ALA 20 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3cwc h ALA 20 CO -0.02 0.55 -0.31 1.15 0.00 0.00 0.00 179.25 180.62 3cwc h THR 21 N 0.68 1.29 -0.66 0.00 2.02 -0.72 -1.26 112.91 114.26 3cwc h THR 21 Ca 0.13 -1.47 -0.06 0.00 0.77 0.00 0.00 66.41 65.78 3cwc h THR 21 Cb 0.45 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 3cwc h THR 21 CO 0.02 0.48 0.15 0.00 0.37 0.00 0.00 175.52 176.54 3cwc h ALA 22 N 0.74 1.03 -0.42 6.16 0.00 -0.97 -0.86 119.26 124.93 3cwc h ALA 22 Ca 0.06 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3cwc h ALA 22 Cb 0.88 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3cwc h ALA 22 CO 0.08 0.63 -0.02 0.82 0.00 0.00 0.00 179.25 180.76 3cwc h ILE 23 N 0.99 1.26 -0.25 0.00 2.04 -1.06 -2.47 117.51 118.02 3cwc h ILE 23 Ca 0.21 -1.07 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 3cwc h ILE 23 Cb 0.36 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 3cwc h ILE 23 CO 0.00 0.36 -0.03 -0.08 0.00 0.00 0.00 178.15 178.40 3cwc h GLU 24 N 0.59 0.46 -0.56 2.37 4.81 -0.97 -1.44 114.58 119.85 3cwc h GLU 24 Ca 0.12 -0.17 0.11 0.00 -0.13 0.00 0.00 59.36 59.29 3cwc h GLU 24 Cb 0.52 -0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.76 3cwc h GLU 24 CO 0.03 0.67 -0.20 1.96 -0.73 0.00 0.00 179.01 180.73 3cwc h GLN 25 N 0.22 -0.06 -0.22 1.92 4.20 -1.17 -0.32 115.11 119.68 3cwc h GLN 25 Ca 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 3cwc h GLN 25 Cb 0.48 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3cwc h GLN 25 CO 0.02 -0.04 0.11 0.78 -0.67 0.00 0.00 178.83 179.03 3cwc h GLY 26 N -0.07 0.33 0.64 3.46 0.00 -1.29 -2.89 103.07 103.25 3cwc h GLY 26 Ca 0.26 -0.16 0.09 0.00 0.00 0.00 0.00 47.33 47.53 3cwc h GLY 26 CO -0.60 0.15 0.62 0.74 0.00 0.00 0.00 176.54 177.45 3cwc h PHE 27 N 0.23 1.11 0.00 5.60 -1.00 -1.08 -2.43 116.94 119.36 3cwc h PHE 27 Ca 0.07 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.88 3cwc h PHE 27 Cb 0.10 -0.36 0.00 0.00 3.61 0.00 0.00 35.95 39.30 3cwc h PHE 27 CO -0.03 0.51 0.00 0.00 -1.61 0.00 0.00 178.31 177.18 3cwc h ARG 28 N 1.03 0.00 0.00 1.51 3.08 -0.85 0.29 114.38 119.44 3cwc h ARG 28 Ca 0.45 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.46 3cwc h ARG 28 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3cwc h ARG 28 CO -0.21 0.00 -0.17 0.93 -1.07 0.00 0.00 179.97 179.45 3cwc h GLU 29 N 0.00 0.00 0.00 0.04 5.08 -1.33 -2.73 114.58 115.63 3cwc h GLU 29 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 3cwc h GLU 29 Cb 0.38 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.57 3cwc h GLU 29 CO 0.00 0.17 -2.24 -0.89 -1.00 0.00 0.00 179.01 175.05 3cwc n ILE 30 N -3.64 1.23 -3.58 3.13 2.08 -0.71 -4.83 119.36 113.04 3cwc n ILE 30 Ca -0.01 -0.38 -0.27 0.00 0.56 0.00 0.00 62.75 62.64 3cwc n ILE 30 Cb 0.30 -1.55 -0.10 0.00 -0.75 0.00 0.00 39.64 37.55 3cwc n ILE 30 CO 0.00 0.00 0.00 0.79 0.56 0.00 0.00 176.55 177.90 3cwc n TRP 31 N -3.60 2.85 -0.20 1.39 8.01 0.93 -4.95 117.44 121.88 3cwc n TRP 31 Ca -0.41 -4.11 0.02 0.00 -1.31 0.00 0.00 57.50 51.69 3cwc n TRP 31 Cb 0.85 -0.51 0.28 0.00 -2.01 0.00 0.00 31.31 29.93 3cwc n TRP 31 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 3cwc h PRO 32 N 4.70 0.90 -0.44 -0.99 0.13 -1.70 -3.06 132.00 131.54 3cwc h PRO 32 Ca 0.17 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3cwc h PRO 32 Cb 0.73 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.66 3cwc h PRO 32 CO 0.73 0.60 0.00 -0.25 -0.23 0.00 0.00 178.00 178.85 3cwc n ASP 33 N -4.44 3.30 -4.67 1.44 8.00 -1.26 -4.94 116.55 113.97 3cwc n ASP 33 Ca 0.09 -1.97 -0.29 0.00 0.71 0.00 0.00 54.79 53.33 3cwc n ASP 33 Cb 0.09 -0.29 0.17 0.00 -0.02 0.00 0.00 41.12 41.07 3cwc n ASP 33 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3cwc s ALA 34 N -1.43 1.06 -0.39 2.24 0.00 -1.16 -4.97 121.76 117.11 3cwc s ALA 34 Ca 0.40 -0.10 -0.20 0.00 0.00 0.00 0.00 51.96 52.06 3cwc s ALA 34 Cb 0.22 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 20.16 3cwc s ALA 34 CO 0.31 -2.75 0.61 -0.51 0.00 0.00 0.00 175.76 173.42 3cwc s ASP 35 N -3.23 6.35 -0.11 0.00 1.01 -1.26 -5.03 116.67 114.40 3cwc s ASP 35 Ca 0.65 -0.15 -0.05 0.00 0.71 0.00 0.00 52.55 53.72 3cwc s ASP 35 Cb -0.20 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.39 3cwc s ASP 35 CO 0.58 -0.65 0.07 -0.31 0.21 0.00 0.00 175.17 175.07 3cwc s TYR 36 N 2.67 3.39 -0.12 4.23 2.02 -1.26 -0.94 117.35 127.34 3cwc s TYR 36 Ca 0.22 0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 57.27 3cwc s TYR 36 Cb -0.15 -1.87 0.03 0.00 -0.40 0.00 0.00 41.96 39.58 3cwc s TYR 36 CO 0.16 0.60 -0.03 -1.17 -1.57 0.00 0.00 175.55 173.55 3cwc s LEU 37 N -0.93 1.07 -0.18 -1.29 2.96 -0.84 -4.98 118.68 114.48 3cwc s LEU 37 Ca 0.14 -0.38 -0.16 0.00 -0.22 0.00 0.00 54.13 53.51 3cwc s LEU 37 Cb -0.12 -0.68 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 3cwc s LEU 37 CO 0.03 -0.19 0.41 -0.54 -1.32 0.00 0.00 176.35 174.75 3cwc s LYS 38 N 1.81 4.22 -0.50 1.98 1.02 -1.26 -0.39 119.74 126.62 3cwc s LYS 38 Ca 0.03 0.26 0.03 0.00 0.02 0.00 0.00 55.97 56.31 3cwc s LYS 38 Cb -0.14 -3.51 0.15 0.00 -0.52 0.00 0.00 37.83 33.81 3cwc s LYS 38 CO -0.07 0.02 0.31 -0.51 -0.92 0.00 0.00 175.35 174.18 3cwc s LEU 39 N 1.13 3.01 0.21 3.17 1.43 0.04 -4.96 118.68 122.71 3cwc s LEU 39 Ca 0.21 -2.99 -0.32 0.00 -1.03 0.00 0.00 54.13 50.00 3cwc s LEU 39 Cb -0.15 -1.09 -0.12 0.00 0.03 0.00 0.00 46.19 44.86 3cwc s LEU 39 CO 0.08 -0.21 1.70 -0.81 0.23 0.00 0.00 176.35 177.34 3cwc n PRO 40 N 3.06 2.71 -4.11 1.29 -0.04 -1.26 -4.00 135.00 132.64 3cwc n PRO 40 Ca 0.15 0.98 -0.25 0.00 -0.04 0.00 0.00 63.50 64.33 3cwc n PRO 40 Cb 0.37 -2.81 -0.07 0.00 -0.04 0.00 0.00 33.50 30.95 3cwc n PRO 40 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3cwc s LEU 41 N 0.96 3.07 0.15 1.53 1.43 -0.27 -4.75 118.68 120.79 3cwc s LEU 41 Ca 0.74 -1.10 -0.21 0.00 -1.03 0.00 0.00 54.13 52.53 3cwc s LEU 41 Cb -0.52 -1.42 0.06 0.00 0.03 0.00 0.00 46.19 44.34 3cwc s LEU 41 CO 0.35 -0.60 0.55 0.00 0.23 0.00 0.00 176.35 176.87 3cwc s ALA 42 N -2.62 -1.42 -1.20 4.21 0.00 -1.26 -4.46 121.76 115.00 3cwc s ALA 42 Ca 0.39 0.34 0.18 0.00 0.00 0.00 0.00 51.96 52.87 3cwc s ALA 42 Cb 0.03 0.84 0.60 0.00 0.00 0.00 0.00 23.12 24.59 3cwc s ALA 42 CO 0.22 -0.74 1.51 -0.40 0.00 0.00 0.00 175.76 176.35 3cwc n ASP 43 N -0.34 4.10 0.00 0.00 5.68 -1.26 -4.60 116.55 120.13 3cwc n ASP 43 Ca -0.17 -2.29 0.00 0.00 -0.50 0.00 0.00 54.79 51.83 3cwc n ASP 43 Cb 0.65 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 3cwc n ASP 43 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3cwc n GLY 44 N 0.97 0.78 0.00 6.12 0.00 -1.26 -3.50 105.19 108.30 3cwc n GLY 44 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3cwc n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cwc n GLY 45 N -2.00 -0.06 3.56 -0.02 0.00 -1.26 -4.50 105.19 100.91 3cwc n GLY 45 Ca 0.00 -1.71 -0.50 0.00 0.00 0.00 0.00 46.02 43.81 3cwc n GLY 45 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3cwc n GLU 46 N 0.00 0.97 -0.71 1.61 2.13 -1.26 -2.38 120.64 121.00 3cwc n GLU 46 Ca 0.00 0.34 0.00 0.00 0.66 0.00 0.00 57.16 58.16 3cwc n GLU 46 Cb 0.00 -1.80 0.00 0.00 0.27 0.00 0.00 31.44 29.91 3cwc n GLU 46 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cwc n GLY 47 N 1.96 0.69 0.19 8.31 0.00 -1.26 -4.89 105.19 110.19 3cwc n GLY 47 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 3cwc n GLY 47 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3cwc h THR 48 N 0.00 1.33 -0.27 2.61 2.02 -1.80 -2.47 112.91 114.33 3cwc h THR 48 Ca 0.00 -2.19 -0.04 0.00 0.77 0.00 0.00 66.41 64.95 3cwc h THR 48 Cb 0.00 2.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 3cwc h THR 48 CO 0.00 0.67 0.03 0.58 0.37 0.00 0.00 175.52 177.17 3cwc h VAL 49 N 0.37 1.24 -0.38 3.16 2.07 -1.90 -3.11 116.25 117.71 3cwc h VAL 49 Ca -0.07 -0.84 -0.07 0.00 0.82 0.00 0.00 66.70 66.53 3cwc h VAL 49 Cb 1.50 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 3cwc h VAL 49 CO 0.16 0.27 -0.07 -0.33 0.02 0.00 0.00 177.57 177.62 3cwc h GLU 50 N 0.26 0.65 -0.94 1.57 4.39 -1.97 -2.28 114.58 116.27 3cwc h GLU 50 Ca 0.08 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.59 3cwc h GLU 50 Cb 0.37 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 3cwc h GLU 50 CO 0.01 0.72 0.00 0.00 -1.16 0.00 0.00 179.01 178.58 3cwc n ALA 51 N -2.48 2.00 0.00 3.43 0.00 -0.93 -2.51 120.51 120.01 3cwc n ALA 51 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3cwc n ALA 51 Cb 0.32 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3cwc n ALA 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3cwc n VAL 53 N 0.41 0.00 0.31 0.00 0.31 -0.86 -0.93 118.33 117.57 3cwc n VAL 53 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.16 3cwc n VAL 53 Cb 0.22 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.06 3cwc n VAL 53 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3cwc h GLU 54 N 0.00 -0.72 -0.26 5.55 5.08 -1.77 0.51 114.58 122.98 3cwc h GLU 54 Ca 0.00 0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 3cwc h GLU 54 Cb 0.00 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3cwc h GLU 54 CO 0.00 -0.47 0.32 0.00 -1.00 0.00 0.00 179.01 177.86 3cwc h ALA 55 N -0.31 1.89 -0.13 3.43 0.00 -1.30 -2.12 119.26 120.71 3cwc h ALA 55 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3cwc h ALA 55 Cb 0.58 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3cwc h ALA 55 CO 0.13 -0.45 0.00 0.25 0.00 0.00 0.00 179.25 179.17 3cwc n THR 56 N -3.67 0.83 -2.54 0.00 -2.24 -0.88 -4.99 114.28 100.78 3cwc n THR 56 Ca 0.04 -0.91 -0.21 0.00 -2.27 0.00 0.00 64.05 60.70 3cwc n THR 56 Cb 0.46 0.61 -0.00 0.00 -2.10 0.00 0.00 70.33 69.29 3cwc n THR 56 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3cwc n ALA 57 N 0.03 -0.71 -1.71 6.98 0.00 0.15 -1.76 120.51 123.50 3cwc n ALA 57 Ca 0.05 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3cwc n ALA 57 Cb 0.30 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.26 3cwc n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cwc n GLY 58 N -1.10 1.61 3.33 0.00 0.00 0.32 -4.16 105.19 105.19 3cwc n GLY 58 Ca -0.21 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 43.96 3cwc n GLY 58 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3cwc s ARG 59 N 3.05 1.03 -0.11 1.61 1.70 -0.55 -4.82 118.95 120.86 3cwc s ARG 59 Ca 0.00 -0.54 -0.21 0.00 -0.47 0.00 0.00 55.73 54.51 3cwc s ARG 59 Cb 0.00 0.46 -0.04 0.00 -0.57 0.00 0.00 34.95 34.80 3cwc s ARG 59 CO 0.00 -0.39 0.61 0.42 -1.08 0.00 0.00 175.30 174.86 3cwc s ILE 60 N -3.23 5.09 -0.22 4.99 -1.09 -1.26 -1.03 121.20 124.44 3cwc s ILE 60 Ca -0.01 1.23 -0.05 0.00 -2.23 0.00 0.00 60.65 59.60 3cwc s ILE 60 Cb 0.01 -3.95 -0.01 0.00 -1.58 0.00 0.00 42.46 36.92 3cwc s ILE 60 CO -0.08 0.25 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.18 3cwc s VAL 61 N 0.93 3.65 -0.03 2.92 1.01 0.85 -4.97 120.40 124.76 3cwc s VAL 61 Ca 0.32 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 3cwc s VAL 61 Cb -0.16 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 3cwc s VAL 61 CO 0.14 0.40 0.54 -1.00 0.00 0.00 0.00 175.10 175.18 3cwc s HIS 62 N 1.44 3.65 0.03 5.22 3.76 -1.26 -1.27 115.29 126.86 3cwc s HIS 62 Ca 0.05 1.10 -0.13 0.00 -0.15 0.00 0.00 55.06 55.93 3cwc s HIS 62 Cb -0.14 -2.54 0.02 0.00 1.11 0.00 0.00 32.58 31.02 3cwc s HIS 62 CO -0.01 0.36 0.27 0.54 -0.85 0.00 0.00 174.74 175.06 3cwc s VAL 63 N -0.16 0.08 -0.01 -0.90 0.11 -0.90 -4.99 120.40 113.63 3cwc s VAL 63 Ca 0.29 -0.68 -0.18 0.00 -2.93 0.00 0.00 61.98 58.48 3cwc s VAL 63 Cb -0.17 -0.83 -0.05 0.00 -1.53 0.00 0.00 36.38 33.79 3cwc s VAL 63 CO 0.15 -0.37 0.51 -1.61 -3.33 0.00 0.00 175.10 170.45 3cwc s GLU 64 N -2.20 4.19 0.20 1.54 2.02 -1.26 -1.32 118.70 121.86 3cwc s GLU 64 Ca -0.08 0.58 -0.02 0.00 0.02 0.00 0.00 54.97 55.48 3cwc s GLU 64 Cb -0.02 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 3cwc s GLU 64 CO -0.01 0.47 0.15 0.14 0.02 0.00 0.00 175.26 176.03 3cwc s VAL 65 N -0.47 0.00 -0.20 2.63 -7.23 -0.64 -4.96 120.40 109.54 3cwc s VAL 65 Ca 0.27 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 58.18 3cwc s VAL 65 Cb -0.17 -2.48 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 3cwc s VAL 65 CO 0.15 -0.01 1.21 -0.89 -0.31 0.00 0.00 175.10 175.25 3cwc s THR 66 N -4.15 4.36 1.15 5.32 2.01 -1.26 -1.01 115.64 122.05 3cwc s THR 66 Ca 0.38 1.63 -0.17 0.00 0.31 0.00 0.00 61.69 63.84 3cwc s THR 66 Cb 0.07 -4.11 0.26 0.00 0.01 0.00 0.00 72.50 68.73 3cwc s THR 66 CO 0.12 -0.20 1.11 -0.83 -0.69 0.00 0.00 174.62 174.12 3cwc s GLY 67 N 1.90 1.58 0.53 4.40 0.00 0.18 -2.34 107.32 113.57 3cwc s GLY 67 Ca 0.52 -0.80 0.26 0.00 0.00 0.00 0.00 44.72 44.70 3cwc s GLY 67 CO 0.14 0.01 2.12 -0.56 0.00 0.00 0.00 173.10 174.81 3cwc h PRO 68 N -2.39 0.00 -0.54 2.90 0.14 -1.71 -2.31 132.00 128.09 3cwc h PRO 68 Ca -0.48 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.66 3cwc h PRO 68 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.44 3cwc h PRO 68 CO 0.41 0.09 0.00 1.28 0.14 0.00 0.00 178.00 179.92 3cwc n LEU 69 N -3.82 4.87 0.00 1.56 4.77 -1.26 -0.02 117.00 123.10 3cwc n LEU 69 Ca -0.02 -2.69 0.00 0.00 -0.03 0.00 0.00 56.01 53.26 3cwc n LEU 69 Cb 0.19 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 3cwc n LEU 69 CO 0.30 0.72 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 3cwc n GLY 70 N 0.63 0.96 3.93 -0.72 0.00 -0.87 -5.02 105.19 104.10 3cwc n GLY 70 Ca 0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.01 3cwc n GLY 70 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3cwc s HIS 71 N -2.33 3.06 0.08 1.61 3.76 -1.26 -4.56 115.29 115.64 3cwc s HIS 71 Ca 0.00 0.48 -0.30 0.00 -0.15 0.00 0.00 55.06 55.09 3cwc s HIS 71 Cb 0.00 -2.95 -0.05 0.00 1.11 0.00 0.00 32.58 30.69 3cwc s HIS 71 CO 0.00 -1.10 1.06 1.03 -0.85 0.00 0.00 174.74 174.88 3cwc s ARG 72 N -5.08 4.56 0.07 1.40 1.81 -1.26 0.51 118.95 120.95 3cwc s ARG 72 Ca 0.57 1.58 0.04 0.00 -1.72 0.00 0.00 55.73 56.21 3cwc s ARG 72 Cb -0.11 -3.38 -0.03 0.00 -0.45 0.00 0.00 34.95 30.99 3cwc s ARG 72 CO 0.44 -0.03 -0.12 0.14 -0.68 0.00 0.00 175.30 175.05 3cwc s VAL 73 N 0.56 0.98 -0.60 3.52 -7.23 -0.18 -4.82 120.40 112.63 3cwc s VAL 73 Ca 0.52 -1.31 -0.22 0.00 -1.81 0.00 0.00 61.98 59.16 3cwc s VAL 73 Cb -0.25 -1.02 0.07 0.00 0.56 0.00 0.00 36.38 35.73 3cwc s VAL 73 CO 0.30 -0.30 0.86 0.21 -0.31 0.00 0.00 175.10 175.86 3cwc s ASN 74 N -1.81 6.22 0.50 4.85 2.47 -1.26 -1.61 114.94 124.29 3cwc s ASN 74 Ca -0.02 -0.91 0.01 0.00 0.42 0.00 0.00 52.86 52.36 3cwc s ASN 74 Cb -0.09 -2.38 0.07 0.00 -1.45 0.00 0.00 41.25 37.40 3cwc s ASN 74 CO 0.02 -1.25 0.49 0.00 -3.72 0.00 0.00 177.10 172.64 3cwc n ALA 75 N 7.16 0.23 -3.33 1.71 0.00 -0.43 -4.94 120.51 120.92 3cwc n ALA 75 Ca -0.04 -1.03 -0.09 0.00 0.00 0.00 0.00 53.44 52.28 3cwc n ALA 75 Cb 0.45 0.20 -0.04 0.00 0.00 0.00 0.00 19.45 20.06 3cwc n ALA 75 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3cwc s PHE 76 N -1.32 0.13 0.31 0.00 -0.12 -1.26 -2.11 117.98 113.61 3cwc s PHE 76 Ca 0.34 -0.51 -0.13 0.00 -0.05 0.00 0.00 56.93 56.58 3cwc s PHE 76 Cb -0.02 0.34 0.02 0.00 -0.63 0.00 0.00 43.02 42.72 3cwc s PHE 76 CO 0.22 -1.01 0.60 1.52 -0.05 0.00 0.00 175.22 176.50 3cwc s TYR 77 N -3.96 0.37 -0.01 3.49 1.13 -0.40 -4.76 117.35 113.21 3cwc s TYR 77 Ca 0.17 -0.80 0.07 0.00 -1.41 0.00 0.00 57.07 55.10 3cwc s TYR 77 Cb -0.02 0.39 -0.02 0.00 -1.10 0.00 0.00 41.96 41.21 3cwc s TYR 77 CO 0.05 -1.22 -0.23 0.20 -2.51 0.00 0.00 175.55 171.84 3cwc s GLY 78 N -3.07 1.15 0.10 5.49 0.00 -0.58 -0.11 107.32 110.31 3cwc s GLY 78 Ca 0.21 -1.02 0.06 0.00 0.00 0.00 0.00 44.72 43.97 3cwc s GLY 78 CO 0.12 -0.86 -0.08 1.08 0.00 0.00 0.00 173.10 173.36 3cwc s LEU 79 N -0.62 3.12 0.89 0.66 1.43 -0.20 -0.36 118.68 123.60 3cwc s LEU 79 Ca 0.09 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 52.73 3cwc s LEU 79 Cb -0.09 -1.89 0.13 0.00 0.03 0.00 0.00 46.19 44.36 3cwc s LEU 79 CO -0.01 0.18 1.13 -0.94 0.23 0.00 0.00 176.35 176.95 3cwc s SER 80 N -2.18 3.67 0.26 2.29 1.04 0.04 -1.49 113.70 117.33 3cwc s SER 80 Ca 0.22 1.02 -0.05 0.00 0.48 0.00 0.00 55.95 57.62 3cwc s SER 80 Cb -0.11 -1.62 0.30 0.00 0.10 0.00 0.00 66.02 64.69 3cwc s SER 80 CO 0.14 -2.45 1.87 1.23 0.98 0.00 0.00 173.24 175.01 3cwc h GLY 81 N -1.43 1.21 1.26 7.32 0.00 -1.50 -1.90 103.07 108.03 3cwc h GLY 81 Ca -0.50 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.27 3cwc h GLY 81 CO 0.62 0.54 -0.00 2.09 0.00 0.00 0.00 176.54 179.78 3cwc n ASP 82 N -4.33 0.03 -2.26 0.19 5.75 -1.26 -4.90 116.55 109.76 3cwc n ASP 82 Ca 0.08 -0.57 -0.18 0.00 -0.01 0.00 0.00 54.79 54.11 3cwc n ASP 82 Cb 0.11 -0.14 -0.02 0.00 -1.03 0.00 0.00 41.12 40.04 3cwc n ASP 82 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3cwc n ALA 83 N -1.13 -0.60 0.61 2.12 0.00 -0.72 -4.88 120.51 115.92 3cwc n ALA 83 Ca 0.19 0.17 0.07 0.00 0.00 0.00 0.00 53.44 53.87 3cwc n ALA 83 Cb 0.18 -1.97 -0.09 0.00 0.00 0.00 0.00 19.45 17.57 3cwc n ALA 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3cwc n ARG 84 N -2.83 1.84 -4.50 0.00 1.74 -1.26 -4.22 116.66 107.42 3cwc n ARG 84 Ca -0.21 -0.02 -0.21 0.00 -0.77 0.00 0.00 57.85 56.64 3cwc n ARG 84 Cb 0.66 -1.23 -0.14 0.00 -1.02 0.00 0.00 32.46 30.72 3cwc n ARG 84 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3cwc s SER 85 N -2.60 1.51 -0.01 0.55 0.01 -1.26 -0.28 113.70 111.63 3cwc s SER 85 Ca 0.04 -0.29 0.03 0.00 1.31 0.00 0.00 55.95 57.05 3cwc s SER 85 Cb 0.11 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 66.16 3cwc s SER 85 CO 0.62 0.12 -0.09 0.00 0.41 0.00 0.00 173.24 174.29 3cwc s ALA 86 N -0.45 2.90 -0.19 1.44 0.00 0.45 -0.78 121.76 125.13 3cwc s ALA 86 Ca 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.98 3cwc s ALA 86 Cb -0.06 -1.07 0.01 0.00 0.00 0.00 0.00 23.12 22.01 3cwc s ALA 86 CO -0.00 0.59 -0.17 -0.06 0.00 0.00 0.00 175.76 176.13 3cwc s PHE 87 N -0.92 2.82 -0.09 0.00 0.08 0.52 -0.28 117.98 120.11 3cwc s PHE 87 Ca 0.15 -1.50 0.04 0.00 0.12 0.00 0.00 56.93 55.74 3cwc s PHE 87 Cb -0.11 -1.96 0.00 0.00 -0.57 0.00 0.00 43.02 40.39 3cwc s PHE 87 CO 0.05 -0.75 -0.20 0.42 -0.10 0.00 0.00 175.22 174.64 3cwc s ILE 88 N 1.32 1.75 0.04 0.64 1.01 0.10 -1.52 121.20 124.55 3cwc s ILE 88 Ca 0.05 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3cwc s ILE 88 Cb -0.13 -1.53 0.01 0.00 0.01 0.00 0.00 42.46 40.81 3cwc s ILE 88 CO -0.11 0.49 0.05 -0.62 0.00 0.00 0.00 174.94 174.75 3cwc n GLU 89 N 3.57 1.14 0.00 2.79 1.02 -1.26 -0.44 120.64 127.46 3cwc n GLU 89 Ca -0.20 -0.24 0.00 0.00 -0.02 0.00 0.00 57.16 56.69 3cwc n GLU 89 Cb 0.53 -0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.94 3cwc n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cwc n ALA 91 N -2.94 0.00 -0.27 0.62 0.00 -1.26 -4.21 120.51 112.46 3cwc n ALA 91 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.48 3cwc n ALA 91 Cb 0.05 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.69 3cwc n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cwc h ALA 92 N 0.00 1.12 0.02 0.00 0.00 -1.93 -1.69 119.26 116.79 3cwc h ALA 92 Ca 0.00 0.10 -0.30 0.00 0.00 0.00 0.00 54.91 54.71 3cwc h ALA 92 Cb 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3cwc h ALA 92 CO 0.00 -0.16 -1.64 0.00 0.00 0.00 0.00 179.25 177.45 3cwc n ALA 93 N -2.47 0.89 -1.69 0.00 0.00 -1.26 -4.55 120.51 111.42 3cwc n ALA 93 Ca 0.15 -0.62 0.06 0.00 0.00 0.00 0.00 53.44 53.03 3cwc n ALA 93 Cb 0.41 -0.46 0.13 0.00 0.00 0.00 0.00 19.45 19.52 3cwc n ALA 93 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3cwc n SER 94 N -4.18 1.54 -4.91 0.00 7.64 -1.23 -3.47 113.62 109.01 3cwc n SER 94 Ca -0.36 -3.12 -0.27 0.00 1.01 0.00 0.00 58.87 56.13 3cwc n SER 94 Cb 0.79 -0.42 -0.00 0.00 -1.01 0.00 0.00 64.21 63.57 3cwc n SER 94 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3cwc s GLY 95 N -2.66 1.48 0.57 0.23 0.00 -0.64 -1.56 107.32 104.74 3cwc s GLY 95 Ca 0.32 -0.54 0.27 0.00 0.00 0.00 0.00 44.72 44.76 3cwc s GLY 95 CO -0.06 -0.39 2.05 -2.00 0.00 0.00 0.00 173.10 172.71 3cwc h LEU 96 N 0.28 0.00 -1.58 0.66 5.85 -1.26 -1.90 115.31 117.35 3cwc h LEU 96 Ca -0.47 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 3cwc h LEU 96 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 3cwc h LEU 96 CO 0.62 0.00 -0.04 1.05 -0.34 0.00 0.00 178.44 179.72 3cwc h GLU 97 N 0.00 0.00 -0.00 1.25 -0.00 -1.88 -2.81 114.58 111.14 3cwc h GLU 97 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.50 3cwc h GLU 97 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.41 3cwc h GLU 97 CO -0.00 0.04 -0.17 1.04 -0.00 0.00 0.00 179.01 179.92 3cwc n GLN 98 N -3.18 0.26 -3.91 1.06 1.13 -0.72 -4.71 117.38 107.32 3cwc n GLN 98 Ca 0.00 -0.09 -0.35 0.00 -1.94 0.00 0.00 57.00 54.63 3cwc n GLN 98 Cb 0.30 -1.50 -0.14 0.00 0.11 0.00 0.00 30.24 29.01 3cwc n GLN 98 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3cwc s VAL 99 N -2.80 2.93 0.48 5.09 1.01 -1.06 -4.87 120.40 121.18 3cwc s VAL 99 Ca 0.19 -1.54 -0.22 0.00 0.00 0.00 0.00 61.98 60.41 3cwc s VAL 99 Cb 0.19 -2.75 -0.09 0.00 0.00 0.00 0.00 36.38 33.72 3cwc s VAL 99 CO 0.55 -0.20 0.84 -2.65 0.00 0.00 0.00 175.10 173.64 3cwc n PRO 100 N 4.58 0.98 -0.31 2.72 -0.02 -1.26 -4.82 135.00 136.87 3cwc n PRO 100 Ca -0.11 0.36 0.09 0.00 -2.02 0.00 0.00 63.50 61.82 3cwc n PRO 100 Cb 0.43 -1.92 0.25 0.00 -0.02 0.00 0.00 33.50 32.24 3cwc n PRO 100 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3cwc h PRO 101 N 0.98 0.62 -0.48 0.52 0.11 -1.98 -1.89 132.00 129.87 3cwc h PRO 101 Ca -0.45 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.65 3cwc h PRO 101 Cb 1.36 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 3cwc h PRO 101 CO 0.53 0.41 0.32 0.00 -0.21 0.00 0.00 178.00 179.05 3cwc h ALA 102 N 1.59 1.72 -0.59 -0.75 0.00 -2.03 -3.05 119.26 116.14 3cwc h ALA 102 Ca 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.38 3cwc h ALA 102 Cb 0.74 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3cwc h ALA 102 CO -0.38 0.23 0.00 1.04 0.00 0.00 0.00 179.25 180.14 3cwc n GLN 103 N -4.47 2.90 -2.10 0.00 3.00 -0.72 -4.92 117.38 111.08 3cwc n GLN 103 Ca 0.05 -2.35 -0.42 0.00 -0.01 0.00 0.00 57.00 54.27 3cwc n GLN 103 Cb 0.10 -1.65 -0.03 0.00 0.00 0.00 0.00 30.24 28.67 3cwc n GLN 103 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 3cwc s ARG 104 N -1.48 3.26 -0.29 -1.09 0.52 -1.16 -4.92 118.95 113.80 3cwc s ARG 104 Ca 0.43 1.15 -0.02 0.00 -0.52 0.00 0.00 55.73 56.77 3cwc s ARG 104 Cb 0.25 -4.19 0.09 0.00 0.52 0.00 0.00 34.95 31.62 3cwc s ARG 104 CO 0.25 -1.95 0.09 0.34 0.02 0.00 0.00 175.30 174.05 3cwc s ASP 105 N 5.90 3.77 0.00 0.23 -1.08 -1.26 -4.68 116.67 119.56 3cwc s ASP 105 Ca 0.73 -1.45 0.11 0.00 -0.52 0.00 0.00 52.55 51.42 3cwc s ASP 105 Cb -0.18 -0.73 0.49 0.00 -1.46 0.00 0.00 42.92 41.04 3cwc s ASP 105 CO 0.31 -0.40 1.31 -2.65 0.52 0.00 0.00 175.17 174.25 3cwc n PRO 106 N 4.95 0.06 0.10 4.34 -0.02 -1.25 -1.68 135.00 141.49 3cwc n PRO 106 Ca -0.04 0.27 -0.04 0.00 -2.02 0.00 0.00 63.50 61.66 3cwc n PRO 106 Cb 0.43 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.43 3cwc n PRO 106 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3cwc h LEU 107 N 0.00 0.00 0.00 2.45 3.38 -1.94 -3.35 115.31 115.85 3cwc h LEU 107 Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 3cwc h LEU 107 Cb 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3cwc h LEU 107 CO 0.00 0.81 -1.98 0.29 0.09 0.00 0.00 178.44 177.66 3cwc n LYS 108 N -3.56 1.05 -2.06 1.13 4.76 -0.68 -2.13 118.16 116.67 3cwc n LYS 108 Ca -0.01 -0.07 -0.41 0.00 -2.87 0.00 0.00 58.31 54.96 3cwc n LYS 108 Cb 0.78 -1.41 -0.02 0.00 -1.84 0.00 0.00 35.03 32.54 3cwc n LYS 108 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3cwc s THR 109 N -2.70 2.80 0.06 -0.18 -4.23 -0.79 -3.30 115.64 107.30 3cwc s THR 109 Ca -0.07 0.67 0.06 0.00 -1.18 0.00 0.00 61.69 61.16 3cwc s THR 109 Cb 0.07 -3.43 -0.04 0.00 1.34 0.00 0.00 72.50 70.45 3cwc s THR 109 CO 0.68 0.10 -0.09 -0.89 -0.54 0.00 0.00 174.62 173.88 3cwc s THR 110 N 0.06 3.45 -2.04 3.99 2.01 0.97 -3.84 115.64 120.24 3cwc s THR 110 Ca 0.59 -1.07 0.17 0.00 0.31 0.00 0.00 61.69 61.69 3cwc s THR 110 Cb -0.40 -2.56 0.46 0.00 0.01 0.00 0.00 72.50 70.00 3cwc s THR 110 CO 0.42 0.23 1.39 -1.54 -0.69 0.00 0.00 174.62 174.43 3cwc n SER 111 N 1.08 2.75 -0.23 3.53 3.41 -1.26 -4.12 113.62 118.78 3cwc n SER 111 Ca -0.14 -1.98 -0.03 0.00 -0.26 0.00 0.00 58.87 56.46 3cwc n SER 111 Cb 0.52 -0.33 0.04 0.00 -0.26 0.00 0.00 64.21 64.18 3cwc n SER 111 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 3cwc h TRP 112 N 3.06 -0.72 -1.05 7.33 2.91 -1.85 -1.33 115.95 124.30 3cwc h TRP 112 Ca 0.00 0.07 0.33 0.00 1.13 0.00 0.00 58.89 60.42 3cwc h TRP 112 Cb 0.70 0.42 -0.14 0.00 -0.51 0.00 0.00 29.16 29.63 3cwc h TRP 112 CO 0.33 -0.36 0.62 0.78 -1.03 0.00 0.00 178.44 178.79 3cwc h GLY 113 N -0.09 1.85 1.06 2.65 0.00 -1.70 -1.06 103.07 105.78 3cwc h GLY 113 Ca 0.28 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.29 3cwc h GLY 113 CO -0.72 -0.43 -0.03 -0.84 0.00 0.00 0.00 176.54 174.53 3cwc h THR 114 N 0.31 1.27 -0.88 4.70 2.02 -1.51 -2.48 112.91 116.34 3cwc h THR 114 Ca 0.73 -1.16 0.03 0.00 0.77 0.00 0.00 66.41 66.77 3cwc h THR 114 Cb 1.76 0.90 -0.05 0.00 -1.74 0.00 0.00 68.15 69.02 3cwc h THR 114 CO -0.54 0.42 0.58 1.23 0.37 0.00 0.00 175.52 177.58 3cwc h GLY 115 N 0.89 1.25 0.92 2.16 0.00 -1.16 -1.82 103.07 105.31 3cwc h GLY 115 Ca 0.15 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 3cwc h GLY 115 CO 0.03 0.39 -0.18 0.83 0.00 0.00 0.00 176.54 177.61 3cwc h GLU 116 N 1.11 -0.48 -0.61 4.80 5.08 -1.28 0.10 114.58 123.30 3cwc h GLU 116 Ca 0.34 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.86 3cwc h GLU 116 Cb -0.01 0.11 -0.12 0.00 0.50 0.00 0.00 28.75 29.23 3cwc h GLU 116 CO -0.10 -0.27 -0.20 -0.07 -1.00 0.00 0.00 179.01 177.37 3cwc h LEU 117 N -0.58 -0.72 -1.05 1.33 4.07 -1.31 0.11 115.31 117.16 3cwc h LEU 117 Ca -0.05 0.20 -0.02 0.00 0.08 0.00 0.00 57.88 58.09 3cwc h LEU 117 Cb 0.43 0.43 -0.04 0.00 1.08 0.00 0.00 40.66 42.57 3cwc h LEU 117 CO 0.08 -0.24 0.39 0.40 -1.08 0.00 0.00 178.44 177.99 3cwc h ILE 118 N -0.05 1.23 -0.49 1.22 2.04 -1.04 -1.19 117.51 119.22 3cwc h ILE 118 Ca 0.29 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 3cwc h ILE 118 Cb 0.49 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3cwc h ILE 118 CO -0.65 0.27 0.17 -0.09 0.00 0.00 0.00 178.15 177.84 3cwc h ARG 119 N 1.06 0.76 -0.46 2.37 2.43 0.88 -1.05 114.38 120.37 3cwc h ARG 119 Ca 0.26 -0.16 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 3cwc h ARG 119 Cb 0.07 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 3cwc h ARG 119 CO -0.04 0.70 -0.03 0.45 -1.51 0.00 0.00 179.97 179.55 3cwc h HIS 120 N 0.66 0.82 -0.40 2.20 3.86 -0.39 0.57 115.15 122.48 3cwc h HIS 120 Ca 0.16 -0.12 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 3cwc h HIS 120 Cb 0.25 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 3cwc h HIS 120 CO 0.01 0.78 -0.03 0.00 0.86 0.00 0.00 177.93 179.55 3cwc h ALA 121 N 1.25 0.54 -0.52 2.45 0.00 -1.11 -2.63 119.26 119.24 3cwc h ALA 121 Ca 0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3cwc h ALA 121 Cb 0.48 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3cwc h ALA 121 CO 0.02 0.34 0.29 -0.07 0.00 0.00 0.00 179.25 179.84 3cwc h LEU 122 N 0.54 0.62 -2.19 0.00 3.38 -0.77 -2.33 115.31 114.56 3cwc h LEU 122 Ca 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3cwc h LEU 122 Cb 0.52 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3cwc h LEU 122 CO 0.03 0.50 -0.06 0.44 0.09 0.00 0.00 178.44 179.43 3cwc h ASP 123 N 0.72 0.00 -0.43 -0.43 3.32 -0.54 -1.43 116.42 117.63 3cwc h ASP 123 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3cwc h ASP 123 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3cwc h ASP 123 CO -0.03 0.06 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 3cwc n ALA 124 N -2.31 2.93 -2.01 3.45 0.00 -0.88 -4.94 120.51 116.75 3cwc n ALA 124 Ca -0.02 -1.05 -0.21 0.00 0.00 0.00 0.00 53.44 52.16 3cwc n ALA 124 Cb 0.16 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 18.53 3cwc n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cwc n GLY 125 N 0.82 0.71 3.74 0.00 0.00 -0.54 -4.91 105.19 105.01 3cwc n GLY 125 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3cwc n GLY 125 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cwc s VAL 126 N -2.90 2.18 -0.68 1.61 -7.23 -1.23 -4.87 120.40 107.28 3cwc s VAL 126 Ca 0.00 0.12 0.22 0.00 -1.81 0.00 0.00 61.98 60.51 3cwc s VAL 126 Cb 0.00 -3.05 -0.24 0.00 0.56 0.00 0.00 36.38 33.64 3cwc s VAL 126 CO 0.00 -0.02 0.81 -0.62 -0.31 0.00 0.00 175.10 174.96 3cwc n GLU 127 N -1.55 0.22 -3.76 4.82 4.71 0.62 -4.89 120.64 120.80 3cwc n GLU 127 Ca 0.14 -0.06 -0.14 0.00 -0.01 0.00 0.00 57.16 57.09 3cwc n GLU 127 Cb 0.47 -1.52 -0.15 0.00 -1.01 0.00 0.00 31.44 29.24 3cwc n GLU 127 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 3cwc s HIS 128 N -3.17 -0.09 -0.08 -0.32 5.04 -0.90 -0.47 115.29 115.31 3cwc s HIS 128 Ca 0.03 0.33 0.04 0.00 -1.54 0.00 0.00 55.06 53.91 3cwc s HIS 128 Cb 0.15 -0.13 0.00 0.00 0.04 0.00 0.00 32.58 32.65 3cwc s HIS 128 CO 0.87 -0.13 -0.19 0.42 -2.34 0.00 0.00 174.74 173.37 3cwc s ILE 129 N 1.04 1.64 -0.19 0.89 1.01 -0.11 -0.41 121.20 125.07 3cwc s ILE 129 Ca -0.08 -0.78 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 3cwc s ILE 129 Cb -0.11 -1.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 3cwc s ILE 129 CO -0.04 0.47 -0.05 -0.63 0.00 0.00 0.00 174.94 174.69 3cwc s ILE 130 N 0.40 3.57 -0.06 2.92 1.01 0.62 -0.59 121.20 129.07 3cwc s ILE 130 Ca -0.15 -0.45 0.04 0.00 0.00 0.00 0.00 60.65 60.10 3cwc s ILE 130 Cb -0.16 -2.59 -0.00 0.00 0.01 0.00 0.00 42.46 39.72 3cwc s ILE 130 CO 0.06 0.46 -0.18 -0.63 0.00 0.00 0.00 174.94 174.65 3cwc s ILE 131 N 0.94 1.52 -0.03 2.92 1.01 -0.07 0.01 121.20 127.50 3cwc s ILE 131 Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.90 3cwc s ILE 131 Cb -0.15 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 3cwc s ILE 131 CO 0.01 0.44 0.01 -0.83 0.00 0.00 0.00 174.94 174.56 3cwc s GLY 132 N 0.17 1.88 -0.08 6.18 0.00 0.42 -0.35 107.32 115.53 3cwc s GLY 132 Ca -0.08 -0.90 0.14 0.00 0.00 0.00 0.00 44.72 43.89 3cwc s GLY 132 CO 0.03 -0.73 1.14 0.29 0.00 0.00 0.00 173.10 173.83 3cwc n ILE 133 N 1.61 0.95 -2.04 0.90 -5.35 -1.26 -4.39 119.36 109.78 3cwc n ILE 133 Ca -0.16 -1.59 -0.33 0.00 -0.27 0.00 0.00 62.75 60.41 3cwc n ILE 133 Cb 0.53 0.31 0.01 0.00 -1.74 0.00 0.00 39.64 38.75 3cwc n ILE 133 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3cwc s GLY 134 N -2.25 2.14 -0.79 3.28 0.00 -1.26 -4.31 107.32 104.13 3cwc s GLY 134 Ca 0.26 0.41 -0.04 0.00 0.00 0.00 0.00 44.72 45.35 3cwc s GLY 134 CO -0.06 0.74 0.59 0.61 0.00 0.00 0.00 173.10 174.97 3cwc n GLY 135 N -0.91 0.08 3.79 0.20 0.00 -1.26 -4.18 105.19 102.91 3cwc n GLY 135 Ca 0.09 -0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 3cwc n GLY 135 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cwc s SER 136 N -3.09 7.12 0.00 1.61 1.04 -1.26 -1.04 113.70 118.08 3cwc s SER 136 Ca 0.29 1.88 0.23 0.00 0.48 0.00 0.00 55.95 58.83 3cwc s SER 136 Cb -0.13 -2.58 0.12 0.00 0.10 0.00 0.00 66.02 63.53 3cwc s SER 136 CO 0.36 -0.23 1.14 0.00 0.98 0.00 0.00 173.24 175.50 3cwc n ALA 137 N 0.22 4.15 -2.89 5.32 0.00 -0.60 -4.20 120.51 122.52 3cwc n ALA 137 Ca 0.03 -0.49 -0.30 0.00 0.00 0.00 0.00 53.44 52.68 3cwc n ALA 137 Cb 0.50 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.98 3cwc n ALA 137 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3cwc s THR 138 N -2.96 5.20 -0.27 0.00 -4.23 -1.26 -4.67 115.64 107.46 3cwc s THR 138 Ca 0.10 -0.51 0.21 0.00 -1.18 0.00 0.00 61.69 60.32 3cwc s THR 138 Cb 0.17 -3.56 0.50 0.00 1.34 0.00 0.00 72.50 70.96 3cwc s THR 138 CO 0.77 0.10 1.10 -3.20 -0.54 0.00 0.00 174.62 172.86 3cwc n ASN 139 N 0.20 1.79 -0.90 3.99 5.15 -1.26 -3.78 115.26 120.45 3cwc n ASN 139 Ca -0.06 -2.20 0.07 0.00 -0.60 0.00 0.00 54.58 51.80 3cwc n ASN 139 Cb 0.52 -0.47 0.23 0.00 -0.53 0.00 0.00 39.78 39.52 3cwc n ASN 139 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 3cwc n ASP 140 N -0.56 3.64 -1.52 1.20 5.75 -1.24 -4.12 116.55 119.70 3cwc n ASP 140 Ca 0.10 -2.51 -0.18 0.00 -0.01 0.00 0.00 54.79 52.19 3cwc n ASP 140 Cb 0.81 -0.42 -0.07 0.00 -1.03 0.00 0.00 41.12 40.42 3cwc n ASP 140 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cwc n GLY 141 N 0.17 1.38 2.38 6.12 0.00 -0.57 -1.39 105.19 113.29 3cwc n GLY 141 Ca 0.18 -0.14 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 3cwc n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cwc n GLY 142 N -0.79 0.71 0.23 -0.02 0.00 -1.26 -4.32 105.19 99.74 3cwc n GLY 142 Ca -0.19 -0.29 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 3cwc n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cwc h ALA 143 N 0.00 0.62 0.00 4.61 0.00 -1.62 -1.43 119.26 121.43 3cwc h ALA 143 Ca -0.10 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3cwc h ALA 143 Cb 0.57 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3cwc h ALA 143 CO 0.15 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.15 3cwc n GLY 144 N -0.52 0.00 0.00 0.00 0.00 -1.26 -1.61 105.19 101.80 3cwc n GLY 144 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3cwc n GLY 144 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3cwc n VAL 146 N 0.71 0.00 -0.20 1.61 0.24 -0.54 -0.89 118.33 119.26 3cwc n VAL 146 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 3cwc n VAL 146 Cb 0.00 0.00 0.21 0.00 -1.47 0.00 0.00 33.84 32.58 3cwc n VAL 146 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 3cwc h GLN 147 N 0.00 0.96 0.00 7.34 4.20 -1.44 -0.39 115.11 125.79 3cwc h GLN 147 Ca 0.00 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 3cwc h GLN 147 Cb 0.00 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.58 3cwc h GLN 147 CO 0.00 0.71 -0.16 0.00 -0.67 0.00 0.00 178.83 178.71 3cwc h ALA 148 N 1.44 1.12 -0.49 3.87 0.00 -1.27 -2.49 119.26 121.44 3cwc h ALA 148 Ca 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3cwc h ALA 148 Cb 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3cwc h ALA 148 CO -0.04 0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.69 3cwc n LEU 149 N -3.45 3.32 0.00 0.00 4.77 -0.39 -4.75 117.00 116.51 3cwc n LEU 149 Ca -0.01 -1.67 0.00 0.00 -0.03 0.00 0.00 56.01 54.30 3cwc n LEU 149 Cb 0.34 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3cwc n LEU 149 CO 0.31 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 3cwc n GLY 150 N 1.05 0.52 3.76 -0.72 0.00 -0.73 -1.08 105.19 107.99 3cwc n GLY 150 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3cwc n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cwc s ALA 151 N -2.15 3.66 -0.28 4.61 0.00 -0.29 -3.73 121.76 123.57 3cwc s ALA 151 Ca 0.00 1.54 -0.09 0.00 0.00 0.00 0.00 51.96 53.41 3cwc s ALA 151 Cb 0.00 -3.62 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 3cwc s ALA 151 CO 0.00 -0.98 0.13 1.03 0.00 0.00 0.00 175.76 175.94 3cwc s ARG 152 N -1.20 3.59 -0.21 0.00 1.81 0.06 -4.00 118.95 119.00 3cwc s ARG 152 Ca 0.58 -0.54 0.01 0.00 -1.72 0.00 0.00 55.73 54.05 3cwc s ARG 152 Cb -0.46 -3.50 0.05 0.00 -0.45 0.00 0.00 34.95 30.58 3cwc s ARG 152 CO 0.54 -0.28 -0.08 -0.51 -0.68 0.00 0.00 175.30 174.29 3cwc s LEU 153 N 1.65 2.30 0.07 2.53 1.02 -1.26 -0.26 118.68 124.73 3cwc s LEU 153 Ca 0.06 -0.96 -0.04 0.00 0.02 0.00 0.00 54.13 53.20 3cwc s LEU 153 Cb -0.16 -1.17 -0.02 0.00 0.02 0.00 0.00 46.19 44.85 3cwc s LEU 153 CO 0.06 -0.18 0.08 0.00 0.02 0.00 0.00 176.35 176.33 3cwc s ARG 154 N 1.43 0.74 0.00 1.70 1.70 -0.98 -1.73 118.95 121.81 3cwc s ARG 154 Ca -0.03 -1.12 0.00 0.00 -0.47 0.00 0.00 55.73 54.11 3cwc s ARG 154 Cb -0.17 0.27 0.00 0.00 -0.57 0.00 0.00 34.95 34.48 3cwc s ARG 154 CO -0.07 -0.19 0.00 -0.40 -1.08 0.00 0.00 175.30 173.55 3cwc n ASP 155 N 0.02 0.00 0.17 -2.89 5.68 -0.50 -0.59 116.55 118.44 3cwc n ASP 155 Ca -0.14 0.00 0.14 0.00 -0.50 0.00 0.00 54.79 54.29 3cwc n ASP 155 Cb 0.62 0.00 0.49 0.00 -1.14 0.00 0.00 41.12 41.08 3cwc n ASP 155 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3cwc h ALA 156 N -2.00 1.00 -0.51 2.12 0.00 -1.90 -3.22 119.26 114.74 3cwc h ALA 156 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3cwc h ALA 156 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3cwc h ALA 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 3cwc n GLN 157 N -2.57 2.78 -0.94 0.00 0.00 -1.26 -4.95 117.38 110.43 3cwc n GLN 157 Ca 0.03 -2.31 0.00 0.00 0.00 0.00 0.00 57.00 54.72 3cwc n GLN 157 Cb 0.33 -1.40 0.00 0.00 0.00 0.00 0.00 30.24 29.17 3cwc n GLN 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3cwc n GLY 158 N 1.02 0.53 3.75 2.61 0.00 -1.22 -5.03 105.19 106.86 3cwc n GLY 158 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3cwc n GLY 158 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cwc s ASN 159 N -2.01 7.08 0.21 1.61 -0.87 -1.26 -4.84 114.94 114.86 3cwc s ASN 159 Ca 0.00 1.28 -0.32 0.00 -1.57 0.00 0.00 52.86 52.25 3cwc s ASN 159 Cb 0.00 -2.41 -0.12 0.00 -0.02 0.00 0.00 41.25 38.70 3cwc s ASN 159 CO 0.00 0.05 1.72 -1.81 -2.57 0.00 0.00 177.10 174.49 3cwc s ASP 160 N -0.06 6.37 0.64 -1.22 1.01 -1.26 -1.42 116.67 120.74 3cwc s ASP 160 Ca 0.35 2.88 -0.18 0.00 0.71 0.00 0.00 52.55 56.30 3cwc s ASP 160 Cb -0.19 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.12 3cwc s ASP 160 CO 0.20 -0.98 1.19 2.30 0.21 0.00 0.00 175.17 178.09 3cwc n ILE 161 N 3.95 4.59 -0.95 0.77 -5.35 -0.70 -4.85 119.36 116.80 3cwc n ILE 161 Ca 0.16 -0.50 -0.30 0.00 -0.27 0.00 0.00 62.75 61.84 3cwc n ILE 161 Cb 0.35 -1.38 0.17 0.00 -1.74 0.00 0.00 39.64 37.04 3cwc n ILE 161 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3cwc s ALA 162 N -1.43 1.00 0.46 -1.28 0.00 -1.26 -5.00 121.76 114.25 3cwc s ALA 162 Ca 0.81 0.02 -0.25 0.00 0.00 0.00 0.00 51.96 52.54 3cwc s ALA 162 Cb -0.39 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.41 3cwc s ALA 162 CO 0.42 -2.82 1.41 -0.65 0.00 0.00 0.00 175.76 174.12 3cwc s GLN 163 N -4.77 3.63 0.00 0.00 -0.21 -1.26 -4.02 119.66 113.03 3cwc s GLN 163 Ca 0.65 2.37 0.00 0.00 0.02 0.00 0.00 55.36 58.40 3cwc s GLN 163 Cb -0.21 -2.61 0.00 0.00 1.00 0.00 0.00 33.01 31.20 3cwc s GLN 163 CO 0.59 -0.84 0.00 0.41 -2.12 0.00 0.00 175.29 173.33 3cwc n GLY 164 N 0.60 -1.06 0.31 3.09 0.00 -1.21 -4.03 105.19 102.89 3cwc n GLY 164 Ca 0.06 -1.63 0.17 0.00 0.00 0.00 0.00 46.02 44.62 3cwc n GLY 164 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3cwc h GLY 165 N 0.00 0.00 1.60 -0.02 0.00 -1.65 0.12 103.07 103.11 3cwc h GLY 165 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 3cwc h GLY 165 CO 0.00 0.00 -0.29 1.19 0.00 0.00 0.00 176.54 177.44 3cwc h ILE 166 N 0.00 1.27 -0.16 2.60 2.10 -1.66 -2.04 117.51 119.63 3cwc h ILE 166 Ca 0.00 -1.33 0.05 0.00 1.08 0.00 0.00 64.86 64.66 3cwc h ILE 166 Cb 0.34 1.41 -0.01 0.00 -1.09 0.00 0.00 36.82 37.47 3cwc h ILE 166 CO 0.00 0.42 0.14 1.23 -1.08 0.00 0.00 178.15 178.86 3cwc h GLY 167 N 1.04 0.00 2.00 8.18 0.00 -1.10 -2.56 103.07 110.64 3cwc h GLY 167 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3cwc h GLY 167 CO 0.05 0.00 0.00 1.41 0.00 0.00 0.00 176.54 178.00 3cwc h LEU 168 N 0.00 0.00 -1.16 3.11 4.07 -1.43 -3.07 115.31 116.83 3cwc h LEU 168 Ca 0.08 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.99 3cwc h LEU 168 Cb 0.35 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 3cwc h LEU 168 CO -0.00 0.00 -0.24 -0.33 -1.08 0.00 0.00 178.44 176.79 3cwc h GLU 169 N 0.00 0.00 -0.02 1.13 5.08 -1.51 -2.84 114.58 116.42 3cwc h GLU 169 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3cwc h GLU 169 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3cwc h GLU 169 CO 0.00 0.24 -0.40 0.25 -1.00 0.00 0.00 179.01 178.10 3cwc n THR 170 N -3.44 0.00 -1.69 1.13 -2.24 -1.16 -4.99 114.28 101.89 3cwc n THR 170 Ca -0.00 -0.30 -0.44 0.00 -2.27 0.00 0.00 64.05 61.03 3cwc n THR 170 Cb 0.42 1.25 -0.04 0.00 -2.10 0.00 0.00 70.33 69.87 3cwc n THR 170 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3cwc n LEU 171 N 0.05 3.60 0.00 3.22 0.00 -1.07 -4.08 117.00 118.71 3cwc n LEU 171 Ca 0.09 1.04 0.00 0.00 0.00 0.00 0.00 56.01 57.14 3cwc n LEU 171 Cb 0.43 -1.49 0.00 0.00 0.00 0.00 0.00 43.42 42.37 3cwc n LEU 171 CO 0.25 -0.03 -0.42 0.00 0.00 0.00 0.00 177.39 177.18 3cwc n ALA 172 N 4.40 1.71 -3.63 1.96 0.00 0.24 -4.93 120.51 120.25 3cwc n ALA 172 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.48 3cwc n ALA 172 Cb 0.32 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.72 3cwc n ALA 172 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3cwc s SER 173 N -1.79 -0.75 -0.15 0.00 1.04 -0.95 -4.99 113.70 106.12 3cwc s SER 173 Ca 0.00 1.43 -0.03 0.00 0.48 0.00 0.00 55.95 57.83 3cwc s SER 173 Cb 0.00 1.43 -0.02 0.00 0.10 0.00 0.00 66.02 67.53 3cwc s SER 173 CO 0.00 -0.24 -0.06 -0.63 0.98 0.00 0.00 173.24 173.28 3cwc s ILE 174 N 0.49 3.62 -0.26 -1.02 1.01 -1.26 -2.32 121.20 121.46 3cwc s ILE 174 Ca -0.01 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.20 3cwc s ILE 174 Cb -0.05 -2.57 0.07 0.00 0.01 0.00 0.00 42.46 39.92 3cwc s ILE 174 CO -0.01 0.50 -0.03 -0.62 0.00 0.00 0.00 174.94 174.77 3cwc s ASP 175 N 0.44 4.03 -0.26 3.58 2.15 0.64 -4.96 116.67 122.30 3cwc s ASP 175 Ca -0.05 -1.36 0.02 0.00 0.43 0.00 0.00 52.55 51.58 3cwc s ASP 175 Cb -0.15 -1.23 0.33 0.00 -0.30 0.00 0.00 42.92 41.57 3cwc s ASP 175 CO 0.03 -0.27 1.57 2.30 -0.17 0.00 0.00 175.17 178.64 3cwc n ILE 176 N 4.62 2.28 0.09 4.11 -6.64 -1.26 -0.76 119.36 121.79 3cwc n ILE 176 Ca -0.09 -1.14 -0.12 0.00 -1.77 0.00 0.00 62.75 59.63 3cwc n ILE 176 Cb 0.43 -0.82 -0.09 0.00 -1.44 0.00 0.00 39.64 37.72 3cwc n ILE 176 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 3cwc h SER 177 N 0.69 0.30 0.10 7.28 0.02 -1.94 -3.10 113.55 116.90 3cwc h SER 177 Ca 0.34 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3cwc h SER 177 Cb 1.82 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 64.26 3cwc h SER 177 CO 0.63 1.18 -0.07 0.61 -1.14 0.00 0.00 176.83 178.03 3cwc n GLY 178 N 1.27 -0.40 3.69 -3.77 0.00 -1.26 -4.95 105.19 99.78 3cwc n GLY 178 Ca -0.05 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 3cwc n GLY 178 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3cwc s LEU 179 N -2.18 4.35 -0.41 0.99 2.96 -1.17 -4.44 118.68 118.77 3cwc s LEU 179 Ca 0.35 2.41 -0.44 0.00 -0.22 0.00 0.00 54.13 56.23 3cwc s LEU 179 Cb 0.21 -3.56 -0.18 0.00 0.50 0.00 0.00 46.19 43.16 3cwc s LEU 179 CO 0.40 -0.85 1.74 -0.67 -1.32 0.00 0.00 176.35 175.65 3cwc n ASP 180 N 5.56 1.66 0.01 3.68 -0.08 -0.24 -4.78 116.55 122.37 3cwc n ASP 180 Ca 0.15 1.06 0.06 0.00 -1.51 0.00 0.00 54.79 54.54 3cwc n ASP 180 Cb 0.41 -1.00 0.25 0.00 2.34 0.00 0.00 41.12 43.12 3cwc n ASP 180 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3cwc n LYS 181 N 5.10 0.02 0.00 -0.67 4.01 -1.26 -3.00 118.16 122.36 3cwc n LYS 181 Ca 0.32 0.34 0.15 0.00 -0.51 0.00 0.00 58.31 58.61 3cwc n LYS 181 Cb 0.03 -1.54 0.70 0.00 -0.51 0.00 0.00 35.03 33.71 3cwc n LYS 181 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 3cwc n ARG 182 N -1.57 0.59 -0.02 1.97 1.74 -1.26 -4.16 116.66 113.95 3cwc n ARG 182 Ca 0.02 -0.11 -0.13 0.00 -0.77 0.00 0.00 57.85 56.86 3cwc n ARG 182 Cb 0.12 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 29.96 3cwc n ARG 182 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3cwc h LEU 183 N 0.27 -0.03 -0.59 0.55 3.38 -1.87 -2.41 115.31 114.61 3cwc h LEU 183 Ca 0.00 -0.64 -0.00 0.00 0.09 0.00 0.00 57.88 57.33 3cwc h LEU 183 Cb 0.30 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 3cwc h LEU 183 CO 0.00 0.64 0.36 0.77 0.09 0.00 0.00 178.44 180.30 3cwc h SER 184 N -0.72 0.72 -0.89 -0.43 4.64 -1.72 -0.31 113.55 114.84 3cwc h SER 184 Ca -0.00 -0.06 0.19 0.00 -0.47 0.00 0.00 61.79 61.45 3cwc h SER 184 Cb 0.66 -0.18 -0.11 0.00 -0.31 0.00 0.00 62.40 62.46 3cwc h SER 184 CO 0.01 0.57 0.42 0.00 -0.87 0.00 0.00 176.83 176.96 3cwc h ALA 185 N 1.18 1.40 -2.79 5.18 0.00 -1.76 -3.44 119.26 119.03 3cwc h ALA 185 Ca 0.21 0.13 -0.50 0.00 0.00 0.00 0.00 54.91 54.75 3cwc h ALA 185 Cb -0.02 0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.86 3cwc h ALA 185 CO -0.04 -0.24 0.44 0.00 0.00 0.00 0.00 179.25 179.41 3cwc s HIS 187 N -1.15 2.73 -0.19 0.00 2.46 0.38 -4.95 115.29 114.58 3cwc s HIS 187 Ca 0.44 -0.24 -0.02 0.00 0.47 0.00 0.00 55.06 55.70 3cwc s HIS 187 Cb -0.30 -4.17 -0.01 0.00 -0.13 0.00 0.00 32.58 27.97 3cwc s HIS 187 CO 0.39 -1.49 -0.08 0.42 -2.47 0.00 0.00 174.74 171.50 3cwc s ILE 188 N 4.04 3.14 -0.07 0.89 1.01 -1.26 -0.93 121.20 128.02 3cwc s ILE 188 Ca 0.27 -0.59 0.05 0.00 0.00 0.00 0.00 60.65 60.39 3cwc s ILE 188 Cb -0.14 -2.39 -0.01 0.00 0.01 0.00 0.00 42.46 39.93 3cwc s ILE 188 CO 0.15 0.47 -0.24 -1.61 0.00 0.00 0.00 174.94 173.71 3cwc s GLU 189 N 1.12 2.70 -0.18 2.79 2.02 0.25 -1.02 118.70 126.38 3cwc s GLU 189 Ca 0.01 -0.89 -0.00 0.00 0.02 0.00 0.00 54.97 54.11 3cwc s GLU 189 Cb -0.14 -2.21 0.01 0.00 0.10 0.00 0.00 34.13 31.88 3cwc s GLU 189 CO -0.02 0.33 -0.16 0.08 0.02 0.00 0.00 175.26 175.52 3cwc s VAL 190 N -0.04 2.46 -0.28 2.63 1.01 -0.24 -0.89 120.40 125.06 3cwc s VAL 190 Ca -0.07 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 3cwc s VAL 190 Cb -0.15 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 3cwc s VAL 190 CO 0.05 0.51 1.89 0.00 0.00 0.00 0.00 175.10 177.55 3cwc s ALA 191 N 1.23 2.90 -0.12 5.51 0.00 0.52 -1.78 121.76 130.01 3cwc s ALA 191 Ca 0.03 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.41 3cwc s ALA 191 Cb -0.14 -4.01 0.04 0.00 0.00 0.00 0.00 23.12 19.02 3cwc s ALA 191 CO -0.08 -2.57 0.03 0.00 0.00 0.00 0.00 175.76 173.14 3cwc n ASP 193 N 5.15 1.87 -4.41 0.00 9.92 -1.26 -3.37 116.55 124.45 3cwc n ASP 193 Ca -0.07 -2.32 -0.27 0.00 -0.53 0.00 0.00 54.79 51.60 3cwc n ASP 193 Cb 0.49 -0.16 -0.12 0.00 -0.64 0.00 0.00 41.12 40.69 3cwc n ASP 193 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 3cwc s VAL 194 N -1.55 2.28 -2.01 2.53 -7.23 -1.26 -5.03 120.40 108.13 3cwc s VAL 194 Ca 0.11 -1.96 0.25 0.00 -1.81 0.00 0.00 61.98 58.58 3cwc s VAL 194 Cb 0.10 -2.06 0.21 0.00 0.56 0.00 0.00 36.38 35.19 3cwc s VAL 194 CO 0.01 -0.09 1.42 0.35 -0.31 0.00 0.00 175.10 176.48 3cwc n THR 195 N 0.41 0.00 -1.86 5.32 -2.24 -1.26 -3.74 114.28 110.91 3cwc n THR 195 Ca -0.14 -0.21 -0.41 0.00 -2.27 0.00 0.00 64.05 61.02 3cwc n THR 195 Cb 0.55 0.74 -0.01 0.00 -2.10 0.00 0.00 70.33 69.52 3cwc n THR 195 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3cwc s ASN 196 N -2.40 6.44 0.72 3.42 -0.87 -1.26 -1.62 114.94 119.37 3cwc s ASN 196 Ca 0.24 2.94 -0.03 0.00 -1.57 0.00 0.00 52.86 54.44 3cwc s ASN 196 Cb 0.19 -2.65 0.12 0.00 -0.02 0.00 0.00 41.25 38.88 3cwc s ASN 196 CO 0.50 -0.82 0.76 -0.81 -2.57 0.00 0.00 177.10 174.16 3cwc n PRO 197 N 1.16 -0.14 -0.11 -0.60 -0.04 -1.26 -1.03 135.00 132.99 3cwc n PRO 197 Ca 0.03 -1.81 -0.09 0.00 -0.04 0.00 0.00 63.50 61.60 3cwc n PRO 197 Cb 0.39 -0.59 -0.01 0.00 -0.04 0.00 0.00 33.50 33.25 3cwc n PRO 197 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3cwc h LEU 198 N 0.00 0.45 -8.72 1.53 6.46 -1.78 -2.90 115.31 110.35 3cwc h LEU 198 Ca -0.25 -0.11 -0.33 0.00 -0.12 0.00 0.00 57.88 57.08 3cwc h LEU 198 Cb 0.86 -0.11 -0.15 0.00 -0.73 0.00 0.00 40.66 40.53 3cwc h LEU 198 CO 0.24 0.43 -0.68 0.42 -0.62 0.00 0.00 178.44 178.23 3cwc s THR 199 N -5.79 0.94 0.00 1.05 -4.23 -1.26 -2.54 115.64 103.82 3cwc s THR 199 Ca -0.13 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 3cwc s THR 199 Cb 0.10 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.84 3cwc s THR 199 CO 0.73 -0.52 0.00 0.61 -0.54 0.00 0.00 174.62 174.90 3cwc n GLY 200 N -0.28 -1.81 0.43 3.99 0.00 -1.26 -3.83 105.19 102.43 3cwc n GLY 200 Ca -0.07 -2.19 0.31 0.00 0.00 0.00 0.00 46.02 44.06 3cwc n GLY 200 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3cwc h LYS 201 N 3.70 0.20 -0.19 1.61 2.10 -2.00 -0.19 116.57 121.81 3cwc h LYS 201 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3cwc h LYS 201 Cb 0.00 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.28 3cwc h LYS 201 CO 0.00 0.14 0.00 0.39 -2.00 0.00 0.00 179.45 177.98 3cwc n GLU 202 N -4.71 2.52 -1.27 0.07 4.71 -1.26 -4.65 120.64 116.04 3cwc n GLU 202 Ca 0.32 -2.59 -0.29 0.00 -0.01 0.00 0.00 57.16 54.59 3cwc n GLU 202 Cb 1.19 -1.63 0.19 0.00 -1.01 0.00 0.00 31.44 30.19 3cwc n GLU 202 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 3cwc s GLY 203 N -1.99 1.59 0.17 0.62 0.00 -0.08 -4.21 107.32 103.42 3cwc s GLY 203 Ca 0.35 -0.69 -0.25 0.00 0.00 0.00 0.00 44.72 44.12 3cwc s GLY 203 CO 0.08 0.03 1.57 0.00 0.00 0.00 0.00 173.10 174.77 3cwc h ALA 204 N -2.07 -0.32 0.27 3.20 0.00 -1.33 0.48 119.26 119.49 3cwc h ALA 204 Ca -0.50 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3cwc h ALA 204 Cb 1.31 0.97 0.00 0.00 0.00 0.00 0.00 17.79 20.08 3cwc h ALA 204 CO 0.48 -0.82 -0.13 0.77 0.00 0.00 0.00 179.25 179.55 3cwc h SER 205 N -0.21 -0.30 -0.61 0.00 0.02 -1.90 0.14 113.55 110.68 3cwc h SER 205 Ca 0.18 -0.21 0.07 0.00 -0.84 0.00 0.00 61.79 61.00 3cwc h SER 205 Cb 0.56 0.08 -0.06 0.00 0.14 0.00 0.00 62.40 63.12 3cwc h SER 205 CO -0.70 0.08 0.30 0.00 -1.14 0.00 0.00 176.83 175.36 3cwc h ALA 206 N -0.13 0.81 0.14 3.77 0.00 -1.78 -0.92 119.26 121.14 3cwc h ALA 206 Ca -0.04 0.04 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 3cwc h ALA 206 Cb 0.49 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3cwc h ALA 206 CO 0.06 -0.07 -1.87 0.28 0.00 0.00 0.00 179.25 177.65 3cwc h VAL 207 N 0.55 0.74 0.00 0.00 2.07 -0.89 -3.42 116.25 115.30 3cwc h VAL 207 Ca 0.29 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 65.43 3cwc h VAL 207 Cb 0.25 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 3cwc h VAL 207 CO -0.22 0.86 -1.41 0.49 0.02 0.00 0.00 177.57 177.31 3cwc n PHE 208 N -3.58 0.00 -0.24 1.57 3.72 0.45 -4.67 117.46 114.71 3cwc n PHE 208 Ca -0.30 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 56.99 3cwc n PHE 208 Cb 1.03 -0.23 -0.09 0.00 -0.94 0.00 0.00 39.48 39.26 3cwc n PHE 208 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3cwc h GLY 209 N 2.00 -0.85 -0.28 1.37 0.00 -0.53 -3.18 103.07 101.60 3cwc h GLY 209 Ca 0.00 0.72 0.23 0.00 0.00 0.00 0.00 47.33 48.27 3cwc h GLY 209 CO 0.00 -0.08 0.36 -2.55 0.00 0.00 0.00 176.54 174.27 3cwc h PRO 210 N -0.24 0.33 0.00 4.80 0.11 -1.71 0.32 132.00 135.60 3cwc h PRO 210 Ca 0.12 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.16 3cwc h PRO 210 Cb 0.54 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 3cwc h PRO 210 CO -0.73 0.22 -0.23 -0.56 -0.21 0.00 0.00 178.00 176.49 3cwc h GLN 211 N 0.34 0.00 -0.36 1.05 3.07 -1.86 -2.38 115.11 114.97 3cwc h GLN 211 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.31 3cwc h GLN 211 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.67 3cwc h GLN 211 CO -0.57 0.23 0.00 1.63 0.09 0.00 0.00 178.83 180.22 3cwc n LYS 212 N -3.54 1.81 -0.48 0.06 5.02 1.00 -4.89 118.16 117.15 3cwc n LYS 212 Ca -0.01 -1.15 0.00 0.00 -2.02 0.00 0.00 58.31 55.13 3cwc n LYS 212 Cb 0.38 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 3cwc n LYS 212 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3cwc n GLY 213 N 0.94 0.76 3.66 0.72 0.00 -0.89 -3.92 105.19 106.46 3cwc n GLY 213 Ca 0.11 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 3cwc n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cwc s ALA 214 N -2.00 3.59 0.76 4.61 0.00 -0.47 -4.71 121.76 123.54 3cwc s ALA 214 Ca 0.00 0.62 -0.11 0.00 0.00 0.00 0.00 51.96 52.47 3cwc s ALA 214 Cb 0.00 -3.70 0.05 0.00 0.00 0.00 0.00 23.12 19.47 3cwc s ALA 214 CO 0.00 -1.38 1.08 0.95 0.00 0.00 0.00 175.76 176.42 3cwc s THR 215 N 3.94 3.45 0.43 0.00 -4.23 -1.26 -3.97 115.64 114.01 3cwc s THR 215 Ca 0.64 0.47 0.11 0.00 -1.18 0.00 0.00 61.69 61.73 3cwc s THR 215 Cb -0.26 -3.07 0.29 0.00 1.34 0.00 0.00 72.50 70.80 3cwc s THR 215 CO 0.22 -0.62 2.04 -0.65 -0.54 0.00 0.00 174.62 175.07 3cwc h PRO 216 N -1.04 0.41 -0.99 3.99 0.11 -2.01 0.22 132.00 132.69 3cwc h PRO 216 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3cwc h PRO 216 Cb 1.23 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3cwc h PRO 216 CO 0.54 0.27 0.00 -1.91 -0.21 0.00 0.00 178.00 176.70 3cwc n GLU 217 N -4.48 0.57 0.00 1.05 0.00 -1.26 -2.63 120.64 113.89 3cwc n GLU 217 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.21 3cwc n GLU 217 Cb 0.19 -1.25 0.00 0.00 0.00 0.00 0.00 31.44 30.38 3cwc n GLU 217 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 3cwc n ILE 219 N 0.46 0.00 -0.12 6.31 5.41 0.79 -2.63 119.36 129.58 3cwc n ILE 219 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 3cwc n ILE 219 Cb 0.21 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 39.12 3cwc n ILE 219 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 3cwc h GLU 220 N 0.00 0.58 0.19 0.38 4.81 -1.77 -0.61 114.58 118.16 3cwc h GLU 220 Ca 0.00 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 3cwc h GLU 220 Cb 0.00 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 3cwc h GLU 220 CO 0.00 0.63 -0.18 0.00 -0.73 0.00 0.00 179.01 178.74 3cwc h ARG 221 N 0.42 -0.38 -0.76 1.92 3.08 -1.81 -2.29 114.38 114.56 3cwc h ARG 221 Ca 0.11 0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 3cwc h ARG 221 Cb 0.33 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.43 3cwc h ARG 221 CO 0.00 -0.25 0.34 -0.07 -1.07 0.00 0.00 179.97 178.92 3cwc h LEU 222 N -0.39 1.02 -0.39 3.04 3.38 -1.84 -0.41 115.31 119.72 3cwc h LEU 222 Ca -0.00 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 3cwc h LEU 222 Cb 0.37 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3cwc h LEU 222 CO -0.04 0.90 0.00 -0.78 0.09 0.00 0.00 178.44 178.61 3cwc h ASP 223 N 1.09 0.67 -0.01 -0.43 3.58 -1.10 0.16 116.42 120.37 3cwc h ASP 223 Ca 0.26 -0.31 0.03 0.00 0.42 0.00 0.00 57.03 57.43 3cwc h ASP 223 Cb 0.17 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 3cwc h ASP 223 CO -0.03 0.81 -0.16 0.74 -2.88 0.00 0.00 179.24 177.72 3cwc h THR 224 N 0.51 0.61 -0.21 2.25 2.02 -1.28 -0.32 112.91 116.49 3cwc h THR 224 Ca 0.11 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 3cwc h THR 224 Cb 0.47 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 3cwc h THR 224 CO 0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.91 3cwc h ALA 225 N 0.69 1.63 0.03 6.16 0.00 -0.53 -1.72 119.26 125.52 3cwc h ALA 225 Ca 0.05 -0.13 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 3cwc h ALA 225 Cb 0.33 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3cwc h ALA 225 CO -0.16 0.28 -1.00 -0.07 0.00 0.00 0.00 179.25 178.30 3cwc h LEU 226 N 0.29 0.18 -0.62 0.00 3.38 -0.61 -2.06 115.31 115.86 3cwc h LEU 226 Ca 0.07 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3cwc h LEU 226 Cb 0.20 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3cwc h LEU 226 CO 0.00 1.07 0.37 0.74 0.09 0.00 0.00 178.44 180.71 3cwc h THR 227 N 0.05 1.18 0.34 0.22 2.02 -0.26 -0.04 112.91 116.42 3cwc h THR 227 Ca -0.05 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 66.70 3cwc h THR 227 Cb 1.70 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 3cwc h THR 227 CO 0.15 0.19 -0.16 0.03 0.37 0.00 0.00 175.52 176.10 3cwc h ARG 228 N 0.84 -0.44 -0.75 6.66 3.08 -1.36 -1.75 114.38 120.67 3cwc h ARG 228 Ca 0.22 0.03 0.17 0.00 0.07 0.00 0.00 59.98 60.48 3cwc h ARG 228 Cb -0.02 0.10 -0.13 0.00 0.08 0.00 0.00 29.97 30.01 3cwc h ARG 228 CO -0.04 -0.24 0.06 -0.92 -1.07 0.00 0.00 179.97 177.75 3cwc h TYR 229 N -0.53 0.04 -0.56 3.04 3.20 -1.29 0.13 116.97 121.01 3cwc h TYR 229 Ca -0.05 0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.89 3cwc h TYR 229 Cb 0.39 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 3cwc h TYR 229 CO -0.03 -0.21 0.36 0.00 -1.64 0.00 0.00 178.16 176.64 3cwc h ALA 230 N 1.69 0.72 -0.58 1.82 0.00 -0.83 0.95 119.26 123.02 3cwc h ALA 230 Ca 0.42 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.19 3cwc h ALA 230 Cb 0.75 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3cwc h ALA 230 CO -0.63 0.12 -0.06 0.45 0.00 0.00 0.00 179.25 179.12 3cwc h HIS 231 N 0.73 1.17 -0.04 0.00 3.86 -0.34 -2.32 115.15 118.21 3cwc h HIS 231 Ca 0.21 -0.23 -0.13 0.00 -1.16 0.00 0.00 60.37 59.07 3cwc h HIS 231 Cb -0.04 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.12 3cwc h HIS 231 CO -0.04 1.06 -0.55 -0.07 0.86 0.00 0.00 177.93 179.18 3cwc h LEU 232 N 0.95 0.14 -0.30 2.43 3.38 -0.54 -1.45 115.31 119.92 3cwc h LEU 232 Ca 0.16 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3cwc h LEU 232 Cb 0.63 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3cwc h LEU 232 CO 0.04 0.66 0.03 0.40 0.09 0.00 0.00 178.44 179.66 3cwc h ILE 233 N 0.10 1.24 -0.36 1.22 2.04 -0.67 0.36 117.51 121.43 3cwc h ILE 233 Ca -0.00 -0.85 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 3cwc h ILE 233 Cb 1.00 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 3cwc h ILE 233 CO 0.08 0.28 0.19 0.00 0.00 0.00 0.00 178.15 178.69 3cwc h ALA 234 N 0.86 1.65 0.16 1.87 0.00 -1.28 0.20 119.26 122.73 3cwc h ALA 234 Ca 0.09 -0.07 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 3cwc h ALA 234 Cb 0.38 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.02 3cwc h ALA 234 CO 0.01 0.29 -1.46 -0.09 0.00 0.00 0.00 179.25 178.01 3cwc h ARG 235 N 0.50 0.34 0.00 0.00 2.43 -0.98 -2.76 114.38 113.90 3cwc h ARG 235 Ca 0.13 -0.58 -0.04 0.00 -0.81 0.00 0.00 59.98 58.68 3cwc h ARG 235 Cb 0.04 0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 3cwc h ARG 235 CO -0.02 1.24 -1.82 -0.25 -1.51 0.00 0.00 179.97 177.61 3cwc n ASP 236 N -3.55 1.13 -0.11 -3.80 8.00 0.09 -4.46 116.55 113.85 3cwc n ASP 236 Ca -0.15 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.37 3cwc n ASP 236 Cb 1.06 1.65 0.00 0.00 -0.02 0.00 0.00 41.12 43.81 3cwc n ASP 236 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3cwc n LEU 237 N -2.16 0.96 -2.93 0.64 7.99 0.70 -4.99 117.00 117.21 3cwc n LEU 237 Ca -0.06 -0.84 -0.21 0.00 -0.01 0.00 0.00 56.01 54.88 3cwc n LEU 237 Cb 0.52 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.85 3cwc n LEU 237 CO 0.35 0.21 -0.07 1.41 -1.51 0.00 0.00 177.39 177.79 3cwc n HIS 238 N -0.20 -1.73 -4.52 -1.77 8.25 -1.04 -4.96 115.22 109.26 3cwc n HIS 238 Ca 0.02 0.38 -0.29 0.00 -0.26 0.00 0.00 57.72 57.57 3cwc n HIS 238 Cb 0.09 -3.97 -0.17 0.00 1.12 0.00 0.00 29.99 27.06 3cwc n HIS 238 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3cwc s VAL 239 N -3.06 1.60 -0.82 1.59 0.11 -1.25 -4.99 120.40 113.58 3cwc s VAL 239 Ca 0.24 -0.70 -0.25 0.00 -2.93 0.00 0.00 61.98 58.34 3cwc s VAL 239 Cb -0.11 -1.45 0.01 0.00 -1.53 0.00 0.00 36.38 33.30 3cwc s VAL 239 CO 0.30 0.46 1.56 -0.62 -3.33 0.00 0.00 175.10 173.47 3cwc s ASP 240 N 0.93 5.90 0.01 3.54 -1.08 -1.26 -3.21 116.67 121.50 3cwc s ASP 240 Ca -0.07 -0.59 0.24 0.00 -0.52 0.00 0.00 52.55 51.61 3cwc s ASP 240 Cb -0.15 -2.56 0.39 0.00 -1.46 0.00 0.00 42.92 39.14 3cwc s ASP 240 CO -0.01 -2.01 1.33 1.33 0.52 0.00 0.00 175.17 176.33 3cwc n VAL 241 N 6.94 0.04 0.24 1.11 0.24 -1.26 -4.23 118.33 121.41 3cwc n VAL 241 Ca 0.21 -0.04 0.11 0.00 -2.04 0.00 0.00 64.34 62.58 3cwc n VAL 241 Cb 0.50 0.29 0.58 0.00 -1.47 0.00 0.00 33.84 33.75 3cwc n VAL 241 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3cwc h LEU 242 N 0.00 0.00 -2.19 1.34 4.07 -1.85 -2.73 115.31 113.95 3cwc h LEU 242 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3cwc h LEU 242 Cb 0.53 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.27 3cwc h LEU 242 CO 0.00 0.18 0.00 0.47 -1.08 0.00 0.00 178.44 178.01 3cwc n ASP 243 N -3.49 2.76 -4.66 -0.43 8.00 -1.26 -4.70 116.55 112.77 3cwc n ASP 243 Ca -0.01 -1.81 -0.42 0.00 0.71 0.00 0.00 54.79 53.26 3cwc n ASP 243 Cb 0.34 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.27 3cwc n ASP 243 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3cwc s LEU 244 N -1.15 4.28 0.10 0.64 1.43 -1.03 -4.98 118.68 117.97 3cwc s LEU 244 Ca 0.25 2.09 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 3cwc s LEU 244 Cb 0.15 -3.53 -0.09 0.00 0.03 0.00 0.00 46.19 42.74 3cwc s LEU 244 CO 0.20 -0.88 1.60 0.00 0.23 0.00 0.00 176.35 177.50 3cwc s ALA 245 N 3.90 3.71 0.00 4.21 0.00 -1.26 -2.55 121.76 129.76 3cwc s ALA 245 Ca 0.68 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.89 3cwc s ALA 245 Cb -0.30 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.16 3cwc s ALA 245 CO 0.26 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.47 3cwc n GLY 246 N 3.87 1.55 0.32 0.00 0.00 -0.19 -4.91 105.19 105.83 3cwc n GLY 246 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 3cwc n GLY 246 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3cwc h GLY 247 N 0.00 0.00 1.85 -0.02 0.00 -1.20 -1.45 103.07 102.25 3cwc h GLY 247 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3cwc h GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3cwc n GLY 248 N -1.58 -1.24 3.64 4.60 0.00 -0.78 -2.02 105.19 107.81 3cwc n GLY 248 Ca 0.03 -0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.51 3cwc n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cwc n ALA 249 N -1.42 0.55 -3.78 4.61 0.00 -0.54 -2.80 120.51 117.13 3cwc n ALA 249 Ca 0.08 0.40 -0.24 0.00 0.00 0.00 0.00 53.44 53.67 3cwc n ALA 249 Cb 0.25 -2.16 0.02 0.00 0.00 0.00 0.00 19.45 17.55 3cwc n ALA 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cwc n ALA 250 N 0.87 -2.11 -1.39 0.00 0.00 -1.26 -1.96 120.51 114.66 3cwc n ALA 250 Ca 0.09 -0.21 -0.13 0.00 0.00 0.00 0.00 53.44 53.19 3cwc n ALA 250 Cb 0.32 -2.19 -0.06 0.00 0.00 0.00 0.00 19.45 17.52 3cwc n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cwc n GLY 251 N -1.73 1.34 0.00 0.00 0.00 -1.16 -4.60 105.19 99.03 3cwc n GLY 251 Ca -0.27 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3cwc n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cwc n GLY 252 N -0.60 0.74 4.12 -0.02 0.00 -0.85 -1.52 105.19 107.06 3cwc n GLY 252 Ca -0.13 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.15 3cwc n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cwc n GLY 254 N 0.00 0.00 0.31 -0.02 0.00 -0.83 -2.51 105.19 102.14 3cwc n GLY 254 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3cwc n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cwc h ALA 255 N 0.00 1.01 -0.23 4.61 0.00 -1.62 -1.07 119.26 121.96 3cwc h ALA 255 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3cwc h ALA 255 Cb 0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3cwc h ALA 255 CO 0.00 0.46 -0.17 0.00 0.00 0.00 0.00 179.25 179.54 3cwc h ALA 256 N 1.26 1.29 -0.16 0.00 0.00 -1.68 0.29 119.26 120.27 3cwc h ALA 256 Ca 0.29 -0.28 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 3cwc h ALA 256 Cb -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3cwc h ALA 256 CO -0.06 0.47 -0.71 -0.07 0.00 0.00 0.00 179.25 178.88 3cwc h LEU 257 N 0.36 0.80 0.67 0.00 3.38 -1.81 0.03 115.31 118.75 3cwc h LEU 257 Ca 0.07 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.50 3cwc h LEU 257 Cb 0.51 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.03 3cwc h LEU 257 CO 0.03 1.28 -0.32 0.22 0.09 0.00 0.00 178.44 179.74 3cwc h TYR 258 N 0.48 -0.83 0.19 1.13 5.03 -1.01 -0.80 116.97 121.16 3cwc h TYR 258 Ca -0.03 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.25 3cwc h TYR 258 Cb 1.32 0.28 0.00 0.00 1.55 0.00 0.00 36.73 39.87 3cwc h TYR 258 CO 0.07 -0.50 -0.09 0.00 -1.32 0.00 0.00 178.16 176.32 3cwc h ALA 259 N -0.67 -0.25 0.14 1.82 0.00 -0.45 -2.80 119.26 117.05 3cwc h ALA 259 Ca -0.09 -0.22 -0.27 0.00 0.00 0.00 0.00 54.91 54.33 3cwc h ALA 259 Cb 0.71 0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.62 3cwc h ALA 259 CO 0.15 -0.34 -1.14 0.74 0.00 0.00 0.00 179.25 178.66 3cwc h PHE 260 N -0.86 0.87 0.00 0.00 -1.00 -1.17 -3.39 116.94 111.39 3cwc h PHE 260 Ca -0.03 -0.58 -0.04 0.00 2.81 0.00 0.00 57.97 60.13 3cwc h PHE 260 Cb 0.52 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 3cwc h PHE 260 CO 0.07 1.43 -1.64 0.00 -1.61 0.00 0.00 178.31 176.56 3cwc n GLY 262 N 1.28 0.44 3.79 0.00 0.00 -0.82 -4.12 105.19 105.76 3cwc n GLY 262 Ca -0.05 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 3cwc n GLY 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cwc s ALA 263 N -2.00 2.68 -0.20 4.61 0.00 -0.37 -4.77 121.76 121.71 3cwc s ALA 263 Ca 0.00 0.48 -0.12 0.00 0.00 0.00 0.00 51.96 52.32 3cwc s ALA 263 Cb 0.00 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 3cwc s ALA 263 CO 0.00 -0.89 0.20 -1.14 0.00 0.00 0.00 175.76 173.94 3cwc s GLN 264 N -3.95 4.17 -0.36 0.00 0.74 -0.18 -4.41 119.66 115.67 3cwc s GLN 264 Ca 0.65 -0.12 -0.23 0.00 0.05 0.00 0.00 55.36 55.71 3cwc s GLN 264 Cb -0.18 -3.47 0.01 0.00 1.10 0.00 0.00 33.01 30.47 3cwc s GLN 264 CO 0.36 0.18 0.80 -0.51 -0.55 0.00 0.00 175.29 175.57 3cwc s LEU 265 N 0.68 4.11 0.11 3.68 1.02 -1.26 -1.08 118.68 125.94 3cwc s LEU 265 Ca 0.11 0.41 0.04 0.00 0.02 0.00 0.00 54.13 54.71 3cwc s LEU 265 Cb -0.13 -3.05 -0.04 0.00 0.02 0.00 0.00 46.19 42.99 3cwc s LEU 265 CO 0.02 -0.73 -0.11 -0.13 0.02 0.00 0.00 176.35 175.43 3cwc s ARG 266 N 3.12 0.93 0.28 1.70 0.52 -0.74 -4.92 118.95 119.84 3cwc s ARG 266 Ca 0.32 -1.25 -0.30 0.00 -0.52 0.00 0.00 55.73 53.98 3cwc s ARG 266 Cb -0.13 -0.60 -0.12 0.00 0.52 0.00 0.00 34.95 34.62 3cwc s ARG 266 CO 0.17 0.09 1.58 0.54 0.02 0.00 0.00 175.30 177.69 3cwc n ARG 267 N 0.34 2.61 -0.12 3.54 1.74 -1.22 -0.31 116.66 123.25 3cwc n ARG 267 Ca -0.14 0.93 -0.04 0.00 -0.77 0.00 0.00 57.85 57.82 3cwc n ARG 267 Cb 0.58 -2.70 0.03 0.00 -1.02 0.00 0.00 32.46 29.36 3cwc n ARG 267 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3cwc h GLY 268 N 4.79 0.45 1.01 -0.13 0.00 -1.77 -1.13 103.07 106.29 3cwc h GLY 268 Ca -0.47 0.02 0.09 0.00 0.00 0.00 0.00 47.33 46.97 3cwc h GLY 268 CO 0.79 -0.08 0.44 1.19 0.00 0.00 0.00 176.54 178.89 3cwc h ILE 269 N 0.15 0.94 -0.01 2.60 6.09 -1.81 -1.75 117.51 123.72 3cwc h ILE 269 Ca 0.20 -0.19 -0.16 0.00 -1.37 0.00 0.00 64.86 63.34 3cwc h ILE 269 Cb 0.27 0.34 -0.02 0.00 0.47 0.00 0.00 36.82 37.89 3cwc h ILE 269 CO -0.30 0.10 -0.74 -0.33 -3.07 0.00 0.00 178.15 173.80 3cwc h GLU 270 N 0.55 0.11 -0.13 2.19 5.08 -1.59 -1.26 114.58 119.53 3cwc h GLU 270 Ca 0.30 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 3cwc h GLU 270 Cb 0.45 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 3cwc h GLU 270 CO -0.09 0.80 -0.02 0.82 -1.00 0.00 0.00 179.01 179.52 3cwc h ILE 271 N 0.07 1.28 -0.54 3.13 2.04 -0.92 -3.09 117.51 119.48 3cwc h ILE 271 Ca -0.02 -0.92 -0.10 0.00 1.00 0.00 0.00 64.86 64.82 3cwc h ILE 271 Cb 1.31 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 39.01 3cwc h ILE 271 CO 0.11 0.27 -0.04 0.58 0.00 0.00 0.00 178.15 179.06 3cwc h VAL 272 N -0.06 1.27 -0.16 1.67 2.07 -1.28 -1.55 116.25 118.21 3cwc h VAL 272 Ca 0.03 -1.17 0.03 0.00 0.82 0.00 0.00 66.70 66.41 3cwc h VAL 272 Cb 0.42 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 3cwc h VAL 272 CO 0.01 0.42 -0.52 0.74 0.02 0.00 0.00 177.57 178.23 3cwc h THR 273 N 0.86 0.00 -0.40 2.57 2.02 -1.32 -2.41 112.91 114.23 3cwc h THR 273 Ca 0.15 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 3cwc h THR 273 Cb 0.59 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3cwc h THR 273 CO 0.04 0.00 0.23 0.44 0.37 0.00 0.00 175.52 176.60 3cwc h ASP 274 N -0.54 0.50 -0.62 4.18 3.32 -1.44 -1.18 116.42 120.63 3cwc h ASP 274 Ca 0.03 -0.07 0.09 0.00 0.02 0.00 0.00 57.03 57.11 3cwc h ASP 274 Cb 0.64 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 3cwc h ASP 274 CO -0.44 0.43 0.41 0.00 -1.72 0.00 0.00 179.24 177.92 3cwc h ALA 275 N 1.09 1.97 -0.37 3.45 0.00 -1.13 -2.35 119.26 121.92 3cwc h ALA 275 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3cwc h ALA 275 Cb 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3cwc h ALA 275 CO -0.02 -0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.40 3cwc n LEU 276 N -4.47 3.02 -3.87 0.00 4.77 -0.92 -4.97 117.00 110.55 3cwc n LEU 276 Ca 0.10 -1.80 -0.26 0.00 -0.03 0.00 0.00 56.01 54.02 3cwc n LEU 276 Cb 0.36 -0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 3cwc n LEU 276 CO 0.34 0.73 -0.05 1.41 -1.33 0.00 0.00 177.39 178.49 3cwc n HIS 277 N 0.83 -1.96 -0.09 -1.77 8.25 -0.79 -4.82 115.22 114.88 3cwc n HIS 277 Ca 0.14 0.84 0.06 0.00 -0.26 0.00 0.00 57.72 58.49 3cwc n HIS 277 Cb 0.46 -3.99 0.40 0.00 1.12 0.00 0.00 29.99 27.98 3cwc n HIS 277 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3cwc h LEU 278 N -1.90 0.55 -0.81 2.41 6.46 -1.52 -1.99 115.31 118.51 3cwc h LEU 278 Ca -0.60 -0.00 -0.12 0.00 -0.12 0.00 0.00 57.88 57.03 3cwc h LEU 278 Cb 1.37 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 41.16 3cwc h LEU 278 CO 0.63 0.37 -0.36 -0.08 -0.62 0.00 0.00 178.44 178.38 3cwc h GLU 279 N 0.63 0.47 -0.06 1.25 4.81 -1.88 -1.53 114.58 118.27 3cwc h GLU 279 Ca 0.24 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 3cwc h GLU 279 Cb 0.14 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.52 3cwc h GLU 279 CO -0.06 0.77 -0.24 0.00 -0.73 0.00 0.00 179.01 178.74 3cwc h ALA 280 N 1.22 0.11 -0.78 2.92 0.00 -1.76 -2.11 119.26 118.86 3cwc h ALA 280 Ca 0.04 -0.41 0.14 0.00 0.00 0.00 0.00 54.91 54.68 3cwc h ALA 280 Cb 0.82 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 3cwc h ALA 280 CO 0.07 0.11 0.35 0.00 0.00 0.00 0.00 179.25 179.78 3cwc h LEU 282 N 0.51 0.23 -1.39 0.00 4.07 -1.31 -2.89 115.31 114.53 3cwc h LEU 282 Ca 0.43 -0.23 -0.05 0.00 0.08 0.00 0.00 57.88 58.11 3cwc h LEU 282 Cb 0.63 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.28 3cwc h LEU 282 CO -0.38 1.11 -0.15 0.00 -1.08 0.00 0.00 178.44 177.94 3cwc h ALA 283 N 0.86 1.50 0.00 1.53 0.00 -1.14 -2.51 119.26 119.50 3cwc h ALA 283 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3cwc h ALA 283 Cb 1.72 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3cwc h ALA 283 CO 0.15 0.36 -0.63 0.22 0.00 0.00 0.00 179.25 179.35 3cwc h ASP 284 N 0.20 0.00 -4.14 0.00 1.82 -1.50 -3.48 116.42 109.32 3cwc h ASP 284 Ca 0.04 -0.12 -0.50 0.00 -0.39 0.00 0.00 57.03 56.06 3cwc h ASP 284 Cb 0.39 0.00 0.08 0.00 0.68 0.00 0.00 39.33 40.48 3cwc h ASP 284 CO 0.02 0.06 0.40 0.00 -1.61 0.00 0.00 179.24 178.11 3cwc s ALA 285 N -3.22 2.64 -0.16 -0.78 0.00 -0.95 -4.87 121.76 114.41 3cwc s ALA 285 Ca 0.05 0.63 0.18 0.00 0.00 0.00 0.00 51.96 52.82 3cwc s ALA 285 Cb 0.11 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 3cwc s ALA 285 CO 0.73 -0.92 0.99 -0.44 0.00 0.00 0.00 175.76 176.12 3cwc h ASP 286 N 0.68 0.00 -2.97 0.00 3.32 -0.94 -3.48 116.42 113.02 3cwc h ASP 286 Ca -0.48 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.57 3cwc h ASP 286 Cb 1.25 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.58 3cwc h ASP 286 CO 0.56 0.42 -0.03 -0.22 -1.72 0.00 0.00 179.24 178.25 3cwc s LEU 287 N -5.79 -0.86 -0.13 1.55 2.96 -1.02 -4.33 118.68 111.05 3cwc s LEU 287 Ca -0.01 1.44 0.01 0.00 -0.22 0.00 0.00 54.13 55.35 3cwc s LEU 287 Cb 0.09 2.25 -0.01 0.00 0.50 0.00 0.00 46.19 49.02 3cwc s LEU 287 CO 0.79 -0.23 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.74 3cwc s VAL 288 N 1.68 2.70 -0.09 1.68 1.01 -0.34 -1.22 120.40 125.82 3cwc s VAL 288 Ca -0.10 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.13 3cwc s VAL 288 Cb -0.06 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 3cwc s VAL 288 CO -0.19 0.53 -0.16 -0.63 0.00 0.00 0.00 175.10 174.64 3cwc s ILE 289 N 0.54 2.80 0.00 2.22 -1.09 -0.19 -1.38 121.20 124.10 3cwc s ILE 289 Ca -0.10 -0.78 0.00 0.00 -2.23 0.00 0.00 60.65 57.54 3cwc s ILE 289 Cb -0.16 -2.12 0.00 0.00 -1.58 0.00 0.00 42.46 38.60 3cwc s ILE 289 CO 0.04 0.55 0.00 1.07 -1.23 0.00 0.00 174.94 175.37 3cwc n THR 290 N 3.09 0.00 0.00 2.92 5.66 -0.13 -0.25 114.28 125.57 3cwc n THR 290 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 3cwc n THR 290 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 3cwc n THR 290 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3cwc n GLY 291 N 0.78 -0.22 3.62 1.09 0.00 -1.26 -0.73 105.19 108.47 3cwc n GLY 291 Ca 0.00 -1.23 -0.06 0.00 0.00 0.00 0.00 46.02 44.73 3cwc n GLY 291 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3cwc s GLU 292 N -2.00 0.96 -0.03 1.61 -1.05 -1.24 -0.73 118.70 116.21 3cwc s GLU 292 Ca 0.00 -0.45 0.04 0.00 -0.15 0.00 0.00 54.97 54.41 3cwc s GLU 292 Cb 0.00 0.38 -0.00 0.00 -0.44 0.00 0.00 34.13 34.06 3cwc s GLU 292 CO 0.00 -0.43 -0.14 0.20 0.95 0.00 0.00 175.26 175.84 3cwc s GLY 293 N -2.69 0.77 0.02 -3.83 0.00 0.25 -0.79 107.32 101.04 3cwc s GLY 293 Ca 0.09 -0.58 0.04 0.00 0.00 0.00 0.00 44.72 44.26 3cwc s GLY 293 CO -0.04 -0.33 -0.13 0.50 0.00 0.00 0.00 173.10 173.10 3cwc s ARG 294 N -0.03 0.94 0.00 2.90 1.81 -1.09 -1.84 118.95 121.64 3cwc s ARG 294 Ca -0.01 -0.62 0.24 0.00 -1.72 0.00 0.00 55.73 53.62 3cwc s ARG 294 Cb -0.09 -0.92 0.19 0.00 -0.45 0.00 0.00 34.95 33.68 3cwc s ARG 294 CO 0.01 0.24 1.21 0.44 -0.68 0.00 0.00 175.30 176.51 3cwc n ILE 295 N 2.27 0.00 -4.32 1.52 -5.35 -1.26 -3.88 119.36 108.34 3cwc n ILE 295 Ca -0.16 -0.20 -0.31 0.00 -0.27 0.00 0.00 62.75 61.81 3cwc n ILE 295 Cb 0.55 0.99 -0.10 0.00 -1.74 0.00 0.00 39.64 39.34 3cwc n ILE 295 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 3cwc s ASP 296 N -2.54 4.71 0.00 7.28 1.11 -1.26 -4.88 116.67 121.09 3cwc s ASP 296 Ca 0.19 -0.19 0.00 0.00 0.18 0.00 0.00 52.55 52.73 3cwc s ASP 296 Cb 0.18 -1.07 0.00 0.00 1.07 0.00 0.00 42.92 43.10 3cwc s ASP 296 CO 0.59 0.24 0.00 -0.24 1.18 0.00 0.00 175.17 176.93 3cwc n SER 297 N 1.14 0.00 0.00 0.27 2.88 -1.26 -5.09 113.62 111.55 3cwc n SER 297 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 3cwc n SER 297 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 3cwc n SER 297 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3cwc n GLY 302 N 0.00 -1.21 0.23 0.46 0.00 -1.26 -5.17 105.19 98.24 3cwc n GLY 302 Ca 0.00 0.38 0.06 0.00 0.00 0.00 0.00 46.02 46.45 3cwc n GLY 302 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cwc h LYS 303 N 0.00 0.00 0.33 1.61 1.57 -2.01 -3.22 116.57 114.85 3cwc h LYS 303 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3cwc h LYS 303 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3cwc h LYS 303 CO 0.00 0.18 -0.16 0.28 -0.57 0.00 0.00 179.45 179.18 3cwc h VAL 304 N 0.00 0.00 -0.84 0.50 2.07 -1.94 -0.49 116.25 115.56 3cwc h VAL 304 Ca -0.00 -0.54 0.15 0.00 0.82 0.00 0.00 66.70 67.13 3cwc h VAL 304 Cb 0.33 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.04 3cwc h VAL 304 CO 0.02 0.00 0.55 -0.65 0.02 0.00 0.00 177.57 177.51 3cwc h PRO 305 N -0.98 0.56 -0.05 1.57 0.11 -1.81 0.08 132.00 131.48 3cwc h PRO 305 Ca -0.05 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.82 3cwc h PRO 305 Cb 0.34 -0.13 0.01 0.00 0.11 0.00 0.00 31.00 31.34 3cwc h PRO 305 CO 0.07 0.37 -0.80 0.82 -0.21 0.00 0.00 178.00 178.25 3cwc h ILE 306 N 0.57 1.33 -0.59 4.15 1.08 -1.62 -0.62 117.51 121.81 3cwc h ILE 306 Ca 0.42 -2.08 0.08 0.00 -0.39 0.00 0.00 64.86 62.88 3cwc h ILE 306 Cb 0.78 2.32 -0.06 0.00 -3.07 0.00 0.00 36.82 36.79 3cwc h ILE 306 CO -0.17 0.64 0.26 1.23 -0.69 0.00 0.00 178.15 179.42 3cwc h GLY 307 N 0.27 0.84 0.64 5.37 0.00 -0.26 -0.52 103.07 109.40 3cwc h GLY 307 Ca -0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 3cwc h GLY 307 CO 0.16 0.04 -0.04 -2.08 0.00 0.00 0.00 176.54 174.63 3cwc h VAL 308 N 0.48 1.13 -0.49 4.60 2.07 -0.97 -3.03 116.25 120.04 3cwc h VAL 308 Ca 0.28 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 67.02 3cwc h VAL 308 Cb 0.29 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 3cwc h VAL 308 CO -0.25 0.19 0.32 0.00 0.02 0.00 0.00 177.57 177.86 3cwc h ALA 309 N 0.42 1.66 -0.23 1.67 0.00 -0.96 -1.54 119.26 120.29 3cwc h ALA 309 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3cwc h ALA 309 Cb 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3cwc h ALA 309 CO 0.02 0.31 0.12 -0.91 0.00 0.00 0.00 179.25 178.79 3cwc h ASN 310 N 0.65 0.29 0.84 0.00 2.35 -1.05 -0.25 115.58 118.41 3cwc h ASN 310 Ca 0.18 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 3cwc h ASN 310 Cb -0.06 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.24 3cwc h ASN 310 CO -0.04 0.29 -0.45 0.40 -1.65 0.00 0.00 177.43 175.98 3cwc h ILE 311 N 0.26 0.00 -0.87 2.81 2.04 -1.36 -2.99 117.51 117.41 3cwc h ILE 311 Ca 0.08 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.13 3cwc h ILE 311 Cb 0.07 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 35.99 3cwc h ILE 311 CO -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 178.15 177.98 3cwc h ALA 312 N -1.34 0.67 -0.18 1.87 0.00 -1.23 -0.71 119.26 118.33 3cwc h ALA 312 Ca -0.11 0.32 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 3cwc h ALA 312 Cb 0.93 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 3cwc h ALA 312 CO 0.16 -0.42 -0.26 0.87 0.00 0.00 0.00 179.25 179.60 3cwc h LYS 313 N 0.01 0.34 -1.04 0.00 1.79 -1.08 -0.36 116.57 116.23 3cwc h LYS 313 Ca 0.44 -0.12 0.27 0.00 -2.18 0.00 0.00 60.65 59.05 3cwc h LYS 313 Cb 0.72 -0.02 -0.10 0.00 -1.58 0.00 0.00 32.23 31.25 3cwc h LYS 313 CO -0.86 0.58 0.67 -0.09 -1.08 0.00 0.00 179.45 178.66 3cwc h ARG 314 N 0.30 0.39 -0.58 3.15 2.43 -0.97 -0.57 114.38 118.53 3cwc h ARG 314 Ca 0.05 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3cwc h ARG 314 Cb 0.62 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 3cwc h ARG 314 CO 0.04 0.26 0.00 0.66 -1.51 0.00 0.00 179.97 179.42 3cwc n TYR 315 N -4.65 1.37 -3.87 2.20 4.01 -0.57 -4.97 117.16 110.69 3cwc n TYR 315 Ca 0.26 -0.63 -0.29 0.00 -0.16 0.00 0.00 57.90 57.07 3cwc n TYR 315 Cb 0.87 -0.24 0.03 0.00 -0.31 0.00 0.00 39.34 39.69 3cwc n TYR 315 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3cwc n ASN 316 N 0.90 -4.57 -4.81 7.72 4.13 -0.22 -4.99 115.26 113.41 3cwc n ASN 316 Ca 0.24 -0.76 -0.37 0.00 1.68 0.00 0.00 54.58 55.37 3cwc n ASN 316 Cb 0.87 -3.99 -0.07 0.00 -1.54 0.00 0.00 39.78 35.05 3cwc n ASN 316 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3cwc s LYS 317 N -6.54 3.89 0.21 3.52 -0.14 -0.25 -4.99 119.74 115.45 3cwc s LYS 317 Ca 0.59 0.07 -0.31 0.00 -1.36 0.00 0.00 55.97 54.96 3cwc s LYS 317 Cb -0.29 -3.29 -0.10 0.00 -1.68 0.00 0.00 37.83 32.46 3cwc s LYS 317 CO 0.82 0.54 1.53 -1.25 -0.76 0.00 0.00 175.35 176.24 3cwc s PRO 318 N -0.44 4.22 -0.09 -1.68 0.04 -1.26 -4.37 135.00 131.41 3cwc s PRO 318 Ca 0.17 2.38 0.01 0.00 0.04 0.00 0.00 61.00 63.60 3cwc s PRO 318 Cb -0.13 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.31 3cwc s PRO 318 CO 0.06 -0.55 -0.10 0.54 0.04 0.00 0.00 177.00 176.98 3cwc s VAL 319 N 0.59 1.12 -0.07 -0.36 0.11 -1.26 -1.20 120.40 119.34 3cwc s VAL 319 Ca 0.66 -0.40 0.05 0.00 -2.93 0.00 0.00 61.98 59.35 3cwc s VAL 319 Cb -0.44 -1.08 -0.01 0.00 -1.53 0.00 0.00 36.38 33.32 3cwc s VAL 319 CO 0.38 0.37 -0.22 -0.63 -3.33 0.00 0.00 175.10 171.67 3cwc s ILE 320 N 1.21 2.33 0.01 7.04 1.01 -0.48 -0.43 121.20 131.90 3cwc s ILE 320 Ca -0.04 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.65 3cwc s ILE 320 Cb -0.14 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 3cwc s ILE 320 CO -0.03 0.57 0.06 -0.83 0.00 0.00 0.00 174.94 174.70 3cwc s GLY 321 N -0.16 1.98 -0.29 6.18 0.00 -0.32 -0.96 107.32 113.75 3cwc s GLY 321 Ca -0.03 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.80 3cwc s GLY 321 CO 0.04 -0.81 -0.02 -0.42 0.00 0.00 0.00 173.10 171.89 3cwc s ILE 322 N -1.19 2.03 -0.20 0.90 1.01 0.09 -1.32 121.20 122.52 3cwc s ILE 322 Ca 0.23 -1.86 -0.05 0.00 0.00 0.00 0.00 60.65 58.97 3cwc s ILE 322 Cb -0.12 -2.34 -0.02 0.00 0.01 0.00 0.00 42.46 39.99 3cwc s ILE 322 CO 0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 174.94 174.74 3cwc s ALA 323 N 1.09 2.97 0.23 9.38 0.00 0.57 -3.64 121.76 132.36 3cwc s ALA 323 Ca 0.01 -1.02 -0.10 0.00 0.00 0.00 0.00 51.96 50.85 3cwc s ALA 323 Cb -0.19 -1.74 -0.07 0.00 0.00 0.00 0.00 23.12 21.12 3cwc s ALA 323 CO -0.08 -0.19 0.55 0.20 0.00 0.00 0.00 175.76 176.25 3cwc s GLY 324 N 1.07 2.28 0.21 0.00 0.00 0.03 -0.50 107.32 110.42 3cwc s GLY 324 Ca 0.02 -0.26 -0.23 0.00 0.00 0.00 0.00 44.72 44.25 3cwc s GLY 324 CO 0.01 -0.12 0.80 -1.35 0.00 0.00 0.00 173.10 172.44 3cwc s SER 325 N -2.36 -0.26 0.16 1.64 1.04 -0.68 -2.66 113.70 110.58 3cwc s SER 325 Ca 0.48 -0.46 0.16 0.00 0.48 0.00 0.00 55.95 56.60 3cwc s SER 325 Cb -0.11 0.62 -0.05 0.00 0.10 0.00 0.00 66.02 66.58 3cwc s SER 325 CO 0.21 -1.13 1.09 -0.07 0.98 0.00 0.00 173.24 174.32 3cwc h LEU 326 N 2.00 0.00 0.00 2.42 -0.00 -1.74 -0.48 115.31 117.51 3cwc h LEU 326 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.66 3cwc h LEU 326 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.91 3cwc h LEU 326 CO 0.25 0.51 0.00 0.35 -0.00 0.00 0.00 178.44 179.55 3cwc n THR 327 N -3.01 0.00 0.09 0.22 -2.24 -1.26 -4.72 114.28 103.36 3cwc n THR 327 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3cwc n THR 327 Cb 0.78 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 3cwc n THR 327 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3cwc n HIS 336 N -0.17 -1.20 1.41 4.78 -0.00 -1.26 -4.94 115.22 113.83 3cwc n HIS 336 Ca 0.00 0.21 0.06 0.00 0.46 0.00 0.00 57.72 58.45 3cwc n HIS 336 Cb 0.00 0.27 0.23 0.00 -0.12 0.00 0.00 29.99 30.38 3cwc n HIS 336 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3cwc n GLY 337 N 2.58 -0.10 3.70 1.57 0.00 -1.26 -4.89 105.19 106.80 3cwc n GLY 337 Ca 0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 3cwc n GLY 337 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cwc s LEU 338 N -1.23 4.31 0.36 0.99 1.43 -1.26 -4.83 118.68 118.46 3cwc s LEU 338 Ca 0.21 1.39 0.05 0.00 -1.03 0.00 0.00 54.13 54.75 3cwc s LEU 338 Cb 0.11 -3.33 0.73 0.00 0.03 0.00 0.00 46.19 43.73 3cwc s LEU 338 CO 0.15 -0.24 1.98 0.44 0.23 0.00 0.00 176.35 178.91 3cwc h ASP 339 N 6.89 0.66 -4.45 2.29 5.19 -1.09 -3.45 116.42 122.47 3cwc h ASP 339 Ca -0.38 -0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.03 3cwc h ASP 339 Cb 1.19 -0.15 -0.21 0.00 0.18 0.00 0.00 39.33 40.34 3cwc h ASP 339 CO 0.77 0.45 0.35 0.00 -3.12 0.00 0.00 179.24 177.69 3cwc s ALA 340 N -5.67 -1.85 -0.00 3.45 0.00 -1.21 -5.03 121.76 111.45 3cwc s ALA 340 Ca -0.10 1.52 0.01 0.00 0.00 0.00 0.00 51.96 53.40 3cwc s ALA 340 Cb 0.19 -0.47 -0.00 0.00 0.00 0.00 0.00 23.12 22.83 3cwc s ALA 340 CO 0.77 -0.33 -0.05 0.54 0.00 0.00 0.00 175.76 176.69 3cwc s VAL 341 N -0.94 0.37 0.04 0.00 0.11 -1.26 -1.17 120.40 117.53 3cwc s VAL 341 Ca -0.06 -0.19 0.07 0.00 -2.93 0.00 0.00 61.98 58.88 3cwc s VAL 341 Cb -0.01 -0.32 -0.02 0.00 -1.53 0.00 0.00 36.38 34.50 3cwc s VAL 341 CO 0.05 0.11 -0.21 -0.36 -3.33 0.00 0.00 175.10 171.36 3cwc s PHE 342 N -0.07 1.84 0.02 1.54 0.40 -0.43 -4.97 117.98 116.30 3cwc s PHE 342 Ca 0.01 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 55.98 3cwc s PHE 342 Cb -0.02 -1.11 -0.04 0.00 0.51 0.00 0.00 43.02 42.36 3cwc s PHE 342 CO -0.00 0.08 0.08 0.45 0.70 0.00 0.00 175.22 176.52 3cwc s SER 343 N -1.09 5.62 -0.06 1.36 0.15 -1.26 -0.31 113.70 118.09 3cwc s SER 343 Ca 0.08 0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.86 3cwc s SER 343 Cb -0.09 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.64 3cwc s SER 343 CO 0.01 0.25 -0.18 -0.69 1.20 0.00 0.00 173.24 173.83 3cwc s VAL 344 N -1.24 1.54 -0.02 4.45 1.01 0.34 -4.89 120.40 121.59 3cwc s VAL 344 Ca 0.24 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.30 3cwc s VAL 344 Cb -0.12 -1.34 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 3cwc s VAL 344 CO 0.16 0.44 0.50 -0.63 0.00 0.00 0.00 175.10 175.58 3cwc s ILE 345 N 0.27 4.99 0.32 2.22 1.09 -1.26 -1.69 121.20 127.14 3cwc s ILE 345 Ca -0.10 1.04 0.03 0.00 -1.10 0.00 0.00 60.65 60.52 3cwc s ILE 345 Cb -0.14 -3.83 -0.05 0.00 -1.06 0.00 0.00 42.46 37.38 3cwc s ILE 345 CO 0.04 0.46 0.11 -0.72 -0.10 0.00 0.00 174.94 174.73 3cwc s TYR 346 N -0.38 1.73 0.28 3.97 1.13 -0.19 -4.86 117.35 119.03 3cwc s TYR 346 Ca 0.27 -1.18 0.10 0.00 -1.41 0.00 0.00 57.07 54.85 3cwc s TYR 346 Cb -0.17 -1.06 -0.05 0.00 -1.10 0.00 0.00 41.96 39.57 3cwc s TYR 346 CO 0.14 -0.27 -0.15 0.95 -2.51 0.00 0.00 175.55 173.72 3cwc s THR 347 N -3.46 2.15 0.53 -3.49 -4.23 -1.26 -4.24 115.64 101.63 3cwc s THR 347 Ca 0.34 -2.28 -0.22 0.00 -1.18 0.00 0.00 61.69 58.34 3cwc s THR 347 Cb 0.06 -2.33 -0.06 0.00 1.34 0.00 0.00 72.50 71.51 3cwc s THR 347 CO 0.15 -0.39 1.29 2.30 -0.54 0.00 0.00 174.62 177.43 3cwc n ILE 348 N -0.60 3.54 0.64 2.99 -5.35 -1.26 -4.78 119.36 114.54 3cwc n ILE 348 Ca -0.06 -0.50 0.04 0.00 -0.27 0.00 0.00 62.75 61.96 3cwc n ILE 348 Cb 0.61 -1.58 0.16 0.00 -1.74 0.00 0.00 39.64 37.09 3cwc n ILE 348 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3cwc h THR 350 N 1.80 0.98 -3.95 0.00 1.35 -1.90 -3.44 112.91 107.75 3cwc h THR 350 Ca 0.00 -1.57 -0.50 0.00 -0.55 0.00 0.00 66.41 63.79 3cwc h THR 350 Cb 0.74 1.93 0.05 0.00 -1.73 0.00 0.00 68.15 69.13 3cwc h THR 350 CO 0.09 0.40 0.48 -0.76 -0.25 0.00 0.00 175.52 175.48 3cwc s LEU 351 N -7.22 4.17 0.16 3.87 2.01 -1.23 -4.97 118.68 115.46 3cwc s LEU 351 Ca -0.00 2.28 -0.16 0.00 0.01 0.00 0.00 54.13 56.26 3cwc s LEU 351 Cb 0.11 -4.07 0.09 0.00 0.01 0.00 0.00 46.19 42.33 3cwc s LEU 351 CO 0.70 -0.66 1.71 -0.08 1.01 0.00 0.00 176.35 179.03 3cwc h GLU 352 N 2.56 0.14 -0.58 1.70 4.57 -1.93 -2.65 114.58 118.39 3cwc h GLU 352 Ca -0.49 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 3cwc h GLU 352 Cb 1.23 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 3cwc h GLU 352 CO 0.62 0.10 0.00 -0.25 -1.18 0.00 0.00 179.01 178.30 3cwc n ASP 353 N -5.14 5.21 0.03 1.04 9.92 -1.26 -4.67 116.55 121.69 3cwc n ASP 353 Ca 0.02 -2.75 -0.17 0.00 -0.53 0.00 0.00 54.79 51.36 3cwc n ASP 353 Cb 0.18 -0.63 -0.08 0.00 -0.64 0.00 0.00 41.12 39.96 3cwc n ASP 353 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3cwc h ALA 354 N 3.84 0.25 -0.21 2.24 0.00 -1.78 -0.79 119.26 122.80 3cwc h ALA 354 Ca 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 54.91 54.19 3cwc h ALA 354 Cb 1.73 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 3cwc h ALA 354 CO 0.37 0.72 -0.06 -0.07 0.00 0.00 0.00 179.25 180.21 3cwc h LEU 355 N 0.39 0.42 -0.28 0.00 3.38 -1.83 -2.40 115.31 114.98 3cwc h LEU 355 Ca -0.10 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.51 3cwc h LEU 355 Cb 1.58 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.20 3cwc h LEU 355 CO 0.18 0.69 0.17 0.50 0.09 0.00 0.00 178.44 180.08 3cwc h LYS 356 N 0.14 0.35 -0.56 1.13 1.63 -1.87 -1.59 116.57 115.80 3cwc h LYS 356 Ca 0.05 -0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 59.76 3cwc h LYS 356 Cb 0.51 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 3cwc h LYS 356 CO 0.02 0.23 0.06 -0.91 -3.45 0.00 0.00 179.45 175.41 3cwc h ASN 357 N 0.36 0.87 -0.24 4.20 2.35 -1.18 -0.59 115.58 121.35 3cwc h ASN 357 Ca 0.11 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 3cwc h ASN 357 Cb -0.02 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 3cwc h ASN 357 CO -0.04 0.90 0.02 0.00 -1.65 0.00 0.00 177.43 176.66 3cwc h ALA 358 N 1.20 0.33 -0.52 -0.83 0.00 -1.36 -0.79 119.26 117.29 3cwc h ALA 358 Ca 0.17 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3cwc h ALA 358 Cb 0.42 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3cwc h ALA 358 CO 0.01 0.03 0.33 1.03 0.00 0.00 0.00 179.25 180.65 3cwc h SER 359 N 0.21 0.56 -0.79 0.00 0.87 -1.11 -1.32 113.55 111.96 3cwc h SER 359 Ca 0.07 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 3cwc h SER 359 Cb 0.36 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.16 3cwc h SER 359 CO 0.01 0.40 0.44 -0.33 -0.53 0.00 0.00 176.83 176.82 3cwc h GLU 360 N 0.67 1.09 -0.36 2.24 5.08 -1.01 -0.95 114.58 121.34 3cwc h GLU 360 Ca 0.20 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 3cwc h GLU 360 Cb -0.03 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 3cwc h GLU 360 CO -0.07 0.79 -0.01 -0.91 -1.00 0.00 0.00 179.01 177.82 3cwc h ASN 361 N 1.09 0.64 -0.61 1.42 2.35 -0.98 -2.93 115.58 116.55 3cwc h ASN 361 Ca 0.28 -0.32 0.04 0.00 -0.55 0.00 0.00 56.30 55.75 3cwc h ASN 361 Cb 0.01 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.17 3cwc h ASN 361 CO -0.05 0.80 0.36 0.58 -1.65 0.00 0.00 177.43 177.47 3cwc h VAL 362 N 0.46 1.04 0.00 2.81 2.07 -1.21 -2.04 116.25 119.38 3cwc h VAL 362 Ca 0.10 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3cwc h VAL 362 Cb 0.48 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3cwc h VAL 362 CO 0.02 0.13 0.00 -1.14 0.02 0.00 0.00 177.57 176.60 3cwc n ARG 363 N -4.76 0.04 0.00 1.57 0.63 -0.37 -1.08 116.66 112.69 3cwc n ARG 363 Ca 0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 3cwc n ARG 363 Cb 0.11 -1.01 0.00 0.00 0.45 0.00 0.00 32.46 32.01 3cwc n ARG 363 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 3cwc n THR 365 N 0.12 0.00 -0.24 5.15 -1.04 -0.77 -1.25 114.28 116.25 3cwc n THR 365 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 3cwc n THR 365 Cb 0.01 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.57 3cwc n THR 365 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3cwc h ALA 366 N 0.00 0.87 -0.82 2.41 0.00 -1.36 -0.41 119.26 119.94 3cwc h ALA 366 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.91 3cwc h ALA 366 Cb 0.00 -0.27 -0.07 0.00 0.00 0.00 0.00 17.79 17.45 3cwc h ALA 366 CO 0.00 0.33 0.49 -0.09 0.00 0.00 0.00 179.25 179.98 3cwc h ARG 367 N 0.93 0.83 -0.01 0.00 2.43 -1.30 0.13 114.38 117.39 3cwc h ARG 367 Ca 0.25 -0.05 -0.18 0.00 -0.81 0.00 0.00 59.98 59.19 3cwc h ARG 367 Cb -0.05 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.30 3cwc h ARG 367 CO -0.05 0.55 -0.82 -0.91 -1.51 0.00 0.00 179.97 177.24 3cwc h ASN 368 N 0.86 0.17 0.01 -3.80 2.35 -1.66 -0.19 115.58 113.32 3cwc h ASN 368 Ca 0.38 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3cwc h ASN 368 Cb 0.26 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.58 3cwc h ASN 368 CO -0.21 0.91 -0.01 0.58 -1.65 0.00 0.00 177.43 177.06 3cwc h VAL 369 N 0.08 1.06 -0.61 2.81 2.07 -0.68 -1.46 116.25 119.52 3cwc h VAL 369 Ca -0.03 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.31 3cwc h VAL 369 Cb 1.42 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.36 3cwc h VAL 369 CO 0.12 0.06 0.36 0.00 0.02 0.00 0.00 177.57 178.12 3cwc h ALA 370 N 0.88 0.79 -0.59 1.67 0.00 -0.59 -0.50 119.26 120.93 3cwc h ALA 370 Ca -0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3cwc h ALA 370 Cb 0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3cwc h ALA 370 CO 0.00 0.07 0.17 0.00 0.00 0.00 0.00 179.25 179.49 3cwc h ALA 371 N 1.28 1.19 -0.21 0.00 0.00 -0.97 -1.30 119.26 119.26 3cwc h ALA 371 Ca 0.25 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3cwc h ALA 371 Cb 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3cwc h ALA 371 CO -0.13 0.56 -0.22 1.15 0.00 0.00 0.00 179.25 180.62 3cwc h THR 372 N 0.87 1.33 -0.57 0.00 2.02 -0.62 -1.52 112.91 114.42 3cwc h THR 372 Ca 0.19 -1.38 0.05 0.00 0.77 0.00 0.00 66.41 66.04 3cwc h THR 372 Cb 0.27 1.75 -0.05 0.00 -1.74 0.00 0.00 68.15 68.39 3cwc h THR 372 CO -0.01 0.42 0.31 -0.07 0.37 0.00 0.00 175.52 176.54 3cwc h LEU 373 N 0.19 0.45 0.08 2.58 3.38 -1.01 -1.63 115.31 119.35 3cwc h LEU 373 Ca 0.03 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3cwc h LEU 373 Cb 0.77 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3cwc h LEU 373 CO 0.05 0.30 -0.04 0.50 0.09 0.00 0.00 178.44 179.35 3cwc h LYS 374 N 0.58 -0.10 -0.90 1.13 3.64 -1.18 -1.96 116.57 117.77 3cwc h LYS 374 Ca 0.25 0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.80 3cwc h LYS 374 Cb 0.14 0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 31.88 3cwc h LYS 374 CO -0.16 -0.06 0.49 0.00 -2.27 0.00 0.00 179.45 177.45 3cwc h ALA 375 N 0.82 1.41 -0.39 5.00 0.00 -1.17 -2.38 119.26 122.55 3cwc h ALA 375 Ca -0.01 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3cwc h ALA 375 Cb 0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3cwc h ALA 375 CO 0.02 -0.08 0.03 0.78 0.00 0.00 0.00 179.25 180.00 3cwc h GLY 376 N 0.66 0.64 0.70 0.00 0.00 -1.01 -2.12 103.07 101.95 3cwc h GLY 376 Ca 0.50 -0.37 0.09 0.00 0.00 0.00 0.00 47.33 47.55 3cwc h GLY 376 CO -0.38 0.35 0.61 1.46 0.00 0.00 0.00 176.54 178.59 3cwc h GLN 377 N 0.57 1.00 -0.01 4.80 4.20 -0.83 -2.37 115.11 122.48 3cwc h GLN 377 Ca 0.12 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3cwc h GLN 377 Cb 0.32 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.87 3cwc h GLN 377 CO 0.01 0.66 -0.14 0.00 -0.67 0.00 0.00 178.83 178.69 3cwc n GLN 378 N -4.53 1.37 -2.32 1.46 10.64 -0.83 -4.63 117.38 118.54 3cwc n GLN 378 Ca 0.16 -0.88 -0.37 0.00 -1.83 0.00 0.00 57.00 54.07 3cwc n GLN 378 Cb 0.26 -1.48 -0.03 0.00 -0.86 0.00 0.00 30.24 28.12 3cwc n GLN 378 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3cwc s LEU 379 N -2.24 3.28 0.00 2.61 1.43 -0.89 -5.11 118.68 117.76 3cwc s LEU 379 Ca 0.30 -0.58 0.27 0.00 -1.03 0.00 0.00 54.13 53.09 3cwc s LEU 379 Cb 0.20 -2.56 0.82 0.00 0.03 0.00 0.00 46.19 44.69 3cwc s LEU 379 CO 0.42 -2.08 1.62 0.54 0.23 0.00 0.00 176.35 177.08