#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwc s ALA 19 N 0.00 3.39 -0.03 3.52 0.00 -1.05 -4.89 121.76 122.72 1bwc s ALA 19 Ca 0.00 0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.19 1bwc s ALA 19 Cb 0.00 -2.82 -0.02 0.00 0.00 0.00 0.00 23.12 20.28 1bwc s ALA 19 CO 0.00 0.32 -0.25 -1.12 0.00 0.00 0.00 175.76 174.71 1bwc s SER 20 N -1.74 2.99 0.24 0.00 0.01 -1.26 -1.27 113.70 112.68 1bwc s SER 20 Ca 0.45 -0.47 0.03 0.00 1.31 0.00 0.00 55.95 57.27 1bwc s SER 20 Cb -0.16 -0.41 -0.05 0.00 0.21 0.00 0.00 66.02 65.61 1bwc s SER 20 CO 0.21 0.30 0.03 -0.31 0.41 0.00 0.00 173.24 173.88 1bwc s TYR 21 N -0.53 1.56 0.24 2.43 2.02 -0.69 -4.99 117.35 117.39 1bwc s TYR 21 Ca 0.08 -1.02 0.03 0.00 -0.37 0.00 0.00 57.07 55.79 1bwc s TYR 21 Cb -0.10 -0.92 0.27 0.00 -0.40 0.00 0.00 41.96 40.80 1bwc s TYR 21 CO -0.00 -0.15 1.58 -0.44 -1.57 0.00 0.00 175.55 174.97 1bwc h ASP 22 N 2.43 0.33 -2.44 2.29 3.32 -1.46 -3.35 116.42 117.54 1bwc h ASP 22 Ca -0.38 -0.18 -0.18 0.00 0.02 0.00 0.00 57.03 56.31 1bwc h ASP 22 Cb 1.23 -0.09 -0.31 0.00 0.22 0.00 0.00 39.33 40.38 1bwc h ASP 22 CO 0.64 0.81 -0.49 -0.47 -1.72 0.00 0.00 179.24 178.02 1bwc s TYR 23 N -3.89 -0.62 -0.19 4.55 5.04 -0.89 -3.67 117.35 117.69 1bwc s TYR 23 Ca -0.05 0.98 -0.05 0.00 -2.44 0.00 0.00 57.07 55.51 1bwc s TYR 23 Cb 0.12 0.03 -0.03 0.00 0.35 0.00 0.00 41.96 42.43 1bwc s TYR 23 CO 0.80 -0.53 0.00 -1.17 -1.34 0.00 0.00 175.55 173.31 1bwc s LEU 24 N 2.50 3.35 -0.18 6.97 2.96 -0.60 -0.96 118.68 132.72 1bwc s LEU 24 Ca 0.05 -0.14 -0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1bwc s LEU 24 Cb -0.13 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.72 1bwc s LEU 24 CO -0.12 0.11 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.18 1bwc s VAL 25 N 0.75 2.58 -0.45 1.68 1.01 0.34 -0.84 120.40 125.47 1bwc s VAL 25 Ca 0.00 -0.78 -0.18 0.00 0.00 0.00 0.00 61.98 61.02 1bwc s VAL 25 Cb -0.14 -2.11 0.03 0.00 0.00 0.00 0.00 36.38 34.16 1bwc s VAL 25 CO 0.02 0.50 0.52 -0.63 0.00 0.00 0.00 175.10 175.52 1bwc s ILE 26 N 1.14 4.99 0.00 2.22 1.01 0.53 -0.39 121.20 130.69 1bwc s ILE 26 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1bwc s ILE 26 Cb -0.14 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.19 1bwc s ILE 26 CO -0.06 -0.56 0.00 0.61 0.00 0.00 0.00 174.94 174.94 1bwc n GLY 27 N 5.11 2.12 2.58 6.18 0.00 0.27 -0.42 105.19 121.02 1bwc n GLY 27 Ca -0.06 -1.10 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 1bwc n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwc n GLY 28 N 1.62 5.77 0.00 -0.02 0.00 -1.23 -4.10 105.19 107.24 1bwc n GLY 28 Ca 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 46.02 43.58 1bwc n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwc n GLY 29 N -0.71 1.65 0.24 -0.02 0.00 -1.26 -0.75 105.19 104.33 1bwc n GLY 29 Ca 0.56 -1.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.61 1bwc n GLY 29 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1bwc h SER 30 N 0.00 -0.49 -0.40 1.61 0.02 -1.92 -0.98 113.55 111.39 1bwc h SER 30 Ca 0.00 0.03 -0.14 0.00 -0.84 0.00 0.00 61.79 60.84 1bwc h SER 30 Cb 0.00 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1bwc h SER 30 CO 0.00 -0.32 -0.28 1.23 -1.14 0.00 0.00 176.83 176.32 1bwc h GLY 31 N -0.50 0.99 0.68 -3.77 0.00 -1.87 -2.59 103.07 96.00 1bwc h GLY 31 Ca -0.04 -0.95 -0.00 0.00 0.00 0.00 0.00 47.33 46.35 1bwc h GLY 31 CO 0.04 0.86 -0.02 -1.33 0.00 0.00 0.00 176.54 176.09 1bwc h GLY 32 N 0.73 -0.06 1.06 4.60 0.00 -1.67 -2.34 103.07 105.38 1bwc h GLY 32 Ca 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.39 1bwc h GLY 32 CO 0.08 -0.02 0.31 1.41 0.00 0.00 0.00 176.54 178.31 1bwc h LEU 33 N -0.39 1.10 -1.08 3.11 3.38 -1.27 -0.63 115.31 119.53 1bwc h LEU 33 Ca -0.01 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 57.84 1bwc h LEU 33 Cb 0.35 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 1bwc h LEU 33 CO 0.01 0.98 0.62 0.00 0.09 0.00 0.00 178.44 180.14 1bwc h ALA 34 N 1.17 1.43 0.13 1.53 0.00 -1.39 -1.90 119.26 120.24 1bwc h ALA 34 Ca 0.26 -0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.84 1bwc h ALA 34 Cb 0.23 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1bwc h ALA 34 CO -0.02 0.44 -1.53 1.03 0.00 0.00 0.00 179.25 179.18 1bwc h SER 35 N 1.14 0.43 -0.64 0.00 0.87 -0.97 -2.83 113.55 111.55 1bwc h SER 35 Ca 0.40 -0.88 0.14 0.00 -1.23 0.00 0.00 61.79 60.22 1bwc h SER 35 Cb 0.12 -0.14 -0.11 0.00 -0.44 0.00 0.00 62.40 61.83 1bwc h SER 35 CO -0.14 1.67 0.02 0.00 -0.53 0.00 0.00 176.83 177.85 1bwc h ALA 36 N -0.01 0.65 0.00 6.23 0.00 -1.14 -1.73 119.26 123.26 1bwc h ALA 36 Ca -0.32 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1bwc h ALA 36 Cb 1.85 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.97 1bwc h ALA 36 CO 0.08 -0.39 -0.00 0.00 0.00 0.00 0.00 179.25 178.94 1bwc h ARG 37 N 0.13 -0.00 -0.59 0.00 3.08 -1.38 -1.64 114.38 113.97 1bwc h ARG 37 Ca 0.34 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 1bwc h ARG 37 Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 1bwc h ARG 37 CO -0.54 0.25 0.33 -0.09 -1.07 0.00 0.00 179.97 178.85 1bwc h ARG 38 N -0.25 0.82 -0.93 0.04 9.65 -1.46 -1.01 114.38 121.23 1bwc h ARG 38 Ca -0.00 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.78 1bwc h ARG 38 Cb 0.25 -0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.62 1bwc h ARG 38 CO 0.00 0.61 0.55 0.00 2.80 0.00 0.00 179.97 183.93 1bwc h ALA 39 N 1.16 1.18 -0.05 2.80 0.00 -1.26 -0.86 119.26 122.24 1bwc h ALA 39 Ca 0.21 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1bwc h ALA 39 Cb 0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 1bwc h ALA 39 CO -0.04 0.65 0.03 0.00 0.00 0.00 0.00 179.25 179.89 1bwc h ALA 40 N 1.30 0.07 -0.89 0.00 0.00 -0.84 0.13 119.26 119.03 1bwc h ALA 40 Ca 0.33 -0.05 0.24 0.00 0.00 0.00 0.00 54.91 55.43 1bwc h ALA 40 Cb -0.04 -0.02 -0.14 0.00 0.00 0.00 0.00 17.79 17.59 1bwc h ALA 40 CO -0.06 -0.38 0.31 0.93 0.00 0.00 0.00 179.25 180.04 1bwc h GLU 41 N -0.01 0.26 -0.00 0.00 5.08 -0.79 0.14 114.58 119.24 1bwc h GLU 41 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bwc h GLU 41 Cb 0.10 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1bwc h GLU 41 CO -0.00 0.17 -0.02 1.28 -1.00 0.00 0.00 179.01 179.44 1bwc n LEU 42 N -5.17 0.39 0.00 1.33 4.77 -0.36 -4.89 117.00 113.07 1bwc n LEU 42 Ca 0.23 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1bwc n LEU 42 Cb 0.71 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1bwc n LEU 42 CO 0.08 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 1bwc n GLY 43 N 1.11 1.14 3.86 -0.72 0.00 0.48 -4.90 105.19 106.16 1bwc n GLY 43 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1bwc n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwc s ALA 44 N -2.00 3.18 -0.44 4.61 0.00 -0.09 -4.99 121.76 122.03 1bwc s ALA 44 Ca 0.00 -0.06 -0.17 0.00 0.00 0.00 0.00 51.96 51.74 1bwc s ALA 44 Cb 0.00 -2.95 0.04 0.00 0.00 0.00 0.00 23.12 20.20 1bwc s ALA 44 CO 0.00 -0.32 0.42 0.50 0.00 0.00 0.00 175.76 176.36 1bwc s ARG 45 N -4.39 3.05 0.09 0.00 3.52 -1.26 -4.29 118.95 115.66 1bwc s ARG 45 Ca 0.55 -0.95 0.09 0.00 -0.13 0.00 0.00 55.73 55.29 1bwc s ARG 45 Cb -0.10 -4.02 -0.04 0.00 -1.56 0.00 0.00 34.95 29.23 1bwc s ARG 45 CO 0.39 -0.91 -0.23 0.00 -0.81 0.00 0.00 175.30 173.74 1bwc s ALA 46 N 2.00 2.47 0.02 6.12 0.00 -1.26 -1.15 121.76 129.96 1bwc s ALA 46 Ca 0.09 -1.34 0.04 0.00 0.00 0.00 0.00 51.96 50.76 1bwc s ALA 46 Cb -0.19 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.37 1bwc s ALA 46 CO 0.11 0.56 -0.13 0.00 0.00 0.00 0.00 175.76 176.30 1bwc s ALA 47 N -0.99 1.11 -0.15 0.00 0.00 -0.13 -1.88 121.76 119.72 1bwc s ALA 47 Ca 0.15 -0.72 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 1bwc s ALA 47 Cb -0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 1bwc s ALA 47 CO 0.06 0.23 -0.12 0.08 0.00 0.00 0.00 175.76 176.01 1bwc s VAL 48 N -0.65 3.00 -0.20 0.00 1.01 0.07 -0.50 120.40 123.13 1bwc s VAL 48 Ca 0.03 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 1bwc s VAL 48 Cb -0.07 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1bwc s VAL 48 CO 0.01 0.51 0.31 -0.69 0.00 0.00 0.00 175.10 175.24 1bwc s VAL 49 N 0.65 5.27 -0.03 2.92 1.01 0.47 -0.51 120.40 130.18 1bwc s VAL 49 Ca -0.07 0.54 -0.00 0.00 0.00 0.00 0.00 61.98 62.45 1bwc s VAL 49 Cb -0.15 -3.65 0.03 0.00 0.00 0.00 0.00 36.38 32.60 1bwc s VAL 49 CO 0.02 0.31 0.02 -0.70 0.00 0.00 0.00 175.10 174.76 1bwc s GLU 50 N 1.02 0.15 0.11 2.72 2.56 -0.34 -0.56 118.70 124.36 1bwc s GLU 50 Ca 0.16 0.17 0.23 0.00 0.00 0.00 0.00 54.97 55.53 1bwc s GLU 50 Cb -0.14 -0.45 0.10 0.00 2.00 0.00 0.00 34.13 35.64 1bwc s GLU 50 CO 0.06 -0.19 1.09 -1.13 -0.56 0.00 0.00 175.26 174.52 1bwc n SER 51 N 4.44 0.68 0.00 -1.70 3.41 -1.15 -1.45 113.62 117.85 1bwc n SER 51 Ca -0.21 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 1bwc n SER 51 Cb 0.50 0.56 0.00 0.00 -0.26 0.00 0.00 64.21 65.01 1bwc n SER 51 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1bwc n HIS 52 N -2.25 0.00 -4.60 7.33 8.25 -1.26 -4.70 115.22 117.99 1bwc n HIS 52 Ca 0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.17 1bwc n HIS 52 Cb 0.48 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.47 1bwc n HIS 52 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1bwc s LYS 53 N 2.29 2.11 0.46 -0.41 1.02 -1.26 -5.03 119.74 118.92 1bwc s LYS 53 Ca 0.00 -0.96 -0.24 0.00 0.02 0.00 0.00 55.97 54.78 1bwc s LYS 53 Cb 0.00 -2.22 -0.07 0.00 -0.52 0.00 0.00 37.83 35.01 1bwc s LYS 53 CO 0.00 0.54 1.32 -0.51 -0.92 0.00 0.00 175.35 175.78 1bwc s LEU 54 N -1.50 4.07 0.00 3.17 1.43 -1.26 -2.85 118.68 121.74 1bwc s LEU 54 Ca 0.15 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 1bwc s LEU 54 Cb -0.11 -4.06 0.00 0.00 0.03 0.00 0.00 46.19 42.06 1bwc s LEU 54 CO 0.06 -1.11 0.00 0.61 0.23 0.00 0.00 176.35 176.14 1bwc n GLY 55 N 0.63 3.08 7.00 -3.19 0.00 0.07 -4.60 105.19 108.17 1bwc n GLY 55 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1bwc n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwc n GLY 56 N -2.00 2.52 0.16 -0.02 0.00 -1.13 -2.80 105.19 101.92 1bwc n GLY 56 Ca 0.00 -0.45 -0.19 0.00 0.00 0.00 0.00 46.02 45.39 1bwc n GLY 56 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1bwc h THR 57 N 0.00 1.39 -0.41 2.61 2.02 -1.94 -2.18 112.91 114.40 1bwc h THR 57 Ca 0.00 -2.17 0.04 0.00 0.77 0.00 0.00 66.41 65.05 1bwc h THR 57 Cb 0.00 2.58 -0.04 0.00 -1.74 0.00 0.00 68.15 68.95 1bwc h THR 57 CO 0.00 0.64 0.19 0.00 0.37 0.00 0.00 175.52 176.72 1bwc h VAL 59 N 0.38 1.35 0.03 0.00 2.07 -1.59 0.05 116.25 118.55 1bwc h VAL 59 Ca 0.18 -1.76 -0.38 0.00 0.82 0.00 0.00 66.70 65.56 1bwc h VAL 59 Cb 0.11 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 1bwc h VAL 59 CO -0.14 0.53 -2.23 0.59 0.02 0.00 0.00 177.57 176.34 1bwc n ASN 60 N -4.23 1.99 -1.51 0.57 3.02 -0.82 -4.33 115.26 109.95 1bwc n ASN 60 Ca -0.07 0.13 0.03 0.00 -0.03 0.00 0.00 54.58 54.64 1bwc n ASN 60 Cb 0.58 -0.68 0.06 0.00 -0.61 0.00 0.00 39.78 39.12 1bwc n ASN 60 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1bwc n VAL 61 N -3.70 0.58 0.00 2.41 0.24 -0.87 -4.82 118.33 112.17 1bwc n VAL 61 Ca -0.43 -1.68 0.00 0.00 -2.04 0.00 0.00 64.34 60.19 1bwc n VAL 61 Cb 0.94 0.77 0.00 0.00 -1.47 0.00 0.00 33.84 34.08 1bwc n VAL 61 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bwc n GLY 62 N 0.07 3.56 0.25 7.63 0.00 -0.26 -4.72 105.19 111.72 1bwc n GLY 62 Ca 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 1bwc n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwc h VAL 64 N 0.49 0.88 -0.54 0.00 2.07 -1.31 -1.05 116.25 116.79 1bwc h VAL 64 Ca 0.08 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 1bwc h VAL 64 Cb 0.60 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 1bwc h VAL 64 CO 0.04 0.23 0.26 1.55 0.02 0.00 0.00 177.57 179.67 1bwc h PRO 65 N -0.84 0.76 -0.30 1.57 0.13 -1.72 -2.60 132.00 129.00 1bwc h PRO 65 Ca -0.02 -0.09 0.05 0.00 -0.87 0.00 0.00 66.00 65.06 1bwc h PRO 65 Cb 0.53 -0.15 -0.04 0.00 0.13 0.00 0.00 31.00 31.47 1bwc h PRO 65 CO 0.03 0.59 0.02 -0.22 -0.23 0.00 0.00 178.00 178.20 1bwc h LYS 66 N 0.76 0.12 -0.69 0.86 3.11 -0.96 -2.04 116.57 117.73 1bwc h LYS 66 Ca 0.19 -0.01 -0.07 0.00 -2.81 0.00 0.00 60.65 57.95 1bwc h LYS 66 Cb 0.09 -0.03 -0.03 0.00 -1.00 0.00 0.00 32.23 31.26 1bwc h LYS 66 CO -0.03 0.08 0.14 -0.22 -2.81 0.00 0.00 179.45 176.61 1bwc h LYS 67 N 0.12 1.11 -0.92 1.90 1.63 -0.94 0.30 116.57 119.76 1bwc h LYS 67 Ca 0.14 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.65 1bwc h LYS 67 Cb 0.17 -0.14 -0.04 0.00 -0.60 0.00 0.00 32.23 31.62 1bwc h LYS 67 CO -0.22 1.00 0.52 0.28 -3.45 0.00 0.00 179.45 177.58 1bwc h VAL 68 N 1.05 1.26 -0.05 2.00 2.07 -1.24 0.38 116.25 121.72 1bwc h VAL 68 Ca 0.21 -0.62 -0.15 0.00 0.82 0.00 0.00 66.70 66.96 1bwc h VAL 68 Cb 0.40 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1bwc h VAL 68 CO 0.01 0.29 -0.65 0.24 0.02 0.00 0.00 177.57 177.47 1bwc h MET 69 N 1.28 0.20 -0.14 1.57 2.86 -0.83 -1.87 114.93 118.00 1bwc h MET 69 Ca 0.32 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.79 1bwc h MET 69 Cb 0.00 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1bwc h MET 69 CO -0.06 0.78 -0.02 2.35 1.06 0.00 0.00 176.91 181.02 1bwc h TRP 70 N 0.14 0.29 -0.88 -0.22 7.01 -0.54 -0.25 115.95 121.51 1bwc h TRP 70 Ca -0.01 -0.06 0.19 0.00 2.11 0.00 0.00 58.89 61.12 1bwc h TRP 70 Cb 1.17 -0.07 -0.11 0.00 -2.10 0.00 0.00 29.16 28.05 1bwc h TRP 70 CO 0.02 0.53 0.43 -0.91 -2.79 0.00 0.00 178.44 175.72 1bwc h ASN 71 N -0.03 0.44 -0.25 2.65 2.35 -0.89 -0.65 115.58 119.20 1bwc h ASN 71 Ca 0.04 0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 1bwc h ASN 71 Cb 0.43 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1bwc h ASN 71 CO 0.01 0.11 0.08 0.74 -1.65 0.00 0.00 177.43 176.72 1bwc h THR 72 N 0.52 1.19 -0.85 2.81 2.02 -1.14 -2.39 112.91 115.07 1bwc h THR 72 Ca 0.52 -0.60 0.01 0.00 0.77 0.00 0.00 66.41 67.11 1bwc h THR 72 Cb 0.88 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 1bwc h THR 72 CO -0.45 0.20 0.55 0.00 0.37 0.00 0.00 175.52 176.19 1bwc h ALA 73 N 0.91 1.38 0.00 6.16 0.00 -0.15 -1.80 119.26 125.75 1bwc h ALA 73 Ca 0.08 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1bwc h ALA 73 Cb 0.22 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1bwc h ALA 73 CO -0.00 0.57 -0.45 -0.39 0.00 0.00 0.00 179.25 178.97 1bwc h VAL 74 N 1.15 1.04 -0.72 0.00 -1.51 -1.09 -1.03 116.25 114.09 1bwc h VAL 74 Ca 0.31 -1.74 0.09 0.00 -1.23 0.00 0.00 66.70 64.12 1bwc h VAL 74 Cb -0.12 2.02 -0.05 0.00 -2.13 0.00 0.00 31.29 31.02 1bwc h VAL 74 CO -0.06 0.44 0.47 0.45 -1.23 0.00 0.00 177.57 177.64 1bwc h HIS 75 N 0.00 0.68 -0.42 5.19 3.86 -0.81 -1.63 115.15 122.03 1bwc h HIS 75 Ca -0.00 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.15 1bwc h HIS 75 Cb 0.99 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.22 1bwc h HIS 75 CO 0.00 0.33 -0.04 1.03 0.86 0.00 0.00 177.93 180.12 1bwc h SER 76 N 0.65 0.75 0.27 2.45 0.87 -0.59 -1.39 113.55 116.56 1bwc h SER 76 Ca 0.33 -0.33 -0.09 0.00 -1.23 0.00 0.00 61.79 60.46 1bwc h SER 76 Cb 0.42 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1bwc h SER 76 CO -0.11 0.90 -0.38 -0.33 -0.53 0.00 0.00 176.83 176.38 1bwc h GLU 77 N 0.59 0.16 0.02 2.24 5.08 -1.13 -2.89 114.58 118.65 1bwc h GLU 77 Ca 0.11 -0.07 -0.23 0.00 -1.00 0.00 0.00 59.36 58.18 1bwc h GLU 77 Cb 0.54 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1bwc h GLU 77 CO 0.03 0.52 -1.10 0.74 -1.00 0.00 0.00 179.01 178.20 1bwc h PHE 78 N 0.14 0.08 -0.81 4.33 0.04 -1.20 -2.86 116.94 116.66 1bwc h PHE 78 Ca 0.01 -0.06 0.19 0.00 2.80 0.00 0.00 57.97 60.92 1bwc h PHE 78 Cb 0.74 -0.00 -0.13 0.00 2.20 0.00 0.00 35.95 38.76 1bwc h PHE 78 CO 0.01 1.05 0.20 1.98 -0.60 0.00 0.00 178.31 180.94 1bwc h MET 79 N 0.01 0.23 -0.73 1.51 4.05 -1.08 -2.35 114.93 116.58 1bwc h MET 79 Ca -0.05 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1bwc h MET 79 Cb 1.82 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 32.53 1bwc h MET 79 CO 0.14 0.15 0.47 0.45 0.23 0.00 0.00 176.91 178.35 1bwc h HIS 80 N 0.24 0.93 0.00 1.39 3.86 -1.30 -2.59 115.15 117.67 1bwc h HIS 80 Ca 0.48 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.70 1bwc h HIS 80 Cb 0.88 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 29.04 1bwc h HIS 80 CO -0.27 0.60 0.00 -0.25 0.86 0.00 0.00 177.93 178.86 1bwc n ASP 81 N -4.56 0.00 0.44 2.45 8.00 -0.91 -4.35 116.55 117.63 1bwc n ASP 81 Ca 0.07 -0.74 -0.20 0.00 0.71 0.00 0.00 54.79 54.63 1bwc n ASP 81 Cb 0.03 -0.08 -0.10 0.00 -0.02 0.00 0.00 41.12 40.95 1bwc n ASP 81 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 1bwc h HIS 82 N 0.00 -1.30 -0.78 1.24 2.76 -1.20 -2.19 115.15 113.69 1bwc h HIS 82 Ca 0.00 -0.02 0.17 0.00 -2.20 0.00 0.00 60.37 58.32 1bwc h HIS 82 Cb 0.07 0.46 -0.05 0.00 1.55 0.00 0.00 27.41 29.44 1bwc h HIS 82 CO 0.00 -0.74 0.52 0.00 -1.30 0.00 0.00 177.93 176.42 1bwc h ALA 83 N -1.22 2.21 -0.01 5.26 0.00 -1.76 0.12 119.26 123.86 1bwc h ALA 83 Ca -0.11 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1bwc h ALA 83 Cb 0.97 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1bwc h ALA 83 CO 0.12 -0.43 -0.09 -0.44 0.00 0.00 0.00 179.25 178.42 1bwc h ASP 84 N 0.36 0.01 -0.47 0.00 3.32 -1.68 -2.47 116.42 115.49 1bwc h ASP 84 Ca 0.39 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 1bwc h ASP 84 Cb 0.98 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.53 1bwc h ASP 84 CO -0.12 0.10 0.00 -1.22 -1.72 0.00 0.00 179.24 176.28 1bwc n TYR 85 N -4.43 0.97 -0.27 4.55 4.01 0.41 -4.87 117.16 117.53 1bwc n TYR 85 Ca -0.03 -0.40 0.00 0.00 -0.16 0.00 0.00 57.90 57.31 1bwc n TYR 85 Cb 0.17 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 1bwc n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bwc n GLY 86 N 0.99 0.84 3.57 2.72 0.00 -0.93 -5.07 105.19 107.31 1bwc n GLY 86 Ca 0.18 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 1bwc n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bwc s PHE 87 N -2.00 2.57 -0.12 1.61 0.08 -1.15 -5.02 117.98 113.94 1bwc s PHE 87 Ca 0.00 -0.25 -0.37 0.00 0.12 0.00 0.00 56.93 56.42 1bwc s PHE 87 Cb 0.00 -1.18 -0.14 0.00 -0.57 0.00 0.00 43.02 41.13 1bwc s PHE 87 CO 0.00 0.60 1.70 -2.30 -0.10 0.00 0.00 175.22 175.12 1bwc n PRO 88 N -0.47 1.55 -1.43 0.24 -0.02 -1.26 -3.60 135.00 130.01 1bwc n PRO 88 Ca -0.08 0.57 -0.49 0.00 -2.02 0.00 0.00 63.50 61.47 1bwc n PRO 88 Cb 0.58 -2.30 -0.09 0.00 -0.02 0.00 0.00 33.50 31.67 1bwc n PRO 88 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1bwc n SER 89 N 5.09 1.59 -4.01 2.55 2.88 -1.26 -4.50 113.62 115.95 1bwc n SER 89 Ca 0.23 0.33 -0.13 0.00 -1.33 0.00 0.00 58.87 57.96 1bwc n SER 89 Cb 0.20 -1.17 -0.12 0.00 -0.75 0.00 0.00 64.21 62.37 1bwc n SER 89 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bwc n GLU 91 N 1.96 0.00 0.00 0.00 -0.00 -1.26 -4.73 120.64 116.62 1bwc n GLU 91 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.96 1bwc n GLU 91 Cb 0.56 -0.59 0.00 0.00 -0.00 0.00 0.00 31.44 31.41 1bwc n GLU 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1bwc n GLY 92 N 2.75 -0.50 3.63 -1.84 0.00 -1.26 -5.14 105.19 102.83 1bwc n GLY 92 Ca 0.00 0.48 -0.42 0.00 0.00 0.00 0.00 46.02 46.08 1bwc n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bwc s LYS 93 N 0.00 4.08 0.08 1.61 1.02 -1.26 -5.00 119.74 120.26 1bwc s LYS 93 Ca 0.00 0.85 -0.30 0.00 0.02 0.00 0.00 55.97 56.54 1bwc s LYS 93 Cb 0.00 -3.69 -0.06 0.00 -0.52 0.00 0.00 37.83 33.56 1bwc s LYS 93 CO 0.00 -0.66 1.14 0.12 -0.92 0.00 0.00 175.35 175.03 1bwc s PHE 94 N 3.05 3.51 -0.49 3.18 5.36 -1.26 -5.01 117.98 126.32 1bwc s PHE 94 Ca 0.36 1.44 -0.12 0.00 -0.96 0.00 0.00 56.93 57.66 1bwc s PHE 94 Cb -0.14 -3.33 0.12 0.00 -0.34 0.00 0.00 43.02 39.32 1bwc s PHE 94 CO 0.11 -0.90 0.40 1.21 -1.46 0.00 0.00 175.22 174.58 1bwc s ASN 95 N 0.76 5.90 0.17 6.13 3.84 -1.26 -4.95 114.94 125.54 1bwc s ASN 95 Ca 0.55 -1.83 -0.13 0.00 0.21 0.00 0.00 52.86 51.67 1bwc s ASN 95 Cb -0.28 -2.09 0.07 0.00 -0.55 0.00 0.00 41.25 38.40 1bwc s ASN 95 CO 0.30 -0.75 1.77 -0.25 -2.79 0.00 0.00 177.10 175.39 1bwc h TRP 96 N 8.62 0.80 -0.95 0.43 2.91 -1.95 -2.99 115.95 122.83 1bwc h TRP 96 Ca -0.25 -0.03 0.26 0.00 1.13 0.00 0.00 58.89 60.00 1bwc h TRP 96 Cb 1.08 -0.25 -0.14 0.00 -0.51 0.00 0.00 29.16 29.35 1bwc h TRP 96 CO 0.67 0.60 0.46 -0.09 -1.03 0.00 0.00 178.44 179.05 1bwc h ARG 97 N 0.77 0.36 -0.09 2.65 9.65 -1.93 -1.18 114.38 124.61 1bwc h ARG 97 Ca 0.20 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 58.99 1bwc h ARG 97 Cb 0.08 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1bwc h ARG 97 CO -0.03 0.24 -0.22 0.28 2.80 0.00 0.00 179.97 183.04 1bwc h VAL 98 N 0.37 1.40 -0.02 0.20 2.07 -1.91 -1.66 116.25 116.71 1bwc h VAL 98 Ca 0.63 -1.54 -0.17 0.00 0.82 0.00 0.00 66.70 66.44 1bwc h VAL 98 Cb 1.30 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 33.23 1bwc h VAL 98 CO -0.57 0.44 -0.75 -0.29 0.02 0.00 0.00 177.57 176.42 1bwc h ILE 99 N -0.15 1.48 -0.71 4.57 6.09 -1.61 -2.87 117.51 124.31 1bwc h ILE 99 Ca -0.00 -2.41 0.02 0.00 -1.37 0.00 0.00 64.86 61.10 1bwc h ILE 99 Cb 0.82 2.30 -0.04 0.00 0.47 0.00 0.00 36.82 40.38 1bwc h ILE 99 CO 0.05 0.70 0.46 0.50 -3.07 0.00 0.00 178.15 176.79 1bwc h LYS 100 N 0.09 0.89 -0.51 2.19 1.63 -1.09 0.85 116.57 120.61 1bwc h LYS 100 Ca -0.02 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 1bwc h LYS 100 Cb 1.32 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 32.73 1bwc h LYS 100 CO 0.11 0.59 0.20 1.49 -3.45 0.00 0.00 179.45 178.39 1bwc h GLU 101 N 0.92 0.77 -0.54 1.90 4.57 -1.24 -1.37 114.58 119.59 1bwc h GLU 101 Ca 0.27 -0.14 -0.11 0.00 -1.18 0.00 0.00 59.36 58.20 1bwc h GLU 101 Cb -0.05 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.39 1bwc h GLU 101 CO -0.08 0.68 -0.08 0.87 -1.18 0.00 0.00 179.01 179.22 1bwc h LYS 102 N 0.69 0.99 -0.24 1.92 1.57 -1.22 -2.28 116.57 117.99 1bwc h LYS 102 Ca 0.17 -0.34 -0.05 0.00 -1.87 0.00 0.00 60.65 58.56 1bwc h LYS 102 Cb 0.20 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1bwc h LYS 102 CO -0.01 1.02 -0.04 -0.09 -0.57 0.00 0.00 179.45 179.76 1bwc h ARG 103 N 0.89 0.46 -0.83 3.15 2.43 -0.69 -1.57 114.38 118.22 1bwc h ARG 103 Ca 0.15 -0.16 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 1bwc h ARG 103 Cb 0.63 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 30.07 1bwc h ARG 103 CO 0.04 0.67 0.45 -0.44 -1.51 0.00 0.00 179.97 179.18 1bwc h ASP 104 N 0.21 0.61 0.61 -3.80 3.32 -1.20 -1.58 116.42 114.58 1bwc h ASP 104 Ca 0.06 0.07 -0.18 0.00 0.02 0.00 0.00 57.03 57.00 1bwc h ASP 104 Cb 0.48 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1bwc h ASP 104 CO 0.02 0.31 -0.82 0.00 -1.72 0.00 0.00 179.24 177.03 1bwc h ALA 105 N 1.49 0.61 -0.27 3.45 0.00 -1.07 -1.29 119.26 122.18 1bwc h ALA 105 Ca 0.42 -0.70 -0.16 0.00 0.00 0.00 0.00 54.91 54.47 1bwc h ALA 105 Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1bwc h ALA 105 CO -0.29 0.91 -0.47 -0.92 0.00 0.00 0.00 179.25 178.48 1bwc h TYR 106 N 0.09 0.89 0.01 0.00 3.20 -1.08 -1.59 116.97 118.47 1bwc h TYR 106 Ca -0.03 -0.29 -0.00 0.00 3.14 0.00 0.00 58.73 61.55 1bwc h TYR 106 Cb 1.43 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.52 1bwc h TYR 106 CO 0.02 1.05 -0.00 0.28 -1.64 0.00 0.00 178.16 177.87 1bwc h VAL 107 N 0.58 1.17 -0.89 1.81 2.07 -1.06 -2.27 116.25 117.66 1bwc h VAL 107 Ca 0.03 -0.53 0.11 0.00 0.82 0.00 0.00 66.70 67.13 1bwc h VAL 107 Cb 1.03 1.53 -0.08 0.00 -1.52 0.00 0.00 31.29 32.25 1bwc h VAL 107 CO 0.10 0.14 0.52 0.28 0.02 0.00 0.00 177.57 178.63 1bwc h SER 108 N -0.23 0.75 -0.40 0.57 0.02 -1.26 -0.51 113.55 112.49 1bwc h SER 108 Ca -0.00 0.05 0.08 0.00 -0.84 0.00 0.00 61.79 61.08 1bwc h SER 108 Cb 0.23 -0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.60 1bwc h SER 108 CO 0.00 0.41 -0.06 -0.09 -1.14 0.00 0.00 176.83 175.95 1bwc h ARG 109 N 0.85 0.03 -0.41 3.45 2.43 -1.15 -2.36 114.38 117.22 1bwc h ARG 109 Ca 0.43 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.55 1bwc h ARG 109 Cb 0.42 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 1bwc h ARG 109 CO -0.26 0.02 0.03 -0.07 -1.51 0.00 0.00 179.97 178.18 1bwc h LEU 110 N 0.04 0.61 -0.44 3.80 3.38 -0.56 -1.61 115.31 120.53 1bwc h LEU 110 Ca 0.19 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1bwc h LEU 110 Cb 0.29 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 1bwc h LEU 110 CO -0.38 0.66 0.14 0.78 0.09 0.00 0.00 178.44 179.72 1bwc h ASN 111 N 0.62 0.11 -0.34 -0.43 -0.26 -0.66 -1.62 115.58 113.01 1bwc h ASN 111 Ca 0.13 0.06 -0.16 0.00 -0.56 0.00 0.00 56.30 55.78 1bwc h ASN 111 Cb 0.34 0.06 -0.00 0.00 -1.06 0.00 0.00 38.32 37.66 1bwc h ASN 111 CO 0.01 0.10 -0.40 0.00 -1.06 0.00 0.00 177.43 176.08 1bwc h ALA 112 N 1.31 0.51 -0.89 -0.83 0.00 -1.17 -1.66 119.26 116.53 1bwc h ALA 112 Ca 0.21 -0.46 0.12 0.00 0.00 0.00 0.00 54.91 54.78 1bwc h ALA 112 Cb 0.23 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.83 1bwc h ALA 112 CO -0.24 0.62 0.52 0.82 0.00 0.00 0.00 179.25 180.97 1bwc h ILE 113 N 0.66 0.87 -0.01 0.00 2.04 -1.08 -0.88 117.51 119.12 1bwc h ILE 113 Ca 0.05 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1bwc h ILE 113 Cb 0.99 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1bwc h ILE 113 CO 0.10 0.15 -0.04 1.88 0.00 0.00 0.00 178.15 180.24 1bwc h TYR 114 N 0.83 0.07 -0.95 1.37 0.05 -0.99 -1.38 116.97 115.96 1bwc h TYR 114 Ca 0.45 -0.03 0.16 0.00 0.05 0.00 0.00 58.73 59.36 1bwc h TYR 114 Cb 0.48 -0.01 -0.10 0.00 1.01 0.00 0.00 36.73 38.11 1bwc h TYR 114 CO -0.05 0.64 0.56 0.37 -1.05 0.00 0.00 178.16 178.64 1bwc h GLN 115 N -0.53 0.76 -0.06 4.88 4.15 -1.20 -0.97 115.11 122.14 1bwc h GLN 115 Ca -0.00 -0.05 -0.20 0.00 0.77 0.00 0.00 58.65 59.17 1bwc h GLN 115 Cb 0.64 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.16 1bwc h GLN 115 CO 0.01 0.50 -0.81 -0.97 -1.93 0.00 0.00 178.83 175.63 1bwc h ASN 116 N 0.78 0.55 -0.24 -0.69 -0.73 -1.11 -1.90 115.58 112.24 1bwc h ASN 116 Ca 0.52 -0.39 -0.18 0.00 1.87 0.00 0.00 56.30 58.12 1bwc h ASN 116 Cb 0.71 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 39.14 1bwc h ASN 116 CO -0.34 1.16 -0.57 0.78 -0.37 0.00 0.00 177.43 178.08 1bwc h ASN 117 N 0.29 0.91 -0.55 1.15 -0.26 -0.85 -1.05 115.58 115.22 1bwc h ASN 117 Ca -0.05 -0.56 0.08 0.00 -0.56 0.00 0.00 56.30 55.21 1bwc h ASN 117 Cb 1.42 -0.26 -0.07 0.00 -1.06 0.00 0.00 38.32 38.35 1bwc h ASN 117 CO 0.14 1.31 0.20 -0.07 -1.06 0.00 0.00 177.43 177.95 1bwc h LEU 118 N 0.56 0.19 -0.30 1.61 3.38 -1.21 -2.29 115.31 117.25 1bwc h LEU 118 Ca -0.00 0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1bwc h LEU 118 Cb 1.19 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1bwc h LEU 118 CO 0.12 0.13 -0.20 0.74 0.09 0.00 0.00 178.44 179.32 1bwc h THR 119 N 0.37 1.30 -0.65 0.22 2.02 -1.23 -0.55 112.91 114.40 1bwc h THR 119 Ca 0.27 -1.34 0.10 0.00 0.77 0.00 0.00 66.41 66.21 1bwc h THR 119 Cb 0.32 1.50 -0.04 0.00 -1.74 0.00 0.00 68.15 68.18 1bwc h THR 119 CO -0.28 0.43 0.43 0.11 0.37 0.00 0.00 175.52 176.58 1bwc h LYS 120 N 0.43 0.46 -0.26 6.66 1.57 -1.12 0.14 116.57 124.45 1bwc h LYS 120 Ca 0.06 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1bwc h LYS 120 Cb 0.75 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1bwc h LYS 120 CO 0.06 0.31 0.00 0.43 -0.57 0.00 0.00 179.45 179.67 1bwc n SER 121 N -4.48 1.67 -3.48 0.86 7.64 -0.87 -4.91 113.62 110.05 1bwc n SER 121 Ca 0.11 -1.88 -0.25 0.00 1.01 0.00 0.00 58.87 57.85 1bwc n SER 121 Cb 0.37 -0.17 0.01 0.00 -1.01 0.00 0.00 64.21 63.40 1bwc n SER 121 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1bwc n HIS 122 N 0.37 -1.93 -3.04 1.43 8.25 0.03 -4.96 115.22 115.37 1bwc n HIS 122 Ca 0.13 0.59 -0.41 0.00 -0.26 0.00 0.00 57.72 57.77 1bwc n HIS 122 Cb 0.29 -3.41 -0.06 0.00 1.12 0.00 0.00 29.99 27.93 1bwc n HIS 122 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1bwc s ILE 123 N -3.07 4.95 0.20 1.59 1.01 -0.25 -4.66 121.20 120.97 1bwc s ILE 123 Ca 0.46 1.29 -0.30 0.00 0.00 0.00 0.00 60.65 62.10 1bwc s ILE 123 Cb -0.24 -4.00 -0.08 0.00 0.01 0.00 0.00 42.46 38.15 1bwc s ILE 123 CO 0.57 0.03 1.22 -0.70 0.00 0.00 0.00 174.94 176.06 1bwc s GLU 124 N 2.38 4.47 -0.24 2.79 2.56 -0.79 -4.27 118.70 125.61 1bwc s GLU 124 Ca 0.30 1.92 -0.11 0.00 0.00 0.00 0.00 54.97 57.09 1bwc s GLU 124 Cb -0.16 -3.22 -0.05 0.00 2.00 0.00 0.00 34.13 32.70 1bwc s GLU 124 CO 0.09 -0.11 0.17 0.42 -0.56 0.00 0.00 175.26 175.27 1bwc s ILE 125 N -0.14 5.35 -0.22 -3.70 1.01 -1.26 -0.75 121.20 121.49 1bwc s ILE 125 Ca 0.53 0.20 -0.06 0.00 0.00 0.00 0.00 60.65 61.32 1bwc s ILE 125 Cb -0.34 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 1bwc s ILE 125 CO 0.38 0.34 0.02 -0.63 0.00 0.00 0.00 174.94 175.05 1bwc s ILE 126 N 1.08 4.04 -0.27 2.92 1.01 0.34 -4.96 121.20 125.36 1bwc s ILE 126 Ca 0.08 -0.28 -0.12 0.00 0.00 0.00 0.00 60.65 60.34 1bwc s ILE 126 Cb -0.14 -2.85 -0.05 0.00 0.01 0.00 0.00 42.46 39.44 1bwc s ILE 126 CO 0.05 0.40 0.22 -0.13 0.00 0.00 0.00 174.94 175.47 1bwc s ARG 127 N 1.26 3.99 0.00 2.79 1.81 -1.26 -1.20 118.95 126.34 1bwc s ARG 127 Ca 0.04 -0.25 0.00 0.00 -1.72 0.00 0.00 55.73 53.80 1bwc s ARG 127 Cb -0.15 -3.64 0.00 0.00 -0.45 0.00 0.00 34.95 30.72 1bwc s ARG 127 CO 0.02 -0.15 0.00 0.41 -0.68 0.00 0.00 175.30 174.90 1bwc n GLY 128 N 4.85 1.00 3.51 -3.53 0.00 -0.53 -4.87 105.19 105.63 1bwc n GLY 128 Ca -0.13 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 1bwc n GLY 128 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1bwc s HIS 129 N -1.42 3.15 0.22 1.61 2.46 -1.26 -2.94 115.29 117.11 1bwc s HIS 129 Ca 0.00 -0.20 -0.30 0.00 0.47 0.00 0.00 55.06 55.03 1bwc s HIS 129 Cb 0.00 -2.99 -0.09 0.00 -0.13 0.00 0.00 32.58 29.37 1bwc s HIS 129 CO 0.00 -0.70 1.28 0.00 -2.47 0.00 0.00 174.74 172.85 1bwc s ALA 130 N 2.32 3.50 0.12 1.58 0.00 -1.26 -4.48 121.76 123.54 1bwc s ALA 130 Ca 0.15 1.10 0.06 0.00 0.00 0.00 0.00 51.96 53.27 1bwc s ALA 130 Cb -0.16 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1bwc s ALA 130 CO 0.15 -0.51 -0.15 0.00 0.00 0.00 0.00 175.76 175.26 1bwc s ALA 131 N -0.19 1.50 0.46 0.00 0.00 -1.04 -4.68 121.76 117.81 1bwc s ALA 131 Ca 0.54 -1.26 -0.23 0.00 0.00 0.00 0.00 51.96 51.01 1bwc s ALA 131 Cb -0.36 -0.09 -0.07 0.00 0.00 0.00 0.00 23.12 22.59 1bwc s ALA 131 CO 0.40 0.13 1.16 -0.06 0.00 0.00 0.00 175.76 177.39 1bwc s PHE 132 N -1.98 2.89 0.55 0.00 0.08 -0.63 -0.97 117.98 117.92 1bwc s PHE 132 Ca 0.08 1.54 0.08 0.00 0.12 0.00 0.00 56.93 58.75 1bwc s PHE 132 Cb -0.06 -3.37 0.09 0.00 -0.57 0.00 0.00 43.02 39.12 1bwc s PHE 132 CO 0.03 -1.46 0.76 0.25 -0.10 0.00 0.00 175.22 174.69 1bwc n THR 133 N -0.48 0.00 0.18 0.64 -2.24 -0.78 -4.72 114.28 106.88 1bwc n THR 133 Ca 0.07 -1.78 0.11 0.00 -2.27 0.00 0.00 64.05 60.18 1bwc n THR 133 Cb 0.48 -0.57 0.27 0.00 -2.10 0.00 0.00 70.33 68.41 1bwc n THR 133 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1bwc n SER 134 N -2.41 3.37 -4.53 3.42 3.41 -1.26 -4.75 113.62 110.87 1bwc n SER 134 Ca 0.15 -1.97 -0.36 0.00 -0.26 0.00 0.00 58.87 56.43 1bwc n SER 134 Cb 0.56 -0.33 0.08 0.00 -0.26 0.00 0.00 64.21 64.26 1bwc n SER 134 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bwc n ASP 135 N 1.38 -0.56 -0.02 4.04 8.00 -1.26 -4.98 116.55 123.15 1bwc n ASP 135 Ca 0.21 0.60 -0.20 0.00 0.71 0.00 0.00 54.79 56.11 1bwc n ASP 135 Cb 0.56 -1.30 -0.13 0.00 -0.02 0.00 0.00 41.12 40.23 1bwc n ASP 135 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1bwc h PRO 136 N -0.46 0.16 -6.46 -0.24 0.13 -1.99 -3.42 132.00 119.72 1bwc h PRO 136 Ca -0.46 -0.27 -0.62 0.00 -0.87 0.00 0.00 66.00 63.78 1bwc h PRO 136 Cb 1.34 0.10 0.09 0.00 0.13 0.00 0.00 31.00 32.65 1bwc h PRO 136 CO 0.44 1.13 0.39 1.17 -0.23 0.00 0.00 178.00 180.90 1bwc n LYS 137 N -4.20 1.55 -1.97 0.86 4.81 -1.26 -4.97 118.16 112.98 1bwc n LYS 137 Ca -0.21 0.55 -0.42 0.00 -0.87 0.00 0.00 58.31 57.36 1bwc n LYS 137 Cb 0.76 -2.09 -0.03 0.00 0.02 0.00 0.00 35.03 33.69 1bwc n LYS 137 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1bwc s PRO 138 N -0.58 4.19 -0.19 1.64 0.02 -1.26 -4.97 135.00 133.84 1bwc s PRO 138 Ca 0.69 2.25 -0.14 0.00 0.02 0.00 0.00 61.00 63.82 1bwc s PRO 138 Cb -0.75 -3.88 0.06 0.00 0.02 0.00 0.00 34.50 29.95 1bwc s PRO 138 CO 0.52 -0.81 0.49 0.99 -0.33 0.00 0.00 177.00 177.86 1bwc s THR 139 N 3.61 -0.01 0.40 0.99 2.01 -1.26 -4.32 115.64 117.05 1bwc s THR 139 Ca 0.74 0.04 0.08 0.00 0.31 0.00 0.00 61.69 62.86 1bwc s THR 139 Cb -0.36 -0.70 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 1bwc s THR 139 CO 0.31 0.02 0.25 0.27 -0.69 0.00 0.00 174.62 174.78 1bwc s ILE 140 N 0.97 2.64 0.00 1.82 -4.36 0.00 -1.87 121.20 120.40 1bwc s ILE 140 Ca -0.06 -1.55 0.01 0.00 -0.26 0.00 0.00 60.65 58.79 1bwc s ILE 140 Cb -0.06 -3.00 -0.00 0.00 1.25 0.00 0.00 42.46 40.64 1bwc s ILE 140 CO -0.08 -0.05 -0.03 -1.83 0.24 0.00 0.00 174.94 173.19 1bwc s GLU 141 N -3.98 0.25 -0.07 0.37 -1.05 -0.15 -0.22 118.70 113.85 1bwc s GLU 141 Ca 0.43 -0.16 0.01 0.00 -0.15 0.00 0.00 54.97 55.10 1bwc s GLU 141 Cb -0.00 -0.21 0.02 0.00 -0.44 0.00 0.00 34.13 33.50 1bwc s GLU 141 CO 0.25 0.05 -0.06 0.08 0.95 0.00 0.00 175.26 176.53 1bwc s VAL 142 N -0.20 0.77 -0.70 1.83 1.01 0.24 -2.51 120.40 120.83 1bwc s VAL 142 Ca -0.00 -0.21 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 1bwc s VAL 142 Cb -0.02 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.59 1bwc s VAL 142 CO -0.00 0.30 0.62 -1.20 0.00 0.00 0.00 175.10 174.82 1bwc n SER 143 N 4.37 -5.07 -4.17 3.32 7.64 -1.26 -0.90 113.62 117.56 1bwc n SER 143 Ca -0.19 -0.70 -0.10 0.00 1.01 0.00 0.00 58.87 58.89 1bwc n SER 143 Cb 0.51 -1.67 -0.06 0.00 -1.01 0.00 0.00 64.21 61.98 1bwc n SER 143 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bwc n GLY 144 N -1.17 -0.13 3.82 0.23 0.00 -1.26 -4.97 105.19 101.70 1bwc n GLY 144 Ca -0.25 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1bwc n GLY 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bwc s LYS 145 N 6.33 4.23 0.24 1.61 2.36 -0.08 -5.10 119.74 129.33 1bwc s LYS 145 Ca 0.38 0.85 -0.08 0.00 -2.55 0.00 0.00 55.97 54.57 1bwc s LYS 145 Cb -0.00 -2.82 -0.06 0.00 -1.05 0.00 0.00 37.83 33.89 1bwc s LYS 145 CO 0.11 0.36 0.54 0.15 1.55 0.00 0.00 175.35 178.06 1bwc s LYS 146 N -2.10 3.74 -0.01 4.03 1.02 -1.26 -0.60 119.74 124.55 1bwc s LYS 146 Ca 0.44 0.17 -0.07 0.00 0.02 0.00 0.00 55.97 56.53 1bwc s LYS 146 Cb -0.16 -2.66 0.00 0.00 -0.52 0.00 0.00 37.83 34.49 1bwc s LYS 146 CO 0.21 0.30 0.14 0.71 -0.92 0.00 0.00 175.35 175.79 1bwc s TYR 147 N -1.88 -0.01 0.07 3.18 2.02 0.70 -2.52 117.35 118.90 1bwc s TYR 147 Ca 0.46 0.01 -0.09 0.00 -0.37 0.00 0.00 57.07 57.07 1bwc s TYR 147 Cb -0.11 -0.02 0.00 0.00 -0.40 0.00 0.00 41.96 41.43 1bwc s TYR 147 CO 0.24 -0.24 0.20 -0.08 -1.57 0.00 0.00 175.55 174.10 1bwc s THR 148 N -1.02 0.13 0.11 -0.71 -1.32 -0.40 -0.82 115.64 111.61 1bwc s THR 148 Ca -0.11 -1.06 -0.07 0.00 -1.21 0.00 0.00 61.69 59.23 1bwc s THR 148 Cb -0.06 -1.19 -0.01 0.00 -1.51 0.00 0.00 72.50 69.72 1bwc s THR 148 CO 0.01 -0.59 0.18 0.00 -2.21 0.00 0.00 174.62 172.01 1bwc s ALA 149 N -3.42 0.02 0.56 11.08 0.00 -1.26 -1.70 121.76 127.03 1bwc s ALA 149 Ca 0.02 -0.84 0.26 0.00 0.00 0.00 0.00 51.96 51.40 1bwc s ALA 149 Cb 0.03 0.61 1.51 0.00 0.00 0.00 0.00 23.12 25.26 1bwc s ALA 149 CO -0.09 -0.53 2.05 -1.00 0.00 0.00 0.00 175.76 176.20 1bwc h PRO 150 N 2.75 0.00 -3.78 0.00 0.13 -1.75 -3.42 132.00 125.93 1bwc h PRO 150 Ca -0.33 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.31 1bwc h PRO 150 Cb 1.20 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.95 1bwc h PRO 150 CO 0.55 0.00 -0.77 -1.01 -0.23 0.00 0.00 178.00 176.54 1bwc s HIS 151 N -4.81 1.02 -0.17 1.56 3.76 -1.24 -4.61 115.29 110.80 1bwc s HIS 151 Ca -0.05 -0.58 0.01 0.00 -0.15 0.00 0.00 55.06 54.29 1bwc s HIS 151 Cb 0.17 -1.00 0.01 0.00 1.11 0.00 0.00 32.58 32.88 1bwc s HIS 151 CO 0.62 -0.48 -0.20 0.42 -0.85 0.00 0.00 174.74 174.26 1bwc s ILE 152 N 1.86 2.16 -0.27 0.60 1.01 -0.19 -1.55 121.20 124.81 1bwc s ILE 152 Ca 0.02 -0.92 -0.13 0.00 0.00 0.00 0.00 60.65 59.62 1bwc s ILE 152 Cb -0.14 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1bwc s ILE 152 CO -0.07 0.54 0.28 -0.22 0.00 0.00 0.00 174.94 175.47 1bwc s LEU 153 N 1.11 4.04 -0.33 2.97 2.96 -0.02 -0.90 118.68 128.50 1bwc s LEU 153 Ca 0.00 0.15 -0.21 0.00 -0.22 0.00 0.00 54.13 53.85 1bwc s LEU 153 Cb -0.14 -2.27 -0.00 0.00 0.50 0.00 0.00 46.19 44.28 1bwc s LEU 153 CO -0.08 -0.10 0.67 -0.63 -1.32 0.00 0.00 176.35 174.89 1bwc s ILE 154 N 1.83 4.87 -0.34 6.68 1.01 0.17 -0.35 121.20 135.08 1bwc s ILE 154 Ca 0.11 0.79 0.16 0.00 0.00 0.00 0.00 60.65 61.70 1bwc s ILE 154 Cb -0.16 -4.08 0.42 0.00 0.01 0.00 0.00 42.46 38.65 1bwc s ILE 154 CO 0.10 -0.27 0.87 0.00 0.00 0.00 0.00 174.94 175.64 1bwc n ALA 155 N 6.07 2.89 1.33 9.38 0.00 0.43 -2.77 120.51 137.84 1bwc n ALA 155 Ca 0.00 -3.24 0.13 0.00 0.00 0.00 0.00 53.44 50.33 1bwc n ALA 155 Cb 0.49 -0.93 0.39 0.00 0.00 0.00 0.00 19.45 19.39 1bwc n ALA 155 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bwc n THR 156 N 0.07 0.00 -4.52 0.00 -2.24 -1.22 -4.33 114.28 102.04 1bwc n THR 156 Ca 0.15 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1bwc n THR 156 Cb 0.76 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 1bwc n THR 156 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bwc n GLY 157 N 1.26 -0.10 1.64 3.38 0.00 -1.26 -4.54 105.19 105.56 1bwc n GLY 157 Ca 0.16 -1.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.05 1bwc n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwc n GLY 158 N 0.00 3.63 3.33 -0.02 0.00 -1.26 -0.92 105.19 109.95 1bwc n GLY 158 Ca 0.00 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 43.96 1bwc n GLY 158 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1bwc s MET 159 N -2.75 1.17 0.37 1.61 0.23 0.11 -4.77 119.30 115.27 1bwc s MET 159 Ca 0.12 -1.25 -0.26 0.00 -1.03 0.00 0.00 55.69 53.26 1bwc s MET 159 Cb 0.01 0.36 -0.09 0.00 -1.53 0.00 0.00 34.83 33.58 1bwc s MET 159 CO 0.09 -0.42 1.18 -2.14 -2.03 0.00 0.00 175.02 171.70 1bwc s PRO 160 N -4.00 4.20 0.21 3.16 0.02 -1.26 -0.14 135.00 137.19 1bwc s PRO 160 Ca 0.20 1.89 -0.20 0.00 0.02 0.00 0.00 61.00 62.92 1bwc s PRO 160 Cb 0.04 -2.82 -0.08 0.00 0.02 0.00 0.00 34.50 31.65 1bwc s PRO 160 CO 0.02 -0.21 0.72 -1.54 -0.33 0.00 0.00 177.00 175.67 1bwc s SER 161 N -0.99 7.09 0.07 2.53 1.04 -0.40 -4.69 113.70 118.35 1bwc s SER 161 Ca 0.54 1.43 0.07 0.00 0.48 0.00 0.00 55.95 58.47 1bwc s SER 161 Cb -0.32 -2.42 -0.03 0.00 0.10 0.00 0.00 66.02 63.34 1bwc s SER 161 CO 0.41 0.06 -0.18 0.42 0.98 0.00 0.00 173.24 174.93 1bwc s THR 162 N -1.48 1.46 0.60 2.02 -4.23 -1.26 -4.62 115.64 108.14 1bwc s THR 162 Ca 0.42 -1.30 -0.18 0.00 -1.18 0.00 0.00 61.69 59.44 1bwc s THR 162 Cb -0.17 -1.33 -0.05 0.00 1.34 0.00 0.00 72.50 72.29 1bwc s THR 162 CO 0.21 -0.01 0.96 -2.65 -0.54 0.00 0.00 174.62 172.59 1bwc n PRO 163 N 1.47 0.88 -2.67 3.99 -0.02 -1.26 -5.00 135.00 132.39 1bwc n PRO 163 Ca -0.19 0.34 -0.34 0.00 -2.02 0.00 0.00 63.50 61.30 1bwc n PRO 163 Cb 0.54 -2.16 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 1bwc n PRO 163 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1bwc s HIS 164 N -1.52 3.15 0.57 6.00 3.76 -1.26 -4.74 115.29 121.25 1bwc s HIS 164 Ca 0.76 1.60 0.26 0.00 -0.15 0.00 0.00 55.06 57.52 1bwc s HIS 164 Cb -0.42 -2.97 1.56 0.00 1.11 0.00 0.00 32.58 31.86 1bwc s HIS 164 CO 0.47 -0.50 2.11 1.49 -0.85 0.00 0.00 174.74 177.46 1bwc h GLU 165 N 1.77 0.00 0.00 1.40 4.57 -1.95 -2.23 114.58 118.14 1bwc h GLU 165 Ca -0.49 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 57.60 1bwc h GLU 165 Cb 1.20 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 1bwc h GLU 165 CO 0.60 0.00 -0.42 0.66 -1.18 0.00 0.00 179.01 178.67 1bwc h SER 166 N 0.00 0.00 0.14 1.04 4.64 -2.00 -3.04 113.55 114.33 1bwc h SER 166 Ca 0.09 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.11 1bwc h SER 166 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1bwc h SER 166 CO -0.00 0.42 -1.52 1.56 -0.87 0.00 0.00 176.83 176.43 1bwc h GLN 167 N 0.00 0.30 -3.26 4.77 4.20 -1.83 -3.45 115.11 115.84 1bwc h GLN 167 Ca -0.00 -0.50 -0.55 0.00 0.06 0.00 0.00 58.65 57.65 1bwc h GLN 167 Cb 0.78 0.19 -0.40 0.00 0.30 0.00 0.00 27.48 28.35 1bwc h GLN 167 CO 0.05 1.24 -0.77 0.42 -0.67 0.00 0.00 178.83 179.11 1bwc s ILE 168 N -2.51 0.47 0.17 2.54 1.01 -0.89 -5.00 121.20 116.99 1bwc s ILE 168 Ca -0.18 -1.05 -0.33 0.00 0.00 0.00 0.00 60.65 59.08 1bwc s ILE 168 Cb 0.05 -1.33 -0.13 0.00 0.01 0.00 0.00 42.46 41.06 1bwc s ILE 168 CO 0.80 -0.64 1.64 -2.65 0.00 0.00 0.00 174.94 174.09 1bwc n PRO 169 N 5.03 2.36 -0.39 2.79 -0.02 -1.15 -1.90 135.00 141.70 1bwc n PRO 169 Ca -0.04 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1bwc n PRO 169 Cb 0.43 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1bwc n PRO 169 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bwc n GLY 170 N 3.63 0.72 0.38 -1.23 0.00 -1.26 -1.09 105.19 106.35 1bwc n GLY 170 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 1bwc n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwc h ALA 171 N 0.00 2.01 0.00 4.61 0.00 -1.67 0.22 119.26 124.43 1bwc h ALA 171 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bwc h ALA 171 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1bwc h ALA 171 CO 0.00 -0.26 0.00 -1.13 0.00 0.00 0.00 179.25 177.86 1bwc n SER 172 N -4.53 0.00 0.14 0.00 3.41 -1.26 -1.45 113.62 109.94 1bwc n SER 172 Ca 0.17 -0.56 0.01 0.00 -0.26 0.00 0.00 58.87 58.23 1bwc n SER 172 Cb 0.55 -0.07 0.16 0.00 -0.26 0.00 0.00 64.21 64.59 1bwc n SER 172 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1bwc h LEU 173 N 0.00 0.00-10.22 1.04 3.38 -1.34 -3.45 115.31 104.72 1bwc h LEU 173 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1bwc h LEU 173 Cb 0.05 0.00 0.13 0.00 0.09 0.00 0.00 40.66 40.93 1bwc h LEU 173 CO 0.00 0.59 0.35 -0.83 0.09 0.00 0.00 178.44 178.64 1bwc s GLY 174 N -4.47 2.06 0.47 0.83 0.00 -0.53 -4.82 107.32 100.86 1bwc s GLY 174 Ca 0.00 0.56 0.08 0.00 0.00 0.00 0.00 44.72 45.37 1bwc s GLY 174 CO 0.74 0.93 0.56 -0.26 0.00 0.00 0.00 173.10 175.08 1bwc s ILE 175 N -2.41 2.53 0.38 0.90 -4.36 0.85 -4.93 121.20 114.16 1bwc s ILE 175 Ca 0.67 -1.14 0.02 0.00 -0.26 0.00 0.00 60.65 59.94 1bwc s ILE 175 Cb -0.22 -2.67 0.02 0.00 1.25 0.00 0.00 42.46 40.84 1bwc s ILE 175 CO 0.47 0.00 0.14 0.35 0.24 0.00 0.00 174.94 176.14 1bwc n THR 176 N -1.87 0.00 -0.22 8.37 -2.24 -1.26 -0.59 114.28 116.47 1bwc n THR 176 Ca 0.08 -1.66 0.08 0.00 -2.27 0.00 0.00 64.05 60.28 1bwc n THR 176 Cb 0.61 0.10 0.36 0.00 -2.10 0.00 0.00 70.33 69.30 1bwc n THR 176 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1bwc h SER 177 N 0.69 0.67 -0.28 3.42 4.64 -1.97 -0.16 113.55 120.56 1bwc h SER 177 Ca -0.28 0.02 0.07 0.00 -0.47 0.00 0.00 61.79 61.12 1bwc h SER 177 Cb 0.92 -0.13 -0.08 0.00 -0.31 0.00 0.00 62.40 62.81 1bwc h SER 177 CO 0.45 0.41 -0.29 0.44 -0.87 0.00 0.00 176.83 176.97 1bwc h ASP 178 N 0.75 -0.95 0.22 4.97 5.19 -1.96 -2.02 116.42 122.62 1bwc h ASP 178 Ca 0.36 0.16 -0.04 0.00 -0.62 0.00 0.00 57.03 56.90 1bwc h ASP 178 Cb 0.42 0.44 -0.01 0.00 0.18 0.00 0.00 39.33 40.36 1bwc h ASP 178 CO -0.14 -0.32 -0.17 1.23 -3.12 0.00 0.00 179.24 176.73 1bwc h GLY 179 N -0.28 0.00 0.28 2.75 0.00 -1.55 -2.43 103.07 101.84 1bwc h GLY 179 Ca 0.14 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.67 1bwc h GLY 179 CO -0.44 0.00 0.60 -2.75 0.00 0.00 0.00 176.54 173.95 1bwc h PHE 180 N 0.00 0.62 -0.01 5.60 3.57 -0.32 -1.44 116.94 124.96 1bwc h PHE 180 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1bwc h PHE 180 Cb 0.32 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1bwc h PHE 180 CO 0.00 0.16 -0.09 1.19 -2.23 0.00 0.00 178.31 177.33 1bwc n PHE 181 N -4.54 0.00 1.06 0.41 3.72 -0.91 -2.54 117.46 114.65 1bwc n PHE 181 Ca 0.20 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.71 1bwc n PHE 181 Cb 0.68 -0.05 0.08 0.00 -0.94 0.00 0.00 39.48 39.25 1bwc n PHE 181 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1bwc n GLN 182 N -0.22 1.04 -1.69 -1.08 6.02 -0.57 -4.97 117.38 115.90 1bwc n GLN 182 Ca 0.17 -0.82 -0.43 0.00 -0.01 0.00 0.00 57.00 55.91 1bwc n GLN 182 Cb 0.34 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 30.08 1bwc n GLN 182 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1bwc n LEU 183 N -0.27 3.98 0.01 1.08 4.77 -1.02 -4.86 117.00 120.68 1bwc n LEU 183 Ca 0.10 0.99 0.10 0.00 -0.03 0.00 0.00 56.01 57.17 1bwc n LEU 183 Cb 0.43 -1.53 -0.14 0.00 -2.33 0.00 0.00 43.42 39.85 1bwc n LEU 183 CO 0.29 0.15 -0.63 1.21 -1.33 0.00 0.00 177.39 177.07 1bwc n GLU 184 N 5.56 0.65 -4.23 3.23 4.07 -1.26 -4.96 120.64 123.70 1bwc n GLU 184 Ca 0.18 -0.13 -0.13 0.00 -0.06 0.00 0.00 57.16 57.02 1bwc n GLU 184 Cb 0.36 -1.58 -0.10 0.00 -0.06 0.00 0.00 31.44 30.07 1bwc n GLU 184 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1bwc s GLU 185 N -3.45 1.01 -0.25 5.31 0.41 -1.26 -4.10 118.70 116.37 1bwc s GLU 185 Ca -0.07 -1.44 -0.29 0.00 -0.41 0.00 0.00 54.97 52.76 1bwc s GLU 185 Cb 0.13 -0.42 -0.01 0.00 -1.78 0.00 0.00 34.13 32.05 1bwc s GLU 185 CO 0.89 -0.00 1.46 -1.17 -0.49 0.00 0.00 175.26 175.94 1bwc s LEU 186 N -3.14 3.92 0.21 1.80 2.96 -1.26 -4.97 118.68 118.20 1bwc s LEU 186 Ca 0.17 1.46 -0.32 0.00 -0.22 0.00 0.00 54.13 55.22 1bwc s LEU 186 Cb 0.04 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 43.07 1bwc s LEU 186 CO -0.00 -1.14 1.56 -2.65 -1.32 0.00 0.00 176.35 172.79 1bwc n PRO 187 N 7.43 2.28 -0.15 0.98 -0.02 -1.26 -4.88 135.00 139.38 1bwc n PRO 187 Ca 0.17 0.82 -0.06 0.00 -2.02 0.00 0.00 63.50 62.41 1bwc n PRO 187 Cb 0.46 -2.57 0.11 0.00 -0.02 0.00 0.00 33.50 31.48 1bwc n PRO 187 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1bwc h GLY 188 N 5.45 0.97 -6.99 -1.23 0.00 -1.94 -3.40 103.07 95.93 1bwc h GLY 188 Ca -0.45 -0.66 -0.34 0.00 0.00 0.00 0.00 47.33 45.88 1bwc h GLY 188 CO 0.85 0.61 -0.67 -1.60 0.00 0.00 0.00 176.54 175.73 1bwc s ARG 189 N -5.01 0.04 -0.03 4.80 6.06 -1.26 -1.60 118.95 121.96 1bwc s ARG 189 Ca -0.10 0.35 0.04 0.00 -2.50 0.00 0.00 55.73 53.52 1bwc s ARG 189 Cb 0.14 -0.76 -0.03 0.00 0.06 0.00 0.00 34.95 34.37 1bwc s ARG 189 CO 0.83 -0.44 -0.14 -1.12 -2.50 0.00 0.00 175.30 171.93 1bwc s SER 190 N 2.25 4.06 -0.21 -2.12 0.01 -0.11 -1.26 113.70 116.33 1bwc s SER 190 Ca 0.04 -0.23 0.01 0.00 1.31 0.00 0.00 55.95 57.09 1bwc s SER 190 Cb -0.13 -0.84 0.04 0.00 0.21 0.00 0.00 66.02 65.30 1bwc s SER 190 CO -0.07 0.32 -0.15 -0.69 0.41 0.00 0.00 173.24 173.07 1bwc s VAL 191 N -0.80 1.95 -0.20 3.43 1.01 0.13 -1.15 120.40 124.77 1bwc s VAL 191 Ca 0.13 -1.13 -0.11 0.00 0.00 0.00 0.00 61.98 60.87 1bwc s VAL 191 Cb -0.11 -1.92 -0.05 0.00 0.00 0.00 0.00 36.38 34.31 1bwc s VAL 191 CO 0.02 0.28 0.16 -0.63 0.00 0.00 0.00 175.10 174.93 1bwc s ILE 192 N 1.28 5.39 -0.26 2.22 -1.09 -0.23 -0.82 121.20 127.69 1bwc s ILE 192 Ca -0.01 0.24 -0.08 0.00 -2.23 0.00 0.00 60.65 58.58 1bwc s ILE 192 Cb -0.16 -3.50 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 1bwc s ILE 192 CO -0.09 0.42 0.10 -0.69 -1.23 0.00 0.00 174.94 173.44 1bwc s VAL 193 N 0.49 4.58 0.00 2.92 1.01 0.16 -0.40 120.40 129.17 1bwc s VAL 193 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1bwc s VAL 193 Cb -0.12 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1bwc s VAL 193 CO -0.00 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1bwc n GLY 194 N 4.92 3.17 0.00 4.51 0.00 -0.72 -0.02 105.19 117.04 1bwc n GLY 194 Ca -0.16 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1bwc n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwc n ALA 195 N -1.98 1.20 -2.42 4.61 0.00 -1.26 -4.62 120.51 116.04 1bwc n ALA 195 Ca 0.00 -0.55 -0.12 0.00 0.00 0.00 0.00 53.44 52.77 1bwc n ALA 195 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1bwc n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwc n GLY 196 N -0.12 0.69 0.26 0.00 0.00 -1.26 -0.72 105.19 104.03 1bwc n GLY 196 Ca 0.00 -1.99 -0.00 0.00 0.00 0.00 0.00 46.02 44.03 1bwc n GLY 196 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1bwc h TYR 197 N -0.51 0.51 -0.40 1.61 -0.00 -1.97 -2.22 116.97 114.00 1bwc h TYR 197 Ca -0.17 -0.06 -0.05 0.00 -0.00 0.00 0.00 58.73 58.45 1bwc h TYR 197 Cb 0.63 -0.15 -0.02 0.00 -0.00 0.00 0.00 36.73 37.20 1bwc h TYR 197 CO 0.00 0.54 0.06 0.82 -0.00 0.00 0.00 178.16 179.58 1bwc h ILE 198 N 0.47 1.24 -0.12 -0.90 2.04 -1.94 -1.26 117.51 117.05 1bwc h ILE 198 Ca 0.10 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 1bwc h ILE 198 Cb 0.38 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1bwc h ILE 198 CO 0.02 0.30 0.07 0.00 0.00 0.00 0.00 178.15 178.54 1bwc h ALA 199 N 0.92 0.15 -0.31 1.87 0.00 -1.69 -1.35 119.26 118.85 1bwc h ALA 199 Ca 0.12 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1bwc h ALA 199 Cb 0.38 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1bwc h ALA 199 CO 0.01 -0.35 0.08 0.28 0.00 0.00 0.00 179.25 179.27 1bwc h VAL 200 N 0.13 0.88 -0.47 0.00 2.07 -1.35 -0.98 116.25 116.54 1bwc h VAL 200 Ca 0.04 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1bwc h VAL 200 Cb 0.02 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1bwc h VAL 200 CO -0.01 0.04 0.27 -0.33 0.02 0.00 0.00 177.57 177.56 1bwc h GLU 201 N 0.20 0.64 -0.42 1.57 5.08 -1.03 -1.40 114.58 119.21 1bwc h GLU 201 Ca 0.14 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1bwc h GLU 201 Cb 0.14 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1bwc h GLU 201 CO -0.17 0.49 0.10 0.52 -1.00 0.00 0.00 179.01 178.95 1bwc h MET 202 N 0.62 0.68 -0.87 2.33 2.86 -1.06 -1.65 114.93 117.83 1bwc h MET 202 Ca 0.17 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1bwc h MET 202 Cb 0.03 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 1bwc h MET 202 CO -0.03 0.69 0.55 0.00 1.06 0.00 0.00 176.91 179.18 1bwc h ALA 203 N 0.96 1.33 -0.22 6.32 0.00 -1.03 -1.56 119.26 125.05 1bwc h ALA 203 Ca 0.13 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 1bwc h ALA 203 Cb 0.32 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1bwc h ALA 203 CO 0.00 0.60 -0.61 0.78 0.00 0.00 0.00 179.25 180.02 1bwc h GLY 204 N 1.20 0.89 0.89 0.00 0.00 -0.91 -1.45 103.07 103.69 1bwc h GLY 204 Ca 0.32 -1.12 -0.01 0.00 0.00 0.00 0.00 47.33 46.51 1bwc h GLY 204 CO -0.06 1.01 -0.08 -2.22 0.00 0.00 0.00 176.54 175.19 1bwc h ILE 205 N 0.56 0.90 -0.47 2.60 2.04 -1.21 -2.10 117.51 119.82 1bwc h ILE 205 Ca -0.01 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1bwc h ILE 205 Cb 1.23 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1bwc h ILE 205 CO 0.13 0.06 0.21 -0.07 0.00 0.00 0.00 178.15 178.47 1bwc h LEU 206 N -0.32 0.64 -0.45 1.44 3.38 -1.28 -2.38 115.31 116.33 1bwc h LEU 206 Ca -0.02 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 1bwc h LEU 206 Cb 0.25 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1bwc h LEU 206 CO 0.04 0.61 0.02 -1.28 0.09 0.00 0.00 178.44 177.92 1bwc h SER 207 N 0.62 0.76 -0.98 -0.43 0.87 -1.33 -1.26 113.55 111.79 1bwc h SER 207 Ca 0.16 -0.29 0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1bwc h SER 207 Cb 0.16 -0.20 -0.07 0.00 -0.44 0.00 0.00 62.40 61.85 1bwc h SER 207 CO -0.02 0.86 0.63 0.00 -0.53 0.00 0.00 176.83 177.78 1bwc h ALA 208 N 0.92 1.37 0.00 6.23 0.00 -1.20 -2.11 119.26 124.47 1bwc h ALA 208 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1bwc h ALA 208 Cb 0.46 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1bwc h ALA 208 CO 0.02 0.41 -0.20 1.28 0.00 0.00 0.00 179.25 180.75 1bwc n LEU 209 N -4.53 0.28 0.00 0.00 4.77 -0.91 -4.82 117.00 111.79 1bwc n LEU 209 Ca 0.15 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1bwc n LEU 209 Cb 0.19 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1bwc n LEU 209 CO 0.32 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1bwc n GLY 210 N 1.47 1.44 3.74 -0.72 0.00 -0.79 -4.82 105.19 105.51 1bwc n GLY 210 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1bwc n GLY 210 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bwc s SER 211 N -1.94 7.08 -0.50 1.61 0.15 -0.52 -4.97 113.70 114.60 1bwc s SER 211 Ca 0.00 2.30 -0.27 0.00 0.70 0.00 0.00 55.95 58.68 1bwc s SER 211 Cb 0.00 -2.62 -0.01 0.00 -1.71 0.00 0.00 66.02 61.68 1bwc s SER 211 CO 0.00 -0.35 1.73 -0.54 1.20 0.00 0.00 173.24 175.28 1bwc s LYS 212 N -0.63 3.03 -0.13 5.44 -0.14 -0.62 -4.21 119.74 122.48 1bwc s LYS 212 Ca 0.51 0.86 -0.02 0.00 -1.36 0.00 0.00 55.97 55.95 1bwc s LYS 212 Cb -0.33 -4.26 -0.03 0.00 -1.68 0.00 0.00 37.83 31.53 1bwc s LYS 212 CO 0.39 -2.24 -0.04 0.99 -0.76 0.00 0.00 175.35 173.69 1bwc s THR 213 N 7.60 3.85 0.07 2.17 2.01 -1.26 -0.94 115.64 129.15 1bwc s THR 213 Ca 0.68 -0.39 0.07 0.00 0.31 0.00 0.00 61.69 62.37 1bwc s THR 213 Cb -0.15 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 1bwc s THR 213 CO 0.26 0.53 -0.17 -0.44 -0.69 0.00 0.00 174.62 174.11 1bwc s SER 214 N -0.02 3.92 -0.16 3.53 0.01 -0.30 -1.72 113.70 118.96 1bwc s SER 214 Ca 0.01 -0.45 0.01 0.00 1.31 0.00 0.00 55.95 56.83 1bwc s SER 214 Cb -0.13 -0.63 0.01 0.00 0.21 0.00 0.00 66.02 65.47 1bwc s SER 214 CO 0.03 0.23 -0.18 -0.22 0.41 0.00 0.00 173.24 173.50 1bwc s LEU 215 N -1.73 2.31 -0.28 2.44 2.96 0.70 -1.06 118.68 124.01 1bwc s LEU 215 Ca 0.16 -0.54 -0.08 0.00 -0.22 0.00 0.00 54.13 53.45 1bwc s LEU 215 Cb -0.11 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.06 1bwc s LEU 215 CO 0.08 0.06 0.11 -0.32 -1.32 0.00 0.00 176.35 174.96 1bwc s MET 216 N 0.93 3.42 0.10 1.98 -2.45 0.47 -0.59 119.30 123.16 1bwc s MET 216 Ca -0.04 -0.65 0.07 0.00 -1.25 0.00 0.00 55.69 53.83 1bwc s MET 216 Cb -0.15 -3.44 -0.03 0.00 1.25 0.00 0.00 34.83 32.46 1bwc s MET 216 CO -0.03 -0.33 -0.19 0.96 1.05 0.00 0.00 175.02 176.48 1bwc s ILE 217 N 1.59 1.58 -0.29 10.11 -4.36 -0.80 -1.76 121.20 127.27 1bwc s ILE 217 Ca 0.05 -1.52 0.21 0.00 -0.26 0.00 0.00 60.65 59.12 1bwc s ILE 217 Cb -0.16 -1.47 0.24 0.00 1.25 0.00 0.00 42.46 42.32 1bwc s ILE 217 CO 0.05 -0.12 1.58 0.03 0.24 0.00 0.00 174.94 176.71 1bwc h ARG 218 N 4.05 0.00 0.00 0.37 3.08 -1.86 -1.02 114.38 119.00 1bwc h ARG 218 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1bwc h ARG 218 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1bwc h ARG 218 CO 0.41 0.18 0.00 0.72 -1.07 0.00 0.00 179.97 180.21 1bwc n HIS 219 N -3.16 0.00 0.19 3.04 8.25 -1.26 -3.89 115.22 118.39 1bwc n HIS 219 Ca 0.03 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.57 1bwc n HIS 219 Cb 0.59 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.57 1bwc n HIS 219 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1bwc n ASP 220 N 0.00 0.98 -4.12 0.41 5.75 -1.26 -1.23 116.55 117.07 1bwc n ASP 220 Ca 0.00 -0.22 -0.12 0.00 -0.01 0.00 0.00 54.79 54.43 1bwc n ASP 220 Cb 0.00 1.59 -0.11 0.00 -1.03 0.00 0.00 41.12 41.58 1bwc n ASP 220 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1bwc s LYS 221 N -3.05 0.69 0.54 0.11 1.02 -1.26 -4.96 119.74 112.82 1bwc s LYS 221 Ca -0.03 -1.02 -0.04 0.00 0.02 0.00 0.00 55.97 54.89 1bwc s LYS 221 Cb 0.11 -0.30 -0.00 0.00 -0.52 0.00 0.00 37.83 37.12 1bwc s LYS 221 CO 0.71 0.03 0.83 0.14 -0.92 0.00 0.00 175.35 176.14 1bwc s VAL 222 N -2.33 3.90 -1.16 3.17 -7.23 -1.26 -4.65 120.40 110.83 1bwc s VAL 222 Ca 0.00 -0.10 -0.09 0.00 -1.81 0.00 0.00 61.98 59.98 1bwc s VAL 222 Cb -0.03 -3.51 -0.03 0.00 0.56 0.00 0.00 36.38 33.37 1bwc s VAL 222 CO -0.02 -0.48 0.82 0.18 -0.31 0.00 0.00 175.10 175.29 1bwc n LEU 223 N -2.41 -3.88 0.02 1.32 4.77 0.10 -4.51 117.00 112.40 1bwc n LEU 223 Ca 0.03 -0.84 0.13 0.00 -0.03 0.00 0.00 56.01 55.30 1bwc n LEU 223 Cb 0.57 -2.77 0.47 0.00 -2.33 0.00 0.00 43.42 39.36 1bwc n LEU 223 CO 0.51 0.33 0.79 0.54 -1.33 0.00 0.00 177.39 178.23 1bwc n ARG 224 N -3.90 0.05 0.00 3.23 1.74 -1.26 -1.94 116.66 114.58 1bwc n ARG 224 Ca -0.16 0.03 0.13 0.00 -0.77 0.00 0.00 57.85 57.09 1bwc n ARG 224 Cb 0.63 -1.55 0.48 0.00 -1.02 0.00 0.00 32.46 31.00 1bwc n ARG 224 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1bwc n SER 225 N -1.63 0.37 -4.94 0.55 3.41 -1.26 -4.90 113.62 105.21 1bwc n SER 225 Ca 0.06 -0.16 -0.24 0.00 -0.26 0.00 0.00 58.87 58.26 1bwc n SER 225 Cb 0.36 -0.08 0.04 0.00 -0.26 0.00 0.00 64.21 64.27 1bwc n SER 225 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1bwc s PHE 226 N -2.80 3.04 0.41 7.33 0.40 -0.82 -5.02 117.98 120.52 1bwc s PHE 226 Ca 0.18 0.36 -0.26 0.00 -0.60 0.00 0.00 56.93 56.62 1bwc s PHE 226 Cb 0.19 -2.84 -0.10 0.00 0.51 0.00 0.00 43.02 40.78 1bwc s PHE 226 CO 0.57 -0.97 1.28 -3.47 0.70 0.00 0.00 175.22 173.33 1bwc n ASP 227 N -2.57 2.64 0.25 1.36 -0.08 -1.26 -4.64 116.55 112.24 1bwc n ASP 227 Ca 0.06 1.12 0.11 0.00 -1.51 0.00 0.00 54.79 54.58 1bwc n ASP 227 Cb 0.59 -1.51 0.63 0.00 2.34 0.00 0.00 41.12 43.17 1bwc n ASP 227 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1bwc h SER 228 N 2.17 0.00 -0.39 1.67 4.64 -1.93 -0.06 113.55 119.65 1bwc h SER 228 Ca -0.48 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1bwc h SER 228 Cb 1.29 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.35 1bwc h SER 228 CO 0.60 0.17 0.22 -0.03 -0.87 0.00 0.00 176.83 176.92 1bwc h MET 229 N 0.00 0.42 0.03 4.77 -1.53 -1.99 -1.23 114.93 115.41 1bwc h MET 229 Ca -0.00 -0.03 -0.00 0.00 -3.44 0.00 0.00 59.70 56.23 1bwc h MET 229 Cb 0.49 -0.10 0.00 0.00 -0.55 0.00 0.00 31.60 31.44 1bwc h MET 229 CO 0.02 0.28 -0.02 0.82 0.14 0.00 0.00 176.91 178.16 1bwc h ILE 230 N 0.44 1.25 -0.62 1.77 1.08 -1.40 -0.29 117.51 119.74 1bwc h ILE 230 Ca 0.16 -0.91 0.12 0.00 -0.39 0.00 0.00 64.86 63.85 1bwc h ILE 230 Cb 0.03 1.85 -0.12 0.00 -3.07 0.00 0.00 36.82 35.52 1bwc h ILE 230 CO -0.09 0.23 -0.15 -1.28 -0.69 0.00 0.00 178.15 176.17 1bwc h SER 231 N -0.44 -0.56 0.03 1.72 0.87 -1.24 0.55 113.55 114.47 1bwc h SER 231 Ca -0.00 0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1bwc h SER 231 Cb 0.41 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 1bwc h SER 231 CO 0.01 -0.20 -0.01 0.74 -0.53 0.00 0.00 176.83 176.83 1bwc h THR 232 N 0.00 1.33 -0.34 2.23 2.02 -1.18 -2.60 112.91 114.37 1bwc h THR 232 Ca 0.30 -1.15 -0.05 0.00 0.77 0.00 0.00 66.41 66.28 1bwc h THR 232 Cb 0.46 2.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 1bwc h THR 232 CO -0.63 0.29 -0.01 -1.13 0.37 0.00 0.00 175.52 174.41 1bwc h ASN 233 N -0.54 0.51 -0.08 4.18 -1.24 -0.77 -2.15 115.58 115.49 1bwc h ASN 233 Ca -0.00 -0.10 -0.18 0.00 0.71 0.00 0.00 56.30 56.72 1bwc h ASN 233 Cb 0.51 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.42 1bwc h ASN 233 CO 0.01 0.58 -0.61 0.00 -1.29 0.00 0.00 177.43 176.12 1bwc h THR 235 N 0.51 1.26 -0.37 0.00 2.02 -1.11 -1.52 112.91 113.70 1bwc h THR 235 Ca -0.00 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 1bwc h THR 235 Cb 1.19 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1bwc h THR 235 CO 0.12 0.32 0.06 -0.33 0.37 0.00 0.00 175.52 176.06 1bwc h GLU 236 N 1.21 0.62 0.00 6.66 5.08 -1.25 -2.81 114.58 124.09 1bwc h GLU 236 Ca 0.29 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1bwc h GLU 236 Cb 0.12 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1bwc h GLU 236 CO -0.04 0.68 -0.37 0.93 -1.00 0.00 0.00 179.01 179.22 1bwc h GLU 237 N 0.46 0.00 -0.10 2.33 4.39 -0.90 -0.31 114.58 120.45 1bwc h GLU 237 Ca 0.11 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.79 1bwc h GLU 237 Cb 0.36 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1bwc h GLU 237 CO 0.01 0.37 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.14 1bwc h LEU 238 N 0.00 0.18 -0.64 1.33 3.38 -1.28 -1.19 115.31 117.10 1bwc h LEU 238 Ca -0.00 -0.34 0.08 0.00 0.09 0.00 0.00 57.88 57.71 1bwc h LEU 238 Cb 0.84 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.48 1bwc h LEU 238 CO 0.05 0.48 0.29 -0.33 0.09 0.00 0.00 178.44 179.02 1bwc h GLU 239 N -0.12 0.51 -0.17 1.13 5.08 -1.25 -0.31 114.58 119.46 1bwc h GLU 239 Ca 0.03 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 1bwc h GLU 239 Cb 0.39 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1bwc h GLU 239 CO 0.01 0.34 -0.24 -0.91 -1.00 0.00 0.00 179.01 177.21 1bwc h ASN 240 N 0.52 0.30 0.21 1.42 2.35 -0.95 -1.73 115.58 117.70 1bwc h ASN 240 Ca 0.31 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1bwc h ASN 240 Cb 0.31 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1bwc h ASN 240 CO -0.25 0.54 -0.03 0.00 -1.65 0.00 0.00 177.43 176.04 1bwc n ALA 241 N -2.48 2.65 -0.23 -0.83 0.00 -0.46 -4.89 120.51 114.27 1bwc n ALA 241 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1bwc n ALA 241 Cb 0.36 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1bwc n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwc n GLY 242 N 1.15 0.87 3.69 0.00 0.00 -0.65 -4.90 105.19 105.35 1bwc n GLY 242 Ca 0.19 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1bwc n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bwc s VAL 243 N -2.00 4.46 -0.51 1.61 1.01 -0.16 -4.73 120.40 120.07 1bwc s VAL 243 Ca 0.00 1.76 -0.29 0.00 0.00 0.00 0.00 61.98 63.45 1bwc s VAL 243 Cb 0.00 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 32.28 1bwc s VAL 243 CO 0.00 0.02 1.17 -0.70 0.00 0.00 0.00 175.10 175.59 1bwc s GLU 244 N 2.01 3.64 -0.39 2.72 2.12 -0.70 -3.81 118.70 124.29 1bwc s GLU 244 Ca 0.53 0.46 -0.21 0.00 0.36 0.00 0.00 54.97 56.11 1bwc s GLU 244 Cb -0.23 -3.95 0.01 0.00 0.26 0.00 0.00 34.13 30.22 1bwc s GLU 244 CO 0.21 -1.51 0.68 0.08 -0.54 0.00 0.00 175.26 174.19 1bwc s VAL 245 N 4.69 4.82 -0.64 3.70 1.01 -1.26 -0.21 120.40 132.50 1bwc s VAL 245 Ca 0.47 0.52 -0.19 0.00 0.00 0.00 0.00 61.98 62.77 1bwc s VAL 245 Cb -0.07 -4.16 0.10 0.00 0.00 0.00 0.00 36.38 32.25 1bwc s VAL 245 CO 0.30 -0.44 0.80 -0.76 0.00 0.00 0.00 175.10 174.99 1bwc s LEU 246 N 2.87 5.21 0.31 3.92 1.43 0.25 -4.96 118.68 127.71 1bwc s LEU 246 Ca 0.26 -1.45 -0.23 0.00 -1.03 0.00 0.00 54.13 51.68 1bwc s LEU 246 Cb -0.14 -2.33 -0.10 0.00 0.03 0.00 0.00 46.19 43.66 1bwc s LEU 246 CO 0.17 -1.16 0.87 -0.54 0.23 0.00 0.00 176.35 175.92 1bwc s LYS 247 N 2.87 4.40 -1.39 1.70 1.02 -1.26 -1.90 119.74 125.17 1bwc s LYS 247 Ca 0.16 1.12 -0.09 0.00 0.02 0.00 0.00 55.97 57.18 1bwc s LYS 247 Cb -0.20 -2.70 0.01 0.00 -0.52 0.00 0.00 37.83 34.42 1bwc s LYS 247 CO 0.05 0.25 1.11 1.19 -0.92 0.00 0.00 175.35 177.03 1bwc n PHE 248 N 0.35 -2.75 -4.22 3.18 3.72 -0.37 -4.73 117.46 112.64 1bwc n PHE 248 Ca 0.02 0.95 -0.20 0.00 -0.05 0.00 0.00 57.45 58.17 1bwc n PHE 248 Cb 0.51 -4.93 -0.12 0.00 -0.94 0.00 0.00 39.48 34.00 1bwc n PHE 248 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1bwc s SER 249 N -3.24 2.00 -0.15 4.37 0.01 -0.47 -1.04 113.70 115.19 1bwc s SER 249 Ca 0.56 -0.70 -0.13 0.00 1.31 0.00 0.00 55.95 56.99 1bwc s SER 249 Cb -0.25 -0.08 0.04 0.00 0.21 0.00 0.00 66.02 65.94 1bwc s SER 249 CO 0.69 -0.07 0.39 -1.10 0.41 0.00 0.00 173.24 173.57 1bwc s GLN 250 N -2.09 0.45 0.15 12.44 -0.21 -0.62 -3.99 119.66 125.79 1bwc s GLN 250 Ca 0.04 0.56 -0.30 0.00 0.02 0.00 0.00 55.36 55.68 1bwc s GLN 250 Cb -0.08 0.20 -0.07 0.00 1.00 0.00 0.00 33.01 34.06 1bwc s GLN 250 CO 0.03 -0.06 1.13 0.08 -2.12 0.00 0.00 175.29 174.35 1bwc s VAL 251 N 0.31 3.88 -0.12 1.09 1.01 -1.26 -1.77 120.40 123.53 1bwc s VAL 251 Ca -0.01 1.55 0.07 0.00 0.00 0.00 0.00 61.98 63.60 1bwc s VAL 251 Cb -0.03 -3.99 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 1bwc s VAL 251 CO -0.01 0.24 -0.01 0.29 0.00 0.00 0.00 175.10 175.61 1bwc n LYS 252 N 2.70 1.62 -3.67 2.72 4.76 0.11 -4.91 118.16 121.49 1bwc n LYS 252 Ca 0.04 0.02 -0.02 0.00 -2.87 0.00 0.00 58.31 55.48 1bwc n LYS 252 Cb 0.46 -1.29 -0.01 0.00 -1.84 0.00 0.00 35.03 32.35 1bwc n LYS 252 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1bwc s GLU 253 N -2.28 0.81 -0.04 1.97 -1.05 -1.19 -4.16 118.70 112.75 1bwc s GLU 253 Ca -0.10 -0.43 0.03 0.00 -0.15 0.00 0.00 54.97 54.32 1bwc s GLU 253 Cb 0.04 0.29 0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1bwc s GLU 253 CO 0.42 -0.37 -0.11 0.08 0.95 0.00 0.00 175.26 176.24 1bwc s VAL 254 N -2.90 0.99 0.04 1.83 1.01 -0.25 -0.72 120.40 120.39 1bwc s VAL 254 Ca 0.12 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 61.74 1bwc s VAL 254 Cb 0.01 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 1bwc s VAL 254 CO -0.02 0.31 -0.21 -0.54 0.00 0.00 0.00 175.10 174.64 1bwc s LYS 255 N 0.40 1.44 0.15 2.72 1.02 -0.62 -4.01 119.74 120.84 1bwc s LYS 255 Ca -0.08 -0.92 -0.30 0.00 0.02 0.00 0.00 55.97 54.69 1bwc s LYS 255 Cb -0.12 -1.54 -0.07 0.00 -0.52 0.00 0.00 37.83 35.58 1bwc s LYS 255 CO 0.02 0.40 1.11 0.21 -0.92 0.00 0.00 175.35 176.16 1bwc s LYS 256 N -1.09 4.56 0.01 1.68 2.20 -1.26 -0.63 119.74 125.21 1bwc s LYS 256 Ca 0.08 1.71 0.00 0.00 -0.36 0.00 0.00 55.97 57.39 1bwc s LYS 256 Cb -0.09 -3.30 -0.00 0.00 -1.51 0.00 0.00 37.83 32.93 1bwc s LYS 256 CO 0.01 0.01 0.00 0.25 -0.36 0.00 0.00 175.35 175.27 1bwc n THR 257 N 2.75 0.00 0.12 3.43 -2.24 0.99 -4.88 114.28 114.45 1bwc n THR 257 Ca 0.04 -0.07 -0.02 0.00 -2.27 0.00 0.00 64.05 61.73 1bwc n THR 257 Cb 0.46 0.02 0.12 0.00 -2.10 0.00 0.00 70.33 68.83 1bwc n THR 257 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1bwc h LEU 258 N 0.00 0.00 -3.26 3.22 3.38 -1.99 -3.29 115.31 113.37 1bwc h LEU 258 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1bwc h LEU 258 Cb 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1bwc h LEU 258 CO 0.02 0.68 -0.01 -1.54 0.09 0.00 0.00 178.44 177.69 1bwc n SER 259 N -3.69 3.51 0.00 -0.43 3.41 -1.26 -5.06 113.62 110.10 1bwc n SER 259 Ca -0.01 -3.17 0.00 0.00 -0.26 0.00 0.00 58.87 55.44 1bwc n SER 259 Cb 0.68 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1bwc n SER 259 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bwc n GLY 260 N -0.70 0.45 3.90 5.00 0.00 -1.24 -4.34 105.19 108.26 1bwc n GLY 260 Ca 0.23 -1.87 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 1bwc n GLY 260 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwc s LEU 261 N 0.00 4.09 -0.11 0.99 1.43 0.06 -0.01 118.68 125.13 1bwc s LEU 261 Ca 0.00 0.72 0.03 0.00 -1.03 0.00 0.00 54.13 53.85 1bwc s LEU 261 Cb 0.00 -3.52 0.01 0.00 0.03 0.00 0.00 46.19 42.70 1bwc s LEU 261 CO 0.00 -0.16 -0.21 -0.70 0.23 0.00 0.00 176.35 175.51 1bwc s GLU 262 N -3.40 2.77 -0.22 1.70 2.12 0.20 -1.33 118.70 120.54 1bwc s GLU 262 Ca 0.44 -0.77 -0.06 0.00 0.36 0.00 0.00 54.97 54.94 1bwc s GLU 262 Cb -0.11 -2.19 -0.02 0.00 0.26 0.00 0.00 34.13 32.07 1bwc s GLU 262 CO 0.28 0.06 0.01 0.08 -0.54 0.00 0.00 175.26 175.16 1bwc s VAL 263 N 0.64 3.94 -0.22 3.70 1.01 0.90 -1.59 120.40 128.79 1bwc s VAL 263 Ca -0.12 -0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.34 1bwc s VAL 263 Cb -0.16 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 1bwc s VAL 263 CO 0.03 0.40 0.65 -0.44 0.00 0.00 0.00 175.10 175.74 1bwc s SER 264 N 1.31 6.68 0.06 3.32 0.01 0.10 0.08 113.70 125.26 1bwc s SER 264 Ca 0.04 0.83 0.09 0.00 1.31 0.00 0.00 55.95 58.22 1bwc s SER 264 Cb -0.15 -2.36 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1bwc s SER 264 CO 0.01 -0.32 -0.26 0.00 0.41 0.00 0.00 173.24 173.08 1bwc s MET 265 N 2.16 1.76 -0.04 12.44 0.23 -0.52 0.04 119.30 135.38 1bwc s MET 265 Ca 0.29 -1.14 -0.25 0.00 -1.03 0.00 0.00 55.69 53.56 1bwc s MET 265 Cb -0.16 -1.99 -0.04 0.00 -1.53 0.00 0.00 34.83 31.11 1bwc s MET 265 CO 0.10 0.50 0.75 0.08 -2.03 0.00 0.00 175.02 174.42 1bwc s VAL 266 N -0.87 4.97 -0.22 5.16 1.01 -0.73 -1.24 120.40 128.49 1bwc s VAL 266 Ca 0.12 1.57 -0.08 0.00 0.00 0.00 0.00 61.98 63.60 1bwc s VAL 266 Cb -0.10 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1bwc s VAL 266 CO 0.03 0.26 0.07 -0.89 0.00 0.00 0.00 175.10 174.57 1bwc s THR 267 N 0.69 4.59 -0.58 3.92 2.01 0.45 -1.59 115.64 125.13 1bwc s THR 267 Ca 0.40 -0.09 0.06 0.00 0.31 0.00 0.00 61.69 62.37 1bwc s THR 267 Cb -0.19 -3.11 0.25 0.00 0.01 0.00 0.00 72.50 69.46 1bwc s THR 267 CO 0.20 0.38 0.68 0.00 -0.69 0.00 0.00 174.62 175.19 1bwc n ALA 268 N 4.33 3.63 -2.07 7.40 0.00 -0.20 -0.89 120.51 132.70 1bwc n ALA 268 Ca -0.16 -4.41 -0.42 0.00 0.00 0.00 0.00 53.44 48.45 1bwc n ALA 268 Cb 0.52 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 19.06 1bwc n ALA 268 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1bwc s VAL 269 N -2.09 3.69 0.00 0.00 1.01 -1.26 -4.91 120.40 116.84 1bwc s VAL 269 Ca 0.38 0.83 0.00 0.00 0.00 0.00 0.00 61.98 63.19 1bwc s VAL 269 Cb 0.14 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1bwc s VAL 269 CO -0.04 -0.10 0.00 -2.65 0.00 0.00 0.00 175.10 172.31 1bwc n PRO 270 N 7.13 0.00 -1.56 2.72 -0.02 -1.26 -1.17 135.00 140.84 1bwc n PRO 270 Ca 0.17 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.56 1bwc n PRO 270 Cb 0.43 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.88 1bwc n PRO 270 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bwc n GLY 271 N 0.00 0.75 3.35 -1.23 0.00 -1.26 -5.00 105.19 101.80 1bwc n GLY 271 Ca 0.00 -0.57 -0.18 0.00 0.00 0.00 0.00 46.02 45.27 1bwc n GLY 271 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bwc s ARG 272 N -3.33 1.54 0.14 1.61 0.52 -0.31 -5.14 118.95 113.97 1bwc s ARG 272 Ca 0.00 -1.86 -0.26 0.00 -0.52 0.00 0.00 55.73 53.09 1bwc s ARG 272 Cb 0.00 -0.25 -0.07 0.00 0.52 0.00 0.00 34.95 35.15 1bwc s ARG 272 CO 0.00 -0.37 0.80 -0.51 0.02 0.00 0.00 175.30 175.24 1bwc s LEU 273 N -3.37 4.56 0.22 2.53 1.43 -1.26 -4.75 118.68 118.04 1bwc s LEU 273 Ca 0.36 1.64 -0.32 0.00 -1.03 0.00 0.00 54.13 54.78 1bwc s LEU 273 Cb 0.06 -3.33 -0.13 0.00 0.03 0.00 0.00 46.19 42.82 1bwc s LEU 273 CO 0.15 0.15 1.56 -2.65 0.23 0.00 0.00 176.35 175.80 1bwc n PRO 274 N 1.92 2.36 -4.69 1.29 -0.02 -1.26 -4.75 135.00 129.84 1bwc n PRO 274 Ca -0.04 0.85 -0.25 0.00 -2.02 0.00 0.00 63.50 62.04 1bwc n PRO 274 Cb 0.49 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.20 1bwc n PRO 274 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1bwc s VAL 275 N 0.49 1.25 -0.20 -1.45 0.11 -0.07 -4.99 120.40 115.55 1bwc s VAL 275 Ca 0.72 -0.59 -0.14 0.00 -2.93 0.00 0.00 61.98 59.04 1bwc s VAL 275 Cb -0.60 -1.10 -0.04 0.00 -1.53 0.00 0.00 36.38 33.11 1bwc s VAL 275 CO 0.42 0.37 0.29 -0.04 -3.33 0.00 0.00 175.10 172.82 1bwc s MET 276 N 0.29 4.17 0.27 1.54 -1.94 -1.26 -0.41 119.30 121.95 1bwc s MET 276 Ca -0.08 0.03 0.03 0.00 -1.71 0.00 0.00 55.69 53.96 1bwc s MET 276 Cb -0.13 -3.50 -0.06 0.00 2.01 0.00 0.00 34.83 33.16 1bwc s MET 276 CO 0.03 0.08 0.04 0.95 -0.01 0.00 0.00 175.02 176.11 1bwc s THR 277 N 0.95 0.95 -0.11 2.05 -4.23 -0.37 -5.01 115.64 109.88 1bwc s THR 277 Ca 0.15 -2.02 0.03 0.00 -1.18 0.00 0.00 61.69 58.67 1bwc s THR 277 Cb -0.14 -2.55 0.01 0.00 1.34 0.00 0.00 72.50 71.15 1bwc s THR 277 CO 0.05 -0.14 -0.21 -0.32 -0.54 0.00 0.00 174.62 173.46 1bwc s MET 278 N -3.92 2.80 -0.44 3.99 1.75 -1.26 -1.44 119.30 120.79 1bwc s MET 278 Ca 0.33 -0.79 -0.16 0.00 -1.25 0.00 0.00 55.69 53.82 1bwc s MET 278 Cb 0.07 -2.19 0.04 0.00 2.84 0.00 0.00 34.83 35.59 1bwc s MET 278 CO 0.12 0.09 0.41 0.42 -0.65 0.00 0.00 175.02 175.40 1bwc s ILE 279 N 0.57 5.15 0.57 10.11 1.01 0.11 -4.93 121.20 133.79 1bwc s ILE 279 Ca -0.14 -0.63 -0.07 0.00 0.00 0.00 0.00 60.65 59.81 1bwc s ILE 279 Cb -0.17 -4.05 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 1bwc s ILE 279 CO 0.04 -0.47 0.89 -2.16 0.00 0.00 0.00 174.94 173.25 1bwc s PRO 280 N 1.93 3.16 -0.56 2.79 0.04 -1.26 -0.07 135.00 141.02 1bwc s PRO 280 Ca 0.08 0.16 -0.01 0.00 0.04 0.00 0.00 61.00 61.27 1bwc s PRO 280 Cb -0.20 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1bwc s PRO 280 CO 0.11 -0.57 0.18 -0.25 0.04 0.00 0.00 177.00 176.51 1bwc n ASP 281 N -2.53 -3.08 -4.57 6.66 8.00 -0.87 -4.94 116.55 115.21 1bwc n ASP 281 Ca 0.04 -0.09 -0.39 0.00 0.71 0.00 0.00 54.79 55.06 1bwc n ASP 281 Cb 0.56 -2.07 -0.11 0.00 -0.02 0.00 0.00 41.12 39.49 1bwc n ASP 281 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1bwc s VAL 282 N -2.69 5.29 0.04 2.53 1.01 -0.44 -4.68 120.40 121.45 1bwc s VAL 282 Ca 0.09 0.08 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1bwc s VAL 282 Cb -0.04 -3.61 -0.18 0.00 0.00 0.00 0.00 36.38 32.55 1bwc s VAL 282 CO 0.11 0.15 1.14 0.44 0.00 0.00 0.00 175.10 176.94 1bwc h ASP 283 N 8.40 0.00 -3.09 3.32 3.32 -1.50 0.20 116.42 127.07 1bwc h ASP 283 Ca -0.33 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.27 1bwc h ASP 283 Cb 1.18 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.32 1bwc h ASP 283 CO 0.59 0.93 -0.75 0.00 -1.72 0.00 0.00 179.24 178.29 1bwc s LEU 285 N 2.14 3.67 -0.23 0.00 2.96 -1.26 -0.70 118.68 125.26 1bwc s LEU 285 Ca 0.02 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 53.85 1bwc s LEU 285 Cb -0.16 -1.99 0.04 0.00 0.50 0.00 0.00 46.19 44.59 1bwc s LEU 285 CO -0.08 -0.00 -0.14 -0.22 -1.32 0.00 0.00 176.35 174.58 1bwc s LEU 286 N 1.45 2.94 -0.32 -0.68 2.96 -0.00 -0.11 118.68 124.91 1bwc s LEU 286 Ca 0.06 -1.08 -0.28 0.00 -0.22 0.00 0.00 54.13 52.60 1bwc s LEU 286 Cb -0.15 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.02 1bwc s LEU 286 CO 0.05 -0.12 1.03 0.26 -1.32 0.00 0.00 176.35 176.26 1bwc s TRP 287 N 1.19 3.15 -0.53 5.38 0.52 0.24 -0.66 118.94 128.22 1bwc s TRP 287 Ca -0.03 1.12 0.07 0.00 0.02 0.00 0.00 56.10 57.28 1bwc s TRP 287 Cb -0.17 -3.64 0.24 0.00 -1.15 0.00 0.00 33.47 28.75 1bwc s TRP 287 CO -0.08 -0.75 0.63 0.00 0.02 0.00 0.00 176.95 176.77 1bwc n ALA 288 N 6.80 3.32 0.25 0.98 0.00 0.97 -4.30 120.51 128.52 1bwc n ALA 288 Ca 0.11 -4.13 0.03 0.00 0.00 0.00 0.00 53.44 49.45 1bwc n ALA 288 Cb 0.47 -0.86 0.01 0.00 0.00 0.00 0.00 19.45 19.07 1bwc n ALA 288 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1bwc n ILE 289 N 1.19 0.00 0.00 0.00 -5.35 -1.25 -4.13 119.36 109.82 1bwc n ILE 289 Ca 0.26 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 1bwc n ILE 289 Cb 0.46 1.10 0.00 0.00 -1.74 0.00 0.00 39.64 39.46 1bwc n ILE 289 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bwc n GLY 290 N 0.51 2.34 3.46 3.28 0.00 -1.26 -5.00 105.19 108.52 1bwc n GLY 290 Ca 0.03 -1.51 -0.30 0.00 0.00 0.00 0.00 46.02 44.23 1bwc n GLY 290 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bwc s ARG 291 N -1.90 1.94 0.08 1.61 1.81 -1.26 -1.28 118.95 119.96 1bwc s ARG 291 Ca 0.00 -1.06 0.07 0.00 -1.72 0.00 0.00 55.73 53.02 1bwc s ARG 291 Cb 0.00 -2.14 -0.04 0.00 -0.45 0.00 0.00 34.95 32.32 1bwc s ARG 291 CO 0.00 0.52 -0.14 0.14 -0.68 0.00 0.00 175.30 175.14 1bwc s VAL 292 N -0.99 3.09 0.60 3.52 -7.23 0.80 -4.82 120.40 115.37 1bwc s VAL 292 Ca 0.15 -1.27 -0.15 0.00 -1.81 0.00 0.00 61.98 58.90 1bwc s VAL 292 Cb -0.10 -2.39 -0.03 0.00 0.56 0.00 0.00 36.38 34.41 1bwc s VAL 292 CO 0.07 0.19 1.06 -2.16 -0.31 0.00 0.00 175.10 173.95 1bwc s PRO 293 N -1.92 3.29 -1.14 4.82 0.04 -1.26 0.04 135.00 138.88 1bwc s PRO 293 Ca 0.18 1.18 -0.13 0.00 0.04 0.00 0.00 61.00 62.27 1bwc s PRO 293 Cb -0.11 -2.03 0.19 0.00 0.04 0.00 0.00 34.50 32.59 1bwc s PRO 293 CO 0.10 -0.83 1.30 -0.80 0.04 0.00 0.00 177.00 176.81 1bwc s ASN 294 N -2.88 7.06 0.00 6.66 -0.87 -0.09 -4.60 114.94 120.22 1bwc s ASN 294 Ca 0.63 -3.01 0.00 0.00 -1.57 0.00 0.00 52.86 48.91 1bwc s ASN 294 Cb -0.16 -2.35 0.00 0.00 -0.02 0.00 0.00 41.25 38.72 1bwc s ASN 294 CO 0.38 -0.67 0.04 0.35 -2.57 0.00 0.00 177.10 174.63 1bwc n THR 295 N 4.27 0.00 0.25 1.60 -2.24 -1.26 -4.77 114.28 112.13 1bwc n THR 295 Ca 0.31 -0.22 0.11 0.00 -2.27 0.00 0.00 64.05 61.98 1bwc n THR 295 Cb 0.43 1.09 0.65 0.00 -2.10 0.00 0.00 70.33 70.40 1bwc n THR 295 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1bwc h LYS 296 N 0.00 0.00 -0.26 -0.78 3.11 -1.93 -2.91 116.57 113.80 1bwc h LYS 296 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1bwc h LYS 296 Cb 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.28 1bwc h LYS 296 CO 0.00 0.16 0.00 -0.25 -2.81 0.00 0.00 179.45 176.55 1bwc n ASP 297 N -3.74 2.68 -0.41 4.20 8.00 -1.26 -4.55 116.55 121.48 1bwc n ASP 297 Ca -0.02 -1.95 0.13 0.00 0.71 0.00 0.00 54.79 53.66 1bwc n ASP 297 Cb 0.27 -0.18 0.37 0.00 -0.02 0.00 0.00 41.12 41.56 1bwc n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1bwc n LEU 298 N 0.34 1.44 -3.85 0.64 4.77 -1.10 -4.62 117.00 114.62 1bwc n LEU 298 Ca 0.09 -0.45 -0.27 0.00 -0.03 0.00 0.00 56.01 55.36 1bwc n LEU 298 Cb 0.38 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1bwc n LEU 298 CO 0.06 0.25 -0.17 -1.20 -1.33 0.00 0.00 177.39 175.01 1bwc n SER 299 N -0.15 -1.71 0.19 -1.43 7.64 -1.26 -1.60 113.62 115.29 1bwc n SER 299 Ca 0.14 -0.99 0.03 0.00 1.01 0.00 0.00 58.87 59.07 1bwc n SER 299 Cb 0.38 -3.26 0.37 0.00 -1.01 0.00 0.00 64.21 60.69 1bwc n SER 299 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1bwc h LEU 300 N -1.87 0.00 -0.83 -3.43 3.38 -1.92 -2.86 115.31 107.78 1bwc h LEU 300 Ca -0.64 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.33 1bwc h LEU 300 Cb 1.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 1bwc h LEU 300 CO 0.58 0.38 -0.02 -0.55 0.09 0.00 0.00 178.44 178.92 1bwc h ASN 301 N 0.00 0.00 -0.19 -0.43 -1.07 -1.89 -1.34 115.58 110.65 1bwc h ASN 301 Ca -0.00 0.00 0.06 0.00 0.07 0.00 0.00 56.30 56.42 1bwc h ASN 301 Cb 0.71 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.95 1bwc h ASN 301 CO 0.05 0.02 0.18 0.11 0.07 0.00 0.00 177.43 177.86 1bwc h LYS 302 N 0.00 0.00 -0.01 4.14 1.57 -1.85 -2.84 116.57 117.58 1bwc h LYS 302 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1bwc h LYS 302 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1bwc h LYS 302 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1bwc n LEU 303 N -4.02 1.35 -2.90 2.94 4.77 -0.56 -4.86 117.00 113.73 1bwc n LEU 303 Ca 0.02 -1.05 -0.17 0.00 -0.03 0.00 0.00 56.01 54.78 1bwc n LEU 303 Cb 0.31 -0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1bwc n LEU 303 CO 0.30 0.30 0.16 0.61 -1.33 0.00 0.00 177.39 177.43 1bwc n GLY 304 N 0.19 -0.20 3.74 -0.72 0.00 -0.88 -4.98 105.19 102.34 1bwc n GLY 304 Ca 0.02 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1bwc n GLY 304 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bwc s ILE 305 N -3.26 4.61 -0.00 -0.61 1.01 -1.07 -4.86 121.20 117.03 1bwc s ILE 305 Ca 0.32 1.83 -0.30 0.00 0.00 0.00 0.00 60.65 62.50 1bwc s ILE 305 Cb -0.14 -4.21 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 1bwc s ILE 305 CO 0.57 0.35 1.02 -1.10 0.00 0.00 0.00 174.94 175.78 1bwc s GLN 306 N -0.07 4.52 0.40 2.79 -0.21 -1.26 -4.79 119.66 121.05 1bwc s GLN 306 Ca 0.42 1.48 0.07 0.00 0.02 0.00 0.00 55.36 57.36 1bwc s GLN 306 Cb -0.22 -3.45 -0.07 0.00 1.00 0.00 0.00 33.01 30.27 1bwc s GLN 306 CO 0.26 -0.12 0.03 0.95 -2.12 0.00 0.00 175.29 174.30 1bwc s THR 307 N 1.14 2.08 0.01 -0.19 -4.23 -1.26 -1.70 115.64 111.50 1bwc s THR 307 Ca 0.53 -1.96 -0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1bwc s THR 307 Cb -0.22 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1bwc s THR 307 CO 0.27 -0.02 0.01 -0.90 -0.54 0.00 0.00 174.62 173.44 1bwc n ASP 308 N -1.00 0.01 0.15 3.99 5.68 -0.84 -4.88 116.55 119.66 1bwc n ASP 308 Ca -0.04 -1.01 0.13 0.00 -0.50 0.00 0.00 54.79 53.36 1bwc n ASP 308 Cb 0.66 -0.01 0.50 0.00 -1.14 0.00 0.00 41.12 41.14 1bwc n ASP 308 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1bwc h ASP 309 N -0.01 0.00 -0.02 -1.12 2.03 -2.02 -2.05 116.42 113.23 1bwc h ASP 309 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1bwc h ASP 309 Cb 0.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.51 1bwc h ASP 309 CO 0.00 0.00 -0.02 0.29 -1.03 0.00 0.00 179.24 178.49 1bwc n LYS 310 N -2.38 1.47 -0.45 4.15 5.02 -1.26 -4.99 118.16 119.73 1bwc n LYS 310 Ca 0.02 -1.52 0.00 0.00 -2.02 0.00 0.00 58.31 54.79 1bwc n LYS 310 Cb 0.27 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.94 1bwc n LYS 310 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bwc n GLY 311 N 1.01 0.77 3.72 0.72 0.00 -0.77 -4.52 105.19 106.12 1bwc n GLY 311 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1bwc n GLY 311 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1bwc n HIS 312 N -2.36 2.38 -2.85 1.61 8.25 -1.26 -4.69 115.22 116.29 1bwc n HIS 312 Ca 0.00 0.50 -0.41 0.00 -0.26 0.00 0.00 57.72 57.55 1bwc n HIS 312 Cb 0.00 -2.42 -0.04 0.00 1.12 0.00 0.00 29.99 28.65 1bwc n HIS 312 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1bwc s ILE 313 N -1.16 4.76 -0.11 1.59 1.01 -0.65 -1.98 121.20 124.66 1bwc s ILE 313 Ca 0.58 1.84 -0.25 0.00 0.00 0.00 0.00 60.65 62.82 1bwc s ILE 313 Cb -0.51 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 37.72 1bwc s ILE 313 CO 0.60 0.28 0.79 -0.63 0.00 0.00 0.00 174.94 175.97 1bwc s ILE 314 N 0.39 4.95 0.19 2.92 -1.09 -0.69 -4.50 121.20 123.38 1bwc s ILE 314 Ca 0.44 1.58 0.05 0.00 -2.23 0.00 0.00 60.65 60.50 1bwc s ILE 314 Cb -0.21 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.51 1bwc s ILE 314 CO 0.25 0.13 -0.09 0.68 -1.23 0.00 0.00 174.94 174.69 1bwc s VAL 315 N 1.50 1.32 0.00 2.92 -7.23 -1.26 -4.26 120.40 113.39 1bwc s VAL 315 Ca 0.39 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.46 1bwc s VAL 315 Cb -0.17 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.73 1bwc s VAL 315 CO 0.16 -0.60 0.00 -0.90 -0.31 0.00 0.00 175.10 173.45 1bwc n ASP 316 N -0.31 0.00 0.00 4.85 5.68 -0.63 -4.91 116.55 121.23 1bwc n ASP 316 Ca -0.08 -0.88 0.11 0.00 -0.50 0.00 0.00 54.79 53.43 1bwc n ASP 316 Cb 0.61 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 41.15 1bwc n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1bwc n GLU 317 N -0.88 0.38 -0.14 0.11 4.71 -1.26 -1.51 120.64 122.05 1bwc n GLU 317 Ca 0.00 0.07 0.07 0.00 -0.01 0.00 0.00 57.16 57.29 1bwc n GLU 317 Cb 0.00 -1.50 0.14 0.00 -1.01 0.00 0.00 31.44 29.07 1bwc n GLU 317 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1bwc n PHE 318 N -1.23 0.36 -1.46 -0.32 3.72 -1.26 -4.53 117.46 112.74 1bwc n PHE 318 Ca 0.11 -0.32 -0.10 0.00 -0.05 0.00 0.00 57.45 57.10 1bwc n PHE 318 Cb 0.15 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.64 1bwc n PHE 318 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1bwc n GLN 319 N 0.77 -0.71 -2.68 -1.08 1.13 -0.57 -4.93 117.38 109.31 1bwc n GLN 319 Ca 0.12 0.78 -0.41 0.00 -1.94 0.00 0.00 57.00 55.55 1bwc n GLN 319 Cb 0.42 -4.73 -0.04 0.00 0.11 0.00 0.00 30.24 26.00 1bwc n GLN 319 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1bwc s ASN 320 N -2.83 7.40 1.21 1.08 0.01 -1.26 -1.90 114.94 118.65 1bwc s ASN 320 Ca 0.00 1.80 -0.17 0.00 -0.71 0.00 0.00 52.86 53.78 1bwc s ASN 320 Cb 0.00 -2.58 0.25 0.00 0.41 0.00 0.00 41.25 39.33 1bwc s ASN 320 CO 0.00 -0.17 0.89 0.35 -1.51 0.00 0.00 177.10 176.66 1bwc n THR 321 N 3.17 0.00 0.63 1.60 -2.24 -0.90 -1.61 114.28 114.94 1bwc n THR 321 Ca 0.04 -0.38 0.10 0.00 -2.27 0.00 0.00 64.05 61.54 1bwc n THR 321 Cb 0.49 -1.18 0.42 0.00 -2.10 0.00 0.00 70.33 67.97 1bwc n THR 321 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1bwc n ASN 322 N -4.57 0.14 -4.54 3.42 6.94 -1.26 -4.73 115.26 110.66 1bwc n ASN 322 Ca 0.12 0.53 -0.35 0.00 -0.02 0.00 0.00 54.58 54.86 1bwc n ASN 322 Cb 0.48 -0.56 -0.11 0.00 -2.36 0.00 0.00 39.78 37.23 1bwc n ASN 322 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1bwc s VAL 323 N -3.05 4.48 0.21 3.53 1.01 -1.26 -5.07 120.40 120.25 1bwc s VAL 323 Ca 0.09 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.63 1bwc s VAL 323 Cb 0.12 -3.04 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 1bwc s VAL 323 CO 0.38 0.41 1.39 -0.75 0.00 0.00 0.00 175.10 176.53 1bwc s LYS 324 N 0.87 4.32 0.00 2.72 2.36 -1.26 -2.15 119.74 126.60 1bwc s LYS 324 Ca 0.03 2.17 0.00 0.00 -2.55 0.00 0.00 55.97 55.63 1bwc s LYS 324 Cb -0.14 -3.16 0.00 0.00 -1.05 0.00 0.00 37.83 33.48 1bwc s LYS 324 CO 0.02 -0.36 0.00 0.41 1.55 0.00 0.00 175.35 176.97 1bwc n GLY 325 N 2.54 0.82 3.23 5.54 0.00 -1.26 -5.04 105.19 111.02 1bwc n GLY 325 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1bwc n GLY 325 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bwc s ILE 326 N -3.16 1.94 0.24 -0.61 1.01 -0.92 -1.02 121.20 118.68 1bwc s ILE 326 Ca 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 60.65 59.69 1bwc s ILE 326 Cb 0.00 -1.65 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 1bwc s ILE 326 CO 0.00 0.54 0.01 -0.31 0.00 0.00 0.00 174.94 175.18 1bwc s TYR 327 N -0.03 1.59 -0.11 3.97 2.02 -0.08 -2.11 117.35 122.60 1bwc s TYR 327 Ca -0.07 -0.94 -0.09 0.00 -0.37 0.00 0.00 57.07 55.61 1bwc s TYR 327 Cb -0.14 -0.94 0.04 0.00 -0.40 0.00 0.00 41.96 40.52 1bwc s TYR 327 CO 0.04 -0.06 0.29 0.00 -1.57 0.00 0.00 175.55 174.26 1bwc s ALA 328 N -3.43 -0.70 0.14 3.71 0.00 -0.80 -0.65 121.76 120.03 1bwc s ALA 328 Ca 0.30 0.94 0.06 0.00 0.00 0.00 0.00 51.96 53.25 1bwc s ALA 328 Cb 0.06 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 1bwc s ALA 328 CO 0.10 -0.17 -0.13 0.14 0.00 0.00 0.00 175.76 175.70 1bwc s VAL 329 N 0.60 1.32 0.00 0.00 -7.23 -1.12 -4.71 120.40 109.26 1bwc s VAL 329 Ca -0.04 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 1bwc s VAL 329 Cb -0.05 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.21 1bwc s VAL 329 CO -0.04 -0.54 0.00 0.61 -0.31 0.00 0.00 175.10 174.82 1bwc n GLY 330 N 0.20 -0.74 0.28 2.32 0.00 -1.26 -4.31 105.19 101.68 1bwc n GLY 330 Ca -0.13 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.38 1bwc n GLY 330 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bwc h ASP 331 N 2.23 0.11 0.36 1.61 5.19 -1.89 -1.72 116.42 122.31 1bwc h ASP 331 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1bwc h ASP 331 Cb 0.00 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.48 1bwc h ASP 331 CO 0.00 0.08 0.00 1.62 -3.12 0.00 0.00 179.24 177.82 1bwc h VAL 332 N 0.13 0.00 0.00 -1.35 3.04 -1.75 -0.92 116.25 115.40 1bwc h VAL 332 Ca 0.05 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 1bwc h VAL 332 Cb 0.03 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.42 1bwc h VAL 332 CO -0.01 0.00 -1.07 0.00 -1.01 0.00 0.00 177.57 175.48 1bwc n GLY 334 N 1.35 0.57 3.14 0.00 0.00 -0.35 -4.69 105.19 105.21 1bwc n GLY 334 Ca 0.01 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 1bwc n GLY 334 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bwc s LYS 335 N -0.94 2.83 -0.42 1.61 2.20 -1.26 -4.87 119.74 118.88 1bwc s LYS 335 Ca 0.00 -0.78 -0.22 0.00 -0.36 0.00 0.00 55.97 54.60 1bwc s LYS 335 Cb 0.00 -2.31 0.03 0.00 -1.51 0.00 0.00 37.83 34.04 1bwc s LYS 335 CO 0.00 -0.03 0.58 0.00 -0.36 0.00 0.00 175.35 175.54 1bwc n ALA 336 N 4.12 -2.79 -2.63 3.13 0.00 -1.26 -4.79 120.51 116.29 1bwc n ALA 336 Ca -0.20 0.87 -0.43 0.00 0.00 0.00 0.00 53.44 53.68 1bwc n ALA 336 Cb 0.51 -3.14 0.00 0.00 0.00 0.00 0.00 19.45 16.82 1bwc n ALA 336 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1bwc n LEU 337 N -0.19 5.94 -3.99 0.00 4.32 -1.26 -4.75 117.00 117.07 1bwc n LEU 337 Ca 0.05 -4.54 -0.10 0.00 -0.02 0.00 0.00 56.01 51.40 1bwc n LEU 337 Cb 0.51 -1.55 -0.11 0.00 -1.62 0.00 0.00 43.42 40.65 1bwc n LEU 337 CO 0.49 1.04 -0.37 -0.76 -1.22 0.00 0.00 177.39 176.58 1bwc s LEU 338 N 0.78 2.24 0.11 2.23 1.43 -1.26 -5.07 118.68 119.14 1bwc s LEU 338 Ca 0.41 -0.50 -0.20 0.00 -1.03 0.00 0.00 54.13 52.82 1bwc s LEU 338 Cb 0.04 0.06 -0.07 0.00 0.03 0.00 0.00 46.19 46.24 1bwc s LEU 338 CO 0.00 -0.28 1.72 0.74 0.23 0.00 0.00 176.35 178.77 1bwc h THR 339 N 4.64 1.10 0.00 5.49 2.02 -2.00 -2.48 112.91 121.68 1bwc h THR 339 Ca -0.32 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 66.56 1bwc h THR 339 Cb 1.21 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 1bwc h THR 339 CO 0.41 0.09 -0.21 -0.65 0.37 0.00 0.00 175.52 175.54 1bwc h PRO 340 N 0.24 0.00 -0.00 6.66 0.11 -1.97 -1.21 132.00 135.82 1bwc h PRO 340 Ca 0.07 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 1bwc h PRO 340 Cb 0.05 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.16 1bwc h PRO 340 CO -0.01 0.21 -0.00 0.28 -0.21 0.00 0.00 178.00 178.26 1bwc h VAL 341 N 0.00 1.36 -0.72 3.15 2.07 -1.85 -1.02 116.25 119.23 1bwc h VAL 341 Ca -0.00 -1.05 0.14 0.00 0.82 0.00 0.00 66.70 66.61 1bwc h VAL 341 Cb 0.63 2.06 -0.10 0.00 -1.52 0.00 0.00 31.29 32.37 1bwc h VAL 341 CO 0.03 0.27 0.23 0.00 0.02 0.00 0.00 177.57 178.12 1bwc h ALA 342 N 0.56 0.97 0.47 1.67 0.00 -1.10 -1.33 119.26 120.49 1bwc h ALA 342 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1bwc h ALA 342 Cb 0.45 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1bwc h ALA 342 CO 0.00 -0.28 -0.23 0.82 0.00 0.00 0.00 179.25 179.57 1bwc h ILE 343 N 0.35 0.47 -0.84 0.00 2.04 -1.18 -1.90 117.51 116.45 1bwc h ILE 343 Ca 0.40 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.94 1bwc h ILE 343 Cb 0.64 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1bwc h ILE 343 CO -0.44 0.06 0.53 0.00 0.00 0.00 0.00 178.15 178.30 1bwc h ALA 344 N -0.47 1.13 -0.62 1.87 0.00 -1.04 0.01 119.26 120.14 1bwc h ALA 344 Ca -0.06 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1bwc h ALA 344 Cb 0.58 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1bwc h ALA 344 CO 0.11 0.33 0.08 0.00 0.00 0.00 0.00 179.25 179.77 1bwc h ALA 345 N 1.37 0.96 -0.63 0.00 0.00 -1.30 0.04 119.26 119.70 1bwc h ALA 345 Ca 0.35 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1bwc h ALA 345 Cb 0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1bwc h ALA 345 CO -0.14 0.64 0.03 0.78 0.00 0.00 0.00 179.25 180.56 1bwc h GLY 346 N 1.03 1.18 0.87 0.00 0.00 -0.57 -2.10 103.07 103.48 1bwc h GLY 346 Ca 0.19 -0.85 -0.11 0.00 0.00 0.00 0.00 47.33 46.56 1bwc h GLY 346 CO 0.01 0.78 -0.31 3.21 0.00 0.00 0.00 176.54 180.23 1bwc h ARG 347 N 1.00 0.54 -0.38 4.80 3.08 -0.88 -2.49 114.38 120.06 1bwc h ARG 347 Ca 0.18 -0.33 0.05 0.00 0.07 0.00 0.00 59.98 59.95 1bwc h ARG 347 Cb 0.54 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.58 1bwc h ARG 347 CO 0.03 0.94 0.12 0.87 -1.07 0.00 0.00 179.97 180.86 1bwc h LYS 348 N 0.19 0.27 -0.86 0.04 6.56 -0.97 -1.96 116.57 119.84 1bwc h LYS 348 Ca 0.01 -0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.61 1bwc h LYS 348 Cb 0.90 -0.06 -0.05 0.00 -0.57 0.00 0.00 32.23 32.45 1bwc h LYS 348 CO 0.07 0.18 0.56 1.25 -2.06 0.00 0.00 179.45 179.45 1bwc h LEU 349 N 0.28 0.96 -1.22 2.94 5.85 -1.40 -1.25 115.31 121.47 1bwc h LEU 349 Ca 0.17 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1bwc h LEU 349 Cb 0.16 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1bwc h LEU 349 CO -0.19 0.68 -0.17 0.00 -0.34 0.00 0.00 178.44 178.42 1bwc h ALA 350 N 1.33 1.36 -0.60 1.25 0.00 -1.09 -0.95 119.26 120.56 1bwc h ALA 350 Ca 0.33 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1bwc h ALA 350 Cb -0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1bwc h ALA 350 CO -0.09 0.44 0.08 0.45 0.00 0.00 0.00 179.25 180.13 1bwc h HIS 351 N 0.30 1.08 -0.23 0.00 3.86 -0.72 -2.25 115.15 117.19 1bwc h HIS 351 Ca 0.05 -0.16 -0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1bwc h HIS 351 Cb 0.48 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1bwc h HIS 351 CO 0.01 0.93 0.13 -0.09 0.86 0.00 0.00 177.93 179.77 1bwc h ARG 352 N 0.91 0.32 0.03 2.45 2.43 -0.53 -1.32 114.38 118.67 1bwc h ARG 352 Ca 0.18 -0.03 -0.24 0.00 -0.81 0.00 0.00 59.98 59.08 1bwc h ARG 352 Cb 0.45 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1bwc h ARG 352 CO 0.02 0.28 -1.01 -0.07 -1.51 0.00 0.00 179.97 177.68 1bwc h LEU 353 N 0.27 0.49 0.00 3.80 3.38 -1.18 -2.65 115.31 119.42 1bwc h LEU 353 Ca 0.08 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1bwc h LEU 353 Cb 0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1bwc h LEU 353 CO -0.01 1.24 -0.25 0.49 0.09 0.00 0.00 178.44 180.00 1bwc n PHE 354 N -3.69 0.00 0.58 1.13 3.72 -0.85 -4.31 117.46 114.04 1bwc n PHE 354 Ca -0.07 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.41 1bwc n PHE 354 Cb 0.88 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.49 1bwc n PHE 354 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1bwc n GLU 355 N -1.12 1.31 -1.52 -1.08 2.13 -0.53 -4.94 120.64 114.89 1bwc n GLU 355 Ca 0.00 -1.50 -0.13 0.00 0.66 0.00 0.00 57.16 56.19 1bwc n GLU 355 Cb 0.01 -1.31 -0.05 0.00 0.27 0.00 0.00 31.44 30.37 1bwc n GLU 355 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1bwc n TYR 356 N 0.89 -0.51 -1.98 4.31 4.01 -1.00 -4.87 117.16 118.00 1bwc n TYR 356 Ca 0.10 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.53 1bwc n TYR 356 Cb 0.40 -2.59 -0.04 0.00 -0.31 0.00 0.00 39.34 36.79 1bwc n TYR 356 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1bwc s LYS 357 N -3.36 2.48 0.45 -0.72 -0.14 -1.15 -4.85 119.74 112.45 1bwc s LYS 357 Ca 0.00 0.19 0.29 0.00 -1.36 0.00 0.00 55.97 55.08 1bwc s LYS 357 Cb 0.00 -4.77 0.96 0.00 -1.68 0.00 0.00 37.83 32.33 1bwc s LYS 357 CO 0.00 -3.22 1.82 1.05 -0.76 0.00 0.00 175.35 174.24 1bwc h GLU 358 N 13.18 0.00 -0.54 1.68 -0.00 -1.89 -2.45 114.58 124.56 1bwc h GLU 358 Ca -0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.29 1bwc h GLU 358 Cb 1.08 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.82 1bwc h GLU 358 CO 1.19 0.00 0.01 -0.40 -0.00 0.00 0.00 179.01 179.82 1bwc n ASP 359 N -2.91 5.45 -4.60 3.06 5.75 -1.26 -4.92 116.55 117.12 1bwc n ASP 359 Ca 0.02 -2.97 -0.43 0.00 -0.01 0.00 0.00 54.79 51.41 1bwc n ASP 359 Cb 0.38 -0.67 -0.03 0.00 -1.03 0.00 0.00 41.12 39.77 1bwc n ASP 359 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1bwc s SER 360 N -0.97 6.64 0.08 -1.12 0.15 -0.92 -5.00 113.70 112.56 1bwc s SER 360 Ca 0.53 0.46 -0.21 0.00 0.70 0.00 0.00 55.95 57.44 1bwc s SER 360 Cb 0.41 -2.51 0.05 0.00 -1.71 0.00 0.00 66.02 62.26 1bwc s SER 360 CO 0.15 -1.08 0.50 -1.59 1.20 0.00 0.00 173.24 172.41 1bwc s LYS 361 N 3.99 1.07 -0.15 5.44 -2.85 -1.26 -4.60 119.74 121.37 1bwc s LYS 361 Ca 0.43 -0.38 -0.23 0.00 -1.00 0.00 0.00 55.97 54.79 1bwc s LYS 361 Cb -0.09 0.48 -0.02 0.00 -2.06 0.00 0.00 37.83 36.14 1bwc s LYS 361 CO 0.26 -0.40 0.73 -1.17 0.10 0.00 0.00 175.35 174.87 1bwc s LEU 362 N -2.26 4.20 -0.14 2.77 2.96 -1.26 -5.02 118.68 119.93 1bwc s LEU 362 Ca -0.03 1.06 -0.29 0.00 -0.22 0.00 0.00 54.13 54.65 1bwc s LEU 362 Cb -0.00 -3.08 -0.03 0.00 0.50 0.00 0.00 46.19 43.57 1bwc s LEU 362 CO -0.06 -0.29 1.52 -0.62 -1.32 0.00 0.00 176.35 175.58 1bwc s ASP 363 N 1.09 6.68 -0.10 3.68 -1.08 -1.26 -4.94 116.67 120.74 1bwc s ASP 363 Ca 0.35 1.89 0.12 0.00 -0.52 0.00 0.00 52.55 54.39 1bwc s ASP 363 Cb -0.17 -2.53 0.53 0.00 -1.46 0.00 0.00 42.92 39.29 1bwc s ASP 363 CO 0.13 -0.96 1.38 -1.22 0.52 0.00 0.00 175.17 175.02 1bwc n TYR 364 N 7.32 1.18 -3.84 -5.34 4.02 -1.26 -4.90 117.16 114.34 1bwc n TYR 364 Ca 0.17 -0.45 -0.34 0.00 -0.01 0.00 0.00 57.90 57.27 1bwc n TYR 364 Cb 0.44 -0.25 -0.05 0.00 -0.02 0.00 0.00 39.34 39.47 1bwc n TYR 364 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 1bwc s ASN 365 N -0.72 6.42 -1.42 7.72 0.02 -1.26 -4.45 114.94 121.26 1bwc s ASN 365 Ca 0.37 0.44 -0.10 0.00 -1.02 0.00 0.00 52.86 52.54 1bwc s ASN 365 Cb 0.25 -2.04 0.04 0.00 0.02 0.00 0.00 41.25 39.52 1bwc s ASN 365 CO 0.16 0.24 1.10 0.59 0.02 0.00 0.00 177.10 179.22 1bwc n ASN 366 N 0.94 -5.65 -4.67 -1.22 5.03 -1.26 -4.95 115.26 103.49 1bwc n ASN 366 Ca -0.10 -0.63 -0.43 0.00 0.87 0.00 0.00 54.58 54.29 1bwc n ASN 366 Cb 0.53 -4.61 -0.03 0.00 -1.02 0.00 0.00 39.78 34.65 1bwc n ASN 366 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1bwc s ILE 367 N -3.32 4.74 0.36 2.41 1.01 -1.26 -4.79 121.20 120.35 1bwc s ILE 367 Ca 0.59 1.94 -0.19 0.00 0.00 0.00 0.00 60.65 62.99 1bwc s ILE 367 Cb -0.28 -4.27 -0.10 0.00 0.01 0.00 0.00 42.46 37.82 1bwc s ILE 367 CO 0.77 -0.11 0.85 -2.16 0.00 0.00 0.00 174.94 174.29 1bwc s PRO 368 N 2.78 4.19 -0.02 2.79 0.04 -1.26 -4.55 135.00 138.97 1bwc s PRO 368 Ca 0.43 0.95 0.04 0.00 0.04 0.00 0.00 61.00 62.47 1bwc s PRO 368 Cb -0.16 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.97 1bwc s PRO 368 CO 0.10 0.11 -0.13 0.99 0.04 0.00 0.00 177.00 178.10 1bwc s THR 369 N -1.98 1.09 -0.16 1.26 2.01 -0.23 -5.02 115.64 112.61 1bwc s THR 369 Ca 0.56 -0.56 -0.03 0.00 0.31 0.00 0.00 61.69 61.97 1bwc s THR 369 Cb -0.11 -0.93 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 1bwc s THR 369 CO 0.17 0.32 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.66 1bwc s VAL 370 N -0.14 3.64 -0.22 3.82 1.01 -1.26 -1.61 120.40 125.64 1bwc s VAL 370 Ca 0.02 -0.44 -0.10 0.00 0.00 0.00 0.00 61.98 61.46 1bwc s VAL 370 Cb -0.07 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1bwc s VAL 370 CO 0.00 0.49 0.13 -0.69 0.00 0.00 0.00 175.10 175.03 1bwc s VAL 371 N 0.49 5.17 -1.26 2.92 1.01 -0.49 -4.97 120.40 123.27 1bwc s VAL 371 Ca -0.05 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 1bwc s VAL 371 Cb -0.15 -3.39 0.17 0.00 0.00 0.00 0.00 36.38 33.02 1bwc s VAL 371 CO 0.03 0.39 2.08 0.49 0.00 0.00 0.00 175.10 178.09 1bwc n PHE 372 N 4.04 2.68 -1.48 5.22 3.72 -1.26 -0.92 117.46 129.46 1bwc n PHE 372 Ca -0.16 -2.76 -0.02 0.00 -0.05 0.00 0.00 57.45 54.46 1bwc n PHE 372 Cb 0.52 -1.76 0.01 0.00 -0.94 0.00 0.00 39.48 37.32 1bwc n PHE 372 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1bwc n SER 373 N 2.22 0.04 -4.01 4.37 3.41 -1.26 -4.68 113.62 113.71 1bwc n SER 373 Ca 0.50 -1.05 -0.31 0.00 -0.26 0.00 0.00 58.87 57.75 1bwc n SER 373 Cb 0.29 -0.07 -0.16 0.00 -0.26 0.00 0.00 64.21 64.02 1bwc n SER 373 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1bwc s HIS 374 N -0.81 2.59 0.92 7.33 0.09 -1.26 -2.49 115.29 121.66 1bwc s HIS 374 Ca 0.06 -1.75 -0.12 0.00 -0.00 0.00 0.00 55.06 53.24 1bwc s HIS 374 Cb -0.00 -1.70 0.14 0.00 -0.00 0.00 0.00 32.58 31.02 1bwc s HIS 374 CO 0.04 -0.78 1.12 -1.25 -0.00 0.00 0.00 174.74 173.87 1bwc s PRO 375 N 1.34 1.07 0.67 8.40 0.04 -1.26 -4.75 135.00 140.50 1bwc s PRO 375 Ca -0.03 0.38 -0.13 0.00 0.04 0.00 0.00 61.00 61.26 1bwc s PRO 375 Cb -0.17 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1bwc s PRO 375 CO -0.08 -2.26 1.08 -1.25 0.04 0.00 0.00 177.00 174.53 1bwc s PRO 376 N -5.19 2.90 -0.15 0.56 0.04 -1.04 -4.58 135.00 127.54 1bwc s PRO 376 Ca 0.64 1.17 -0.04 0.00 0.04 0.00 0.00 61.00 62.81 1bwc s PRO 376 Cb -0.16 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 1bwc s PRO 376 CO 0.54 -1.14 -0.02 0.42 0.04 0.00 0.00 177.00 176.84 1bwc s ILE 377 N -2.67 4.09 -0.08 0.56 1.01 -0.09 -1.83 121.20 122.18 1bwc s ILE 377 Ca 0.62 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 61.01 1bwc s ILE 377 Cb -0.17 -2.79 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 1bwc s ILE 377 CO 0.46 0.50 -0.18 -0.83 0.00 0.00 0.00 174.94 174.89 1bwc s GLY 378 N 0.17 1.44 -0.05 6.18 0.00 0.24 -1.40 107.32 113.90 1bwc s GLY 378 Ca -0.00 -0.97 -0.04 0.00 0.00 0.00 0.00 44.72 43.71 1bwc s GLY 378 CO 0.02 -0.48 0.13 -1.08 0.00 0.00 0.00 173.10 171.68 1bwc s THR 379 N -0.06 -0.01 -0.09 0.90 -1.32 -0.63 -0.64 115.64 113.78 1bwc s THR 379 Ca -0.04 0.03 -0.11 0.00 -1.21 0.00 0.00 61.69 60.36 1bwc s THR 379 Cb -0.14 -0.19 0.03 0.00 -1.51 0.00 0.00 72.50 70.69 1bwc s THR 379 CO 0.04 0.01 0.29 0.54 -2.21 0.00 0.00 174.62 173.29 1bwc s VAL 380 N 0.23 0.01 0.00 5.08 0.11 -0.33 -1.06 120.40 124.44 1bwc s VAL 380 Ca -0.01 -0.09 0.00 0.00 -2.93 0.00 0.00 61.98 58.95 1bwc s VAL 380 Cb -0.02 -0.44 0.00 0.00 -1.53 0.00 0.00 36.38 34.39 1bwc s VAL 380 CO -0.01 -0.05 0.00 0.61 -3.33 0.00 0.00 175.10 172.32 1bwc n GLY 381 N 2.65 -0.23 3.86 6.54 0.00 -1.26 -1.26 105.19 115.49 1bwc n GLY 381 Ca -0.14 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.18 1bwc n GLY 381 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwc s LEU 382 N 0.00 4.42 0.89 0.99 1.43 0.40 -4.92 118.68 121.89 1bwc s LEU 382 Ca 0.00 0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 53.67 1bwc s LEU 382 Cb 0.00 -2.35 0.13 0.00 0.03 0.00 0.00 46.19 44.00 1bwc s LEU 382 CO 0.00 0.36 1.11 0.42 0.23 0.00 0.00 176.35 178.47 1bwc s THR 383 N -1.09 2.55 0.27 5.49 -4.23 -1.26 -4.25 115.64 113.13 1bwc s THR 383 Ca 0.20 0.18 -0.04 0.00 -1.18 0.00 0.00 61.69 60.85 1bwc s THR 383 Cb -0.14 -2.41 0.23 0.00 1.34 0.00 0.00 72.50 71.52 1bwc s THR 383 CO 0.09 -0.23 1.91 -0.08 -0.54 0.00 0.00 174.62 175.77 1bwc h GLU 384 N -1.66 1.13 0.35 3.99 4.81 -1.98 0.22 114.58 121.45 1bwc h GLU 384 Ca -0.46 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1bwc h GLU 384 Cb 1.26 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 1bwc h GLU 384 CO 0.47 0.80 -0.46 -0.44 -0.73 0.00 0.00 179.01 178.65 1bwc h ASP 385 N 1.15 -1.29 -0.87 1.04 5.19 -1.99 -1.37 116.42 118.28 1bwc h ASP 385 Ca 0.30 0.12 0.06 0.00 -0.62 0.00 0.00 57.03 56.88 1bwc h ASP 385 Cb -0.03 0.45 -0.06 0.00 0.18 0.00 0.00 39.33 39.87 1bwc h ASP 385 CO -0.05 -0.59 0.57 -0.33 -3.12 0.00 0.00 179.24 175.72 1bwc h GLU 386 N -0.85 0.97 -0.48 3.56 5.08 -1.76 -1.47 114.58 119.63 1bwc h GLU 386 Ca -0.03 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 1bwc h GLU 386 Cb 0.78 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1bwc h GLU 386 CO -0.13 0.64 0.06 0.00 -1.00 0.00 0.00 179.01 178.59 1bwc h ALA 387 N 1.52 0.64 -0.73 3.43 0.00 -0.86 -2.39 119.26 120.87 1bwc h ALA 387 Ca 0.37 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1bwc h ALA 387 Cb 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1bwc h ALA 387 CO -0.13 0.39 0.30 0.82 0.00 0.00 0.00 179.25 180.62 1bwc h ILE 388 N 0.68 1.25 0.00 0.00 2.04 -0.60 0.34 117.51 121.21 1bwc h ILE 388 Ca 0.14 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.22 1bwc h ILE 388 Cb 0.41 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1bwc h ILE 388 CO 0.01 0.31 -0.06 -0.74 0.00 0.00 0.00 178.15 177.67 1bwc h HIS 389 N 1.04 0.00 0.00 1.37 2.76 -0.94 0.61 115.15 120.00 1bwc h HIS 389 Ca 0.24 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.12 1bwc h HIS 389 Cb 0.20 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 1bwc h HIS 389 CO 0.02 0.06 -2.14 1.17 -1.30 0.00 0.00 177.93 175.74 1bwc n LYS 390 N -3.34 1.20 -0.00 5.26 0.00 -0.84 -4.53 118.16 115.91 1bwc n LYS 390 Ca -0.01 -0.02 0.01 0.00 0.00 0.00 0.00 58.31 58.29 1bwc n LYS 390 Cb 0.22 -1.43 -0.01 0.00 0.00 0.00 0.00 35.03 33.81 1bwc n LYS 390 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1bwc n TYR 391 N -2.60 0.00 -0.37 5.64 4.01 0.05 -5.09 117.16 118.80 1bwc n TYR 391 Ca -0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 1bwc n TYR 391 Cb 1.02 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 40.04 1bwc n TYR 391 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bwc n GLY 392 N 1.27 -3.06 0.22 2.72 0.00 0.20 -4.28 105.19 102.26 1bwc n GLY 392 Ca 0.00 -1.21 0.07 0.00 0.00 0.00 0.00 46.02 44.88 1bwc n GLY 392 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1bwc h ILE 393 N 0.00 0.95 0.00 -0.61 2.04 -1.93 -0.84 117.51 117.12 1bwc h ILE 393 Ca -0.00 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.02 1bwc h ILE 393 Cb 0.24 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1bwc h ILE 393 CO 0.00 0.22 -0.27 1.05 0.00 0.00 0.00 178.15 179.15 1bwc h GLU 394 N 0.00 0.00 -0.71 2.37 9.09 -1.95 -3.15 114.58 120.23 1bwc h GLU 394 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1bwc h GLU 394 Cb 0.46 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.56 1bwc h GLU 394 CO 0.03 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.18 1bwc n ASN 395 N -2.55 4.30 -4.27 3.06 3.02 -0.32 -4.88 115.26 113.61 1bwc n ASN 395 Ca 0.04 -2.17 -0.33 0.00 -0.03 0.00 0.00 54.58 52.09 1bwc n ASN 395 Cb 0.48 -0.53 -0.15 0.00 -0.61 0.00 0.00 39.78 38.97 1bwc n ASN 395 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1bwc s VAL 396 N -1.32 2.59 -0.09 2.41 1.01 -1.19 0.48 120.40 124.30 1bwc s VAL 396 Ca 0.51 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1bwc s VAL 396 Cb 0.29 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.60 1bwc s VAL 396 CO 0.31 0.53 -0.15 -0.75 0.00 0.00 0.00 175.10 175.03 1bwc s LYS 397 N 0.66 2.06 0.04 2.72 2.36 -0.31 -4.98 119.74 122.29 1bwc s LYS 397 Ca -0.09 -0.53 0.03 0.00 -2.55 0.00 0.00 55.97 52.84 1bwc s LYS 397 Cb -0.16 -1.70 -0.04 0.00 -1.05 0.00 0.00 37.83 34.89 1bwc s LYS 397 CO 0.02 0.01 -0.01 0.95 1.55 0.00 0.00 175.35 177.88 1bwc s THR 398 N 0.75 4.01 -0.01 3.43 -4.23 -1.26 0.18 115.64 118.50 1bwc s THR 398 Ca -0.12 -0.80 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 1bwc s THR 398 Cb -0.16 -2.84 -0.02 0.00 1.34 0.00 0.00 72.50 70.83 1bwc s THR 398 CO 0.03 0.27 -0.22 -0.31 -0.54 0.00 0.00 174.62 173.84 1bwc s TYR 399 N -1.17 1.98 0.19 3.99 1.51 -0.30 -5.00 117.35 118.55 1bwc s TYR 399 Ca 0.22 -0.38 -0.13 0.00 -1.01 0.00 0.00 57.07 55.78 1bwc s TYR 399 Cb -0.12 -1.27 0.01 0.00 -0.11 0.00 0.00 41.96 40.47 1bwc s TYR 399 CO 0.13 -0.02 0.40 -1.54 -1.11 0.00 0.00 175.55 173.41 1bwc s SER 400 N -0.58 -0.09 0.17 2.29 1.04 -1.26 -0.24 113.70 115.03 1bwc s SER 400 Ca 0.09 -0.73 -0.20 0.00 0.48 0.00 0.00 55.95 55.59 1bwc s SER 400 Cb -0.09 0.51 0.05 0.00 0.10 0.00 0.00 66.02 66.59 1bwc s SER 400 CO -0.01 -0.99 0.55 0.28 0.98 0.00 0.00 173.24 174.06 1bwc s THR 401 N -3.94 0.02 -0.22 2.02 -1.32 -0.42 -4.93 115.64 106.85 1bwc s THR 401 Ca 0.15 -0.43 -0.10 0.00 -1.21 0.00 0.00 61.69 60.10 1bwc s THR 401 Cb 0.01 -1.29 0.08 0.00 -1.51 0.00 0.00 72.50 69.79 1bwc s THR 401 CO 0.00 -0.10 0.51 -0.55 -2.21 0.00 0.00 174.62 172.27 1bwc s SER 402 N -2.81 -0.63 0.19 8.08 0.15 -1.26 -1.80 113.70 115.62 1bwc s SER 402 Ca 0.05 1.14 -0.16 0.00 0.70 0.00 0.00 55.95 57.68 1bwc s SER 402 Cb -0.01 1.22 0.02 0.00 -1.71 0.00 0.00 66.02 65.55 1bwc s SER 402 CO -0.08 -0.22 0.48 0.72 1.20 0.00 0.00 173.24 175.35 1bwc s PHE 403 N 1.91 -0.04 -0.30 3.44 -0.71 -0.50 -5.00 117.98 116.77 1bwc s PHE 403 Ca -0.07 -0.30 -0.13 0.00 -1.04 0.00 0.00 56.93 55.38 1bwc s PHE 403 Cb -0.09 0.32 -0.03 0.00 -1.21 0.00 0.00 43.02 42.01 1bwc s PHE 403 CO -0.15 -0.88 0.28 0.99 -1.34 0.00 0.00 175.22 174.12 1bwc s THR 404 N -3.88 5.24 0.46 -4.49 2.01 -1.26 -0.04 115.64 113.68 1bwc s THR 404 Ca 0.10 0.19 -0.22 0.00 0.31 0.00 0.00 61.69 62.07 1bwc s THR 404 Cb -0.00 -3.67 -0.10 0.00 0.01 0.00 0.00 72.50 68.74 1bwc s THR 404 CO -0.03 0.11 0.81 -2.65 -0.69 0.00 0.00 174.62 172.17 1bwc n PRO 405 N 5.21 0.95 0.29 4.92 -0.02 -1.26 -4.87 135.00 140.22 1bwc n PRO 405 Ca -0.11 0.35 0.15 0.00 -2.02 0.00 0.00 63.50 61.87 1bwc n PRO 405 Cb 0.51 -1.85 0.88 0.00 -0.02 0.00 0.00 33.50 33.01 1bwc n PRO 405 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1bwc h MET 406 N 1.02 0.00 -0.95 -0.52 4.05 -1.97 0.57 114.93 117.13 1bwc h MET 406 Ca -0.44 0.00 0.29 0.00 -0.28 0.00 0.00 59.70 59.27 1bwc h MET 406 Cb 1.37 0.00 -0.15 0.00 -0.80 0.00 0.00 31.60 32.02 1bwc h MET 406 CO 0.53 0.04 0.39 -0.92 0.23 0.00 0.00 176.91 177.18 1bwc h TYR 407 N 0.00 0.61 -0.11 1.39 3.20 -2.01 -1.42 116.97 118.63 1bwc h TYR 407 Ca -0.00 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1bwc h TYR 407 Cb 0.12 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.28 1bwc h TYR 407 CO 0.00 -0.23 0.00 0.72 -1.64 0.00 0.00 178.16 177.01 1bwc n HIS 408 N -5.17 0.13 0.03 -3.82 8.25 0.19 -4.09 115.22 110.74 1bwc n HIS 408 Ca 0.27 -0.06 0.11 0.00 -0.26 0.00 0.00 57.72 57.78 1bwc n HIS 408 Cb 0.87 0.00 0.55 0.00 1.12 0.00 0.00 29.99 32.53 1bwc n HIS 408 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bwc h ALA 409 N 4.32 2.02 -0.19 -1.41 0.00 -1.30 -2.75 119.26 119.94 1bwc h ALA 409 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bwc h ALA 409 Cb 0.62 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1bwc h ALA 409 CO 0.00 -0.10 0.00 1.33 0.00 0.00 0.00 179.25 180.48 1bwc n VAL 410 N -4.47 1.27 -4.19 0.00 0.24 -1.26 -5.02 118.33 104.90 1bwc n VAL 410 Ca 0.05 -1.25 -0.24 0.00 -2.04 0.00 0.00 64.34 60.85 1bwc n VAL 410 Cb 0.27 0.32 -0.06 0.00 -1.47 0.00 0.00 33.84 32.89 1bwc n VAL 410 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1bwc s THR 411 N -1.45 3.93 -0.04 3.34 -4.23 -1.04 -4.73 115.64 111.41 1bwc s THR 411 Ca 0.19 -1.50 -0.23 0.00 -1.18 0.00 0.00 61.69 58.97 1bwc s THR 411 Cb 0.13 -3.05 -0.26 0.00 1.34 0.00 0.00 72.50 70.66 1bwc s THR 411 CO 0.08 -0.23 0.98 0.11 -0.54 0.00 0.00 174.62 175.02 1bwc h LYS 412 N 2.17 0.26 -6.94 3.99 6.56 -1.95 -3.44 116.57 117.21 1bwc h LYS 412 Ca -0.47 -0.33 -0.54 0.00 -1.06 0.00 0.00 60.65 58.26 1bwc h LYS 412 Cb 1.22 0.11 0.10 0.00 -0.57 0.00 0.00 32.23 33.09 1bwc h LYS 412 CO 0.60 1.07 0.76 0.50 -2.06 0.00 0.00 179.45 180.33 1bwc s ARG 413 N -2.84 4.13 -0.02 3.15 3.52 -1.26 -5.03 118.95 120.60 1bwc s ARG 413 Ca -0.15 2.53 0.05 0.00 -0.13 0.00 0.00 55.73 58.03 1bwc s ARG 413 Cb 0.01 -2.98 -0.01 0.00 -1.56 0.00 0.00 34.95 30.41 1bwc s ARG 413 CO 0.78 -0.50 -0.16 0.15 -0.81 0.00 0.00 175.30 174.77 1bwc s LYS 414 N -2.07 1.36 0.18 5.12 -0.14 -1.26 -4.90 119.74 118.03 1bwc s LYS 414 Ca 0.52 -0.57 0.09 0.00 -1.36 0.00 0.00 55.97 54.65 1bwc s LYS 414 Cb -0.46 -1.29 -0.04 0.00 -1.68 0.00 0.00 37.83 34.36 1bwc s LYS 414 CO 0.62 0.32 -0.18 0.95 -0.76 0.00 0.00 175.35 176.31 1bwc s THR 415 N -0.30 1.85 0.40 2.17 -4.23 -1.26 -5.06 115.64 109.21 1bwc s THR 415 Ca 0.05 -1.98 -0.07 0.00 -1.18 0.00 0.00 61.69 58.50 1bwc s THR 415 Cb -0.07 -1.90 -0.05 0.00 1.34 0.00 0.00 72.50 71.82 1bwc s THR 415 CO -0.00 -0.35 0.72 -0.54 -0.54 0.00 0.00 174.62 173.91 1bwc s LYS 416 N -2.94 3.67 -0.23 3.99 1.02 -1.26 -4.25 119.74 119.74 1bwc s LYS 416 Ca 0.17 0.26 -0.04 0.00 0.02 0.00 0.00 55.97 56.38 1bwc s LYS 416 Cb -0.05 -2.45 -0.01 0.00 -0.52 0.00 0.00 37.83 34.80 1bwc s LYS 416 CO 0.07 -0.02 -0.04 0.00 -0.92 0.00 0.00 175.35 174.44 1bwc s VAL 418 N 1.47 3.88 0.06 0.00 -7.23 -0.47 -1.41 120.40 116.70 1bwc s VAL 418 Ca 0.05 -0.38 0.07 0.00 -1.81 0.00 0.00 61.98 59.91 1bwc s VAL 418 Cb -0.14 -2.66 -0.03 0.00 0.56 0.00 0.00 36.38 34.10 1bwc s VAL 418 CO -0.03 0.53 -0.19 -0.04 -0.31 0.00 0.00 175.10 175.06 1bwc s MET 419 N -0.06 1.19 -0.05 4.82 -1.94 -0.75 -1.42 119.30 121.09 1bwc s MET 419 Ca 0.02 -0.96 -0.02 0.00 -1.71 0.00 0.00 55.69 53.01 1bwc s MET 419 Cb -0.13 -1.32 0.04 0.00 2.01 0.00 0.00 34.83 35.42 1bwc s MET 419 CO 0.03 0.33 0.12 0.21 -0.01 0.00 0.00 175.02 175.69 1bwc s LYS 420 N -1.39 0.06 -0.23 2.03 2.20 0.11 -1.31 119.74 121.21 1bwc s LYS 420 Ca 0.05 0.33 -0.04 0.00 -0.36 0.00 0.00 55.97 55.96 1bwc s LYS 420 Cb -0.09 -0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.02 1bwc s LYS 420 CO 0.02 -0.17 -0.02 1.41 -0.36 0.00 0.00 175.35 176.23 1bwc s MET 421 N 1.21 3.38 -0.21 4.03 -2.45 0.67 -1.20 119.30 124.73 1bwc s MET 421 Ca -0.09 -0.63 -0.15 0.00 -1.25 0.00 0.00 55.69 53.57 1bwc s MET 421 Cb -0.12 -3.07 -0.04 0.00 1.25 0.00 0.00 34.83 32.85 1bwc s MET 421 CO -0.05 -0.22 0.38 0.08 1.05 0.00 0.00 175.02 176.27 1bwc s VAL 422 N 1.49 5.21 0.08 10.11 1.01 0.12 -1.15 120.40 137.26 1bwc s VAL 422 Ca 0.06 0.66 0.10 0.00 0.00 0.00 0.00 61.98 62.80 1bwc s VAL 422 Cb -0.15 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1bwc s VAL 422 CO -0.02 0.25 -0.27 0.00 0.00 0.00 0.00 175.10 175.06 1bwc s ALA 424 N -0.90 2.07 0.00 0.00 0.00 0.79 -1.16 121.76 122.56 1bwc s ALA 424 Ca 0.13 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1bwc s ALA 424 Cb -0.10 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.19 1bwc s ALA 424 CO 0.03 0.17 0.00 0.09 0.00 0.00 0.00 175.76 176.06 1bwc n ASN 425 N 3.72 0.00 -0.11 0.00 5.03 0.18 -1.34 115.26 122.74 1bwc n ASN 425 Ca -0.20 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.13 1bwc n ASN 425 Cb 0.52 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.25 1bwc n ASN 425 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 1bwc h LYS 426 N 0.00 0.74 0.00 3.52 3.64 -1.97 -2.08 116.57 120.42 1bwc h LYS 426 Ca 0.00 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1bwc h LYS 426 Cb 0.00 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1bwc h LYS 426 CO 0.00 0.96 0.00 -0.85 -2.27 0.00 0.00 179.45 177.29 1bwc n GLU 427 N -4.28 0.03 -3.46 1.90 0.00 -1.26 -4.91 120.64 108.66 1bwc n GLU 427 Ca -0.03 0.15 -0.21 0.00 0.00 0.00 0.00 57.16 57.07 1bwc n GLU 427 Cb 0.43 -1.50 0.06 0.00 0.00 0.00 0.00 31.44 30.43 1bwc n GLU 427 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1bwc n GLU 428 N -1.48 -2.83 -1.65 3.44 1.02 -0.78 -4.36 120.64 114.00 1bwc n GLU 428 Ca 0.05 0.72 -0.47 0.00 -0.02 0.00 0.00 57.16 57.44 1bwc n GLU 428 Cb 0.23 -5.27 -0.04 0.00 -0.02 0.00 0.00 31.44 26.34 1bwc n GLU 428 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1bwc n LYS 429 N -3.75 1.93 -2.46 3.49 4.81 -0.45 -0.95 118.16 120.79 1bwc n LYS 429 Ca -0.13 0.70 -0.42 0.00 -0.87 0.00 0.00 58.31 57.58 1bwc n LYS 429 Cb 0.63 -2.43 -0.02 0.00 0.02 0.00 0.00 35.03 33.23 1bwc n LYS 429 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1bwc s VAL 430 N 0.74 3.95 -1.58 3.15 1.01 0.13 -0.15 120.40 127.65 1bwc s VAL 430 Ca 0.79 0.91 0.16 0.00 0.00 0.00 0.00 61.98 63.84 1bwc s VAL 430 Cb -0.73 -4.45 0.02 0.00 0.00 0.00 0.00 36.38 31.22 1bwc s VAL 430 CO 0.41 -1.03 0.88 1.33 0.00 0.00 0.00 175.10 176.69 1bwc n VAL 431 N 6.91 0.00 -3.67 2.92 0.24 -0.58 -4.68 118.33 119.47 1bwc n VAL 431 Ca 0.13 -0.37 -0.10 0.00 -2.04 0.00 0.00 64.34 61.96 1bwc n VAL 431 Cb 0.49 1.22 -0.08 0.00 -1.47 0.00 0.00 33.84 33.99 1bwc n VAL 431 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1bwc s GLY 432 N -1.78 -0.49 -0.03 7.63 0.00 -1.04 -0.45 107.32 111.16 1bwc s GLY 432 Ca 0.14 1.92 0.04 0.00 0.00 0.00 0.00 44.72 46.83 1bwc s GLY 432 CO 0.36 1.87 -0.16 -0.42 0.00 0.00 0.00 173.10 174.76 1bwc s ILE 433 N 1.12 1.31 -0.05 0.90 1.01 -0.39 -0.71 121.20 124.40 1bwc s ILE 433 Ca -0.06 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 59.90 1bwc s ILE 433 Cb -0.06 -1.13 0.04 0.00 0.01 0.00 0.00 42.46 41.32 1bwc s ILE 433 CO -0.11 0.38 0.09 -1.00 0.00 0.00 0.00 174.94 174.31 1bwc s HIS 434 N -0.03 -0.07 0.03 3.97 3.76 -0.34 -1.18 115.29 121.43 1bwc s HIS 434 Ca -0.02 0.34 -0.14 0.00 -0.15 0.00 0.00 55.06 55.10 1bwc s HIS 434 Cb -0.10 -0.20 0.02 0.00 1.11 0.00 0.00 32.58 33.41 1bwc s HIS 434 CO 0.01 -0.15 0.29 0.00 -0.85 0.00 0.00 174.74 174.05 1bwc s MET 435 N 1.34 0.76 -0.03 1.40 0.23 0.18 0.07 119.30 123.25 1bwc s MET 435 Ca -0.07 -0.43 0.01 0.00 -1.03 0.00 0.00 55.69 54.17 1bwc s MET 435 Cb -0.12 0.33 0.02 0.00 -1.53 0.00 0.00 34.83 33.53 1bwc s MET 435 CO -0.05 -0.23 -0.01 -1.14 -2.03 0.00 0.00 175.02 171.57 1bwc s GLN 436 N -2.22 0.37 0.00 3.16 0.74 -0.51 -0.59 119.66 120.61 1bwc s GLN 436 Ca -0.07 0.04 0.00 0.00 0.05 0.00 0.00 55.36 55.38 1bwc s GLN 436 Cb -0.02 -0.51 0.00 0.00 1.10 0.00 0.00 33.01 33.57 1bwc s GLN 436 CO -0.01 -0.12 0.00 0.41 -0.55 0.00 0.00 175.29 175.02 1bwc n GLY 437 N 4.06 0.65 3.68 2.59 0.00 -0.76 -1.37 105.19 114.04 1bwc n GLY 437 Ca -0.26 -0.87 -0.48 0.00 0.00 0.00 0.00 46.02 44.41 1bwc n GLY 437 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bwc n LEU 438 N 0.00 3.33 0.00 0.99 4.77 -1.26 -2.69 117.00 122.14 1bwc n LEU 438 Ca 0.00 1.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.99 1bwc n LEU 438 Cb 0.00 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 39.70 1bwc n LEU 438 CO 0.00 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.54 1bwc n GLY 439 N 4.08 0.76 0.20 -0.72 0.00 -1.26 -4.91 105.19 103.34 1bwc n GLY 439 Ca 0.21 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.37 1bwc n GLY 439 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwc h ASP 441 N 0.00 0.87 0.41 0.00 2.03 -1.84 -3.15 116.42 114.74 1bwc h ASP 441 Ca 0.00 -0.27 0.00 0.00 -0.73 0.00 0.00 57.03 56.03 1bwc h ASP 441 Cb 0.46 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 1bwc h ASP 441 CO 0.00 0.99 -0.53 -0.62 -1.03 0.00 0.00 179.24 178.05 1bwc n GLU 442 N -4.16 0.11 0.06 4.15 -0.58 -0.96 -4.28 120.64 114.98 1bwc n GLU 442 Ca 0.02 -0.07 -0.08 0.00 -0.42 0.00 0.00 57.16 56.61 1bwc n GLU 442 Cb 0.37 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.80 1bwc n GLU 442 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 1bwc h MET 443 N 0.16 0.35 0.03 3.49 4.05 -1.38 -3.39 114.93 118.24 1bwc h MET 443 Ca 0.00 -0.27 -0.27 0.00 -0.28 0.00 0.00 59.70 58.88 1bwc h MET 443 Cb 0.50 0.05 0.02 0.00 -0.80 0.00 0.00 31.60 31.37 1bwc h MET 443 CO 0.00 0.90 -1.09 1.25 0.23 0.00 0.00 176.91 178.20 1bwc h LEU 444 N 0.25 0.87 -0.57 3.39 5.85 -1.74 -3.34 115.31 120.01 1bwc h LEU 444 Ca -0.02 -0.72 0.09 0.00 0.84 0.00 0.00 57.88 58.07 1bwc h LEU 444 Cb 1.22 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.92 1bwc h LEU 444 CO 0.11 1.52 0.20 -0.61 -0.34 0.00 0.00 178.44 179.32 1bwc h GLN 445 N 0.35 0.36 -0.81 1.25 5.75 -1.86 -0.42 115.11 119.74 1bwc h GLN 445 Ca -0.14 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.32 1bwc h GLN 445 Cb 1.74 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 30.17 1bwc h GLN 445 CO 0.21 0.24 0.43 0.78 -2.65 0.00 0.00 178.83 177.84 1bwc h GLY 446 N 0.37 1.21 2.00 2.39 0.00 -1.86 -2.07 103.07 105.11 1bwc h GLY 446 Ca 0.28 -0.56 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 1bwc h GLY 446 CO -0.30 0.53 -0.49 0.74 0.00 0.00 0.00 176.54 177.02 1bwc h PHE 447 N 1.12 0.00 -0.01 5.60 0.04 -1.28 -2.68 116.94 119.74 1bwc h PHE 447 Ca 0.28 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.88 1bwc h PHE 447 Cb 0.04 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 1bwc h PHE 447 CO 0.00 0.49 -0.78 0.00 -0.60 0.00 0.00 178.31 177.43 1bwc h ALA 448 N 1.51 0.67 -0.01 2.45 0.00 -0.78 -0.91 119.26 122.20 1bwc h ALA 448 Ca -0.00 -0.68 0.03 0.00 0.00 0.00 0.00 54.91 54.26 1bwc h ALA 448 Cb 0.88 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1bwc h ALA 448 CO 0.06 0.89 -0.23 0.28 0.00 0.00 0.00 179.25 180.26 1bwc h VAL 449 N 0.08 0.47 -0.80 0.00 2.07 -1.14 -1.30 116.25 115.63 1bwc h VAL 449 Ca -0.02 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1bwc h VAL 449 Cb 1.36 0.47 -0.08 0.00 -1.52 0.00 0.00 31.29 31.53 1bwc h VAL 449 CO 0.11 0.00 0.43 0.00 0.02 0.00 0.00 177.57 178.14 1bwc h ALA 450 N 0.51 1.14 -0.21 1.67 0.00 -1.22 -2.55 119.26 118.61 1bwc h ALA 450 Ca 0.06 0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1bwc h ALA 450 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1bwc h ALA 450 CO -0.21 0.03 -0.46 0.28 0.00 0.00 0.00 179.25 178.88 1bwc h VAL 451 N 0.71 1.31 0.00 0.00 2.07 -1.00 -2.00 116.25 117.34 1bwc h VAL 451 Ca 0.40 -1.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.24 1bwc h VAL 451 Cb 0.42 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1bwc h VAL 451 CO -0.27 0.52 -0.10 0.50 0.02 0.00 0.00 177.57 178.24 1bwc h LYS 452 N 0.43 0.00 -0.00 1.57 3.11 -0.96 -2.20 116.57 118.52 1bwc h LYS 452 Ca 0.03 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.87 1bwc h LYS 452 Cb 0.97 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.20 1bwc h LYS 452 CO 0.09 0.10 -0.01 -1.33 -2.81 0.00 0.00 179.45 175.49 1bwc n MET 453 N -3.37 1.14 -3.05 1.90 2.81 -0.88 -4.93 117.12 110.73 1bwc n MET 453 Ca -0.01 -0.26 -0.13 0.00 -1.81 0.00 0.00 57.70 55.50 1bwc n MET 453 Cb 0.28 -1.49 0.05 0.00 -0.71 0.00 0.00 33.22 31.34 1bwc n MET 453 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bwc n GLY 454 N 1.07 0.10 3.76 3.03 0.00 -0.83 -5.00 105.19 107.32 1bwc n GLY 454 Ca 0.22 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1bwc n GLY 454 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwc s ALA 455 N -3.18 3.15 0.38 4.61 0.00 -0.80 -4.82 121.76 121.09 1bwc s ALA 455 Ca 0.26 1.27 0.08 0.00 0.00 0.00 0.00 51.96 53.57 1bwc s ALA 455 Cb -0.12 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.46 1bwc s ALA 455 CO 0.40 -0.99 0.30 0.95 0.00 0.00 0.00 175.76 176.42 1bwc s THR 456 N -1.29 2.98 0.46 0.00 -4.23 -1.26 -0.70 115.64 111.61 1bwc s THR 456 Ca 0.61 -1.43 0.12 0.00 -1.18 0.00 0.00 61.69 59.82 1bwc s THR 456 Cb -0.39 -3.06 0.23 0.00 1.34 0.00 0.00 72.50 70.63 1bwc s THR 456 CO 0.49 -0.09 2.06 0.50 -0.54 0.00 0.00 174.62 177.04 1bwc h LYS 457 N 1.21 0.17 -0.49 3.99 3.64 -1.24 -1.26 116.57 122.59 1bwc h LYS 457 Ca -0.43 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 58.99 1bwc h LYS 457 Cb 1.26 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.99 1bwc h LYS 457 CO 0.59 0.19 0.19 0.00 -2.27 0.00 0.00 179.45 178.15 1bwc h ALA 458 N 1.84 0.61 -0.97 5.00 0.00 -1.85 0.66 119.26 124.56 1bwc h ALA 458 Ca 0.04 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.11 1bwc h ALA 458 Cb 0.11 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.85 1bwc h ALA 458 CO 0.00 -0.20 0.62 -0.44 0.00 0.00 0.00 179.25 179.23 1bwc h ASP 459 N 0.38 0.91 -0.18 0.00 3.32 -1.62 -0.90 116.42 118.32 1bwc h ASP 459 Ca 0.23 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.27 1bwc h ASP 459 Cb 0.23 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1bwc h ASP 459 CO -0.22 0.52 -0.04 -0.26 -1.72 0.00 0.00 179.24 177.52 1bwc h PHE 460 N 1.00 0.39 0.00 4.55 -1.00 -1.13 -3.13 116.94 117.62 1bwc h PHE 460 Ca 0.46 -0.08 -0.03 0.00 2.81 0.00 0.00 57.97 61.13 1bwc h PHE 460 Cb 0.39 -0.10 -0.00 0.00 3.61 0.00 0.00 35.95 39.85 1bwc h PHE 460 CO -0.00 0.60 -0.13 -0.44 -1.61 0.00 0.00 178.31 176.73 1bwc h ASP 461 N 0.07 0.00 -0.66 2.17 3.32 0.06 -2.35 116.42 119.03 1bwc h ASP 461 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1bwc h ASP 461 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1bwc h ASP 461 CO 0.02 0.13 0.00 0.59 -1.72 0.00 0.00 179.24 178.25 1bwc n ASN 462 N -3.44 3.81 -4.68 6.45 3.02 -0.44 -4.79 115.26 115.20 1bwc n ASN 462 Ca -0.01 -2.00 -0.40 0.00 -0.03 0.00 0.00 54.58 52.15 1bwc n ASN 462 Cb 0.29 -0.44 -0.06 0.00 -0.61 0.00 0.00 39.78 38.96 1bwc n ASN 462 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1bwc s THR 463 N -1.04 5.05 0.34 3.41 2.01 -0.88 -5.06 115.64 119.47 1bwc s THR 463 Ca 0.45 1.17 -0.29 0.00 0.31 0.00 0.00 61.69 63.33 1bwc s THR 463 Cb 0.24 -3.93 -0.11 0.00 0.01 0.00 0.00 72.50 68.71 1bwc s THR 463 CO 0.31 0.16 1.45 -0.69 -0.69 0.00 0.00 174.62 175.17 1bwc s VAL 464 N 1.57 2.29 0.55 3.82 1.01 -1.26 -4.97 120.40 123.40 1bwc s VAL 464 Ca 0.29 0.28 -0.17 0.00 0.00 0.00 0.00 61.98 62.38 1bwc s VAL 464 Cb -0.16 -3.18 -0.06 0.00 0.00 0.00 0.00 36.38 32.99 1bwc s VAL 464 CO 0.11 0.06 1.04 0.00 0.00 0.00 0.00 175.10 176.32 1bwc s ALA 465 N -0.85 2.82 -0.26 5.51 0.00 -1.26 -5.05 121.76 122.67 1bwc s ALA 465 Ca 0.54 0.42 -0.08 0.00 0.00 0.00 0.00 51.96 52.84 1bwc s ALA 465 Cb -0.44 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 1bwc s ALA 465 CO 0.56 -0.59 0.10 0.42 0.00 0.00 0.00 175.76 176.25 1bwc s ILE 466 N -2.34 4.51 0.09 0.00 1.01 -1.26 -5.08 121.20 118.13 1bwc s ILE 466 Ca 0.64 -0.16 0.10 0.00 0.00 0.00 0.00 60.65 61.22 1bwc s ILE 466 Cb -0.15 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1bwc s ILE 466 CO 0.31 0.28 -0.25 -2.28 0.00 0.00 0.00 174.94 173.01 1bwc s HIS 467 N 1.64 2.37 -0.29 3.97 2.46 -1.26 -2.88 115.29 121.30 1bwc s HIS 467 Ca 0.06 -0.36 -0.24 0.00 0.47 0.00 0.00 55.06 54.99 1bwc s HIS 467 Cb -0.16 -1.33 -0.00 0.00 -0.13 0.00 0.00 32.58 30.96 1bwc s HIS 467 CO 0.05 0.27 0.80 -1.25 -2.47 0.00 0.00 174.74 172.14 1bwc s PRO 468 N -1.75 4.02 0.22 2.88 0.04 -1.26 -5.17 135.00 133.97 1bwc s PRO 468 Ca 0.14 0.67 0.02 0.00 0.04 0.00 0.00 61.00 61.87 1bwc s PRO 468 Cb -0.10 -3.71 -0.05 0.00 0.04 0.00 0.00 34.50 30.68 1bwc s PRO 468 CO 0.05 -0.65 0.04 0.95 0.04 0.00 0.00 177.00 177.43 1bwc s THR 469 N 2.95 0.72 0.26 1.26 -4.23 -1.14 -5.03 115.64 110.42 1bwc s THR 469 Ca 0.33 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.83 1bwc s THR 469 Cb -0.14 -2.37 0.08 0.00 1.34 0.00 0.00 72.50 71.41 1bwc s THR 469 CO 0.11 -0.26 1.72 0.28 -0.54 0.00 0.00 174.62 175.93 1bwc h SER 470 N 2.52 0.68 0.39 3.99 0.02 -1.91 -3.35 113.55 115.89 1bwc h SER 470 Ca -0.38 -0.20 -0.05 0.00 -0.84 0.00 0.00 61.79 60.32 1bwc h SER 470 Cb 1.22 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 1bwc h SER 470 CO 0.62 0.83 -0.25 0.77 -1.14 0.00 0.00 176.83 177.67 1bwc h SER 471 N 0.63 0.00 0.30 3.07 4.64 -1.94 -2.56 113.55 117.69 1bwc h SER 471 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1bwc h SER 471 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1bwc h SER 471 CO 0.04 0.25 0.00 1.05 -0.87 0.00 0.00 176.83 177.30 1bwc h GLU 472 N 0.00 0.00 0.00 4.77 4.11 -1.75 -2.42 114.58 119.28 1bwc h GLU 472 Ca -0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.38 1bwc h GLU 472 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1bwc h GLU 472 CO 0.03 0.00 -0.25 0.93 0.07 0.00 0.00 179.01 179.80 1bwc h GLU 473 N 0.00 0.00 0.00 1.06 4.39 -1.71 -2.75 114.58 115.57 1bwc h GLU 473 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1bwc h GLU 473 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1bwc h GLU 473 CO 0.00 0.25 0.00 -0.07 -1.16 0.00 0.00 179.01 178.03 1bwc h LEU 474 N 0.00 0.00 -2.45 1.33 3.38 -1.66 -2.83 115.31 113.09 1bwc h LEU 474 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bwc h LEU 474 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1bwc h LEU 474 CO 0.03 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.89 1bwc n VAL 475 N -2.43 0.68 -1.54 1.22 0.24 -1.05 -4.50 118.33 110.96 1bwc n VAL 475 Ca 0.03 -0.84 0.05 0.00 -2.04 0.00 0.00 64.34 61.54 1bwc n VAL 475 Cb 0.33 0.77 0.07 0.00 -1.47 0.00 0.00 33.84 33.54 1bwc n VAL 475 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1bwc n THR 476 N 0.94 0.95 -2.15 3.34 -2.24 -1.07 -4.42 114.28 109.63 1bwc n THR 476 Ca 0.14 -1.15 -0.38 0.00 -2.27 0.00 0.00 64.05 60.39 1bwc n THR 476 Cb 0.47 0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.82 1bwc n THR 476 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1bwc s LEU 477 N -1.45 4.11 0.00 3.22 1.43 -1.18 -5.03 118.68 119.78 1bwc s LEU 477 Ca 0.16 2.48 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 1bwc s LEU 477 Cb 0.14 -4.07 0.00 0.00 0.03 0.00 0.00 46.19 42.29 1bwc s LEU 477 CO 0.01 -0.89 0.25 0.54 0.23 0.00 0.00 176.35 176.49