#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2brt s ALA 3 N 0.00 0.37 -0.03 3.52 0.00 -1.26 -5.15 121.76 119.22 2brt s ALA 3 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2brt s ALA 3 Cb 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 2brt s ALA 3 CO 0.00 0.08 0.06 0.08 0.00 0.00 0.00 175.76 175.97 2brt s VAL 4 N -0.20 4.61 -0.22 0.00 1.01 -1.26 -5.12 120.40 119.22 2brt s VAL 4 Ca 0.01 -0.37 -0.20 0.00 0.00 0.00 0.00 61.98 61.41 2brt s VAL 4 Cb -0.02 -3.06 0.06 0.00 0.00 0.00 0.00 36.38 33.35 2brt s VAL 4 CO -0.00 0.42 0.58 -0.70 0.00 0.00 0.00 175.10 175.40 2brt s GLU 5 N -1.50 0.68 0.05 2.72 -6.30 -1.26 -5.16 118.70 107.93 2brt s GLU 5 Ca 0.20 0.81 0.07 0.00 -2.50 0.00 0.00 54.97 53.55 2brt s GLU 5 Cb -0.12 0.33 -0.03 0.00 0.00 0.00 0.00 34.13 34.31 2brt s GLU 5 CO 0.10 -0.08 -0.16 1.03 0.02 0.00 0.00 175.26 176.18 2brt s ARG 6 N 0.30 2.10 0.30 4.30 1.81 -1.26 -4.94 118.95 121.56 2brt s ARG 6 Ca -0.00 -0.98 0.01 0.00 -1.72 0.00 0.00 55.73 53.04 2brt s ARG 6 Cb -0.04 -2.23 0.48 0.00 -0.45 0.00 0.00 34.95 32.71 2brt s ARG 6 CO 0.01 0.54 1.83 0.28 -0.68 0.00 0.00 175.30 177.28 2brt h VAL 7 N 3.79 1.22 -0.54 3.52 2.07 -1.94 -1.14 116.25 123.24 2brt h VAL 7 Ca -0.48 -0.84 0.08 0.00 0.82 0.00 0.00 66.70 66.27 2brt h VAL 7 Cb 1.16 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2brt h VAL 7 CO 0.49 0.30 0.36 -0.08 0.02 0.00 0.00 177.57 178.66 2brt h GLU 8 N 0.64 0.39 0.02 1.57 4.81 -1.93 0.12 114.58 120.20 2brt h GLU 8 Ca 0.14 -0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.17 2brt h GLU 8 Cb 0.35 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.65 2brt h GLU 8 CO 0.01 0.26 -0.67 0.77 -0.73 0.00 0.00 179.01 178.64 2brt h SER 9 N 0.40 0.56 -0.51 1.04 0.02 -1.64 -2.88 113.55 110.54 2brt h SER 9 Ca 0.24 -0.78 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2brt h SER 9 Cb 0.43 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 2brt h SER 9 CO -0.06 1.27 0.32 0.25 -1.14 0.00 0.00 176.83 177.47 2brt h LEU 10 N -0.09 0.60 -1.85 5.07 5.85 -0.82 -1.67 115.31 122.41 2brt h LEU 10 Ca -0.09 -0.04 0.17 0.00 0.84 0.00 0.00 57.88 58.76 2brt h LEU 10 Cb 1.39 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 2brt h LEU 10 CO 0.13 0.46 0.46 0.00 -0.34 0.00 0.00 178.44 179.15 2brt h ALA 11 N 1.17 2.41 -0.50 1.25 0.00 -0.81 -3.09 119.26 119.69 2brt h ALA 11 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2brt h ALA 11 Cb -0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2brt h ALA 11 CO -0.04 -0.59 0.00 1.63 0.00 0.00 0.00 179.25 180.25 2brt n LYS 12 N -4.40 2.79 0.00 0.00 5.02 -0.67 -4.52 118.16 116.38 2brt n LYS 12 Ca 0.12 -2.29 0.12 0.00 -2.02 0.00 0.00 58.31 54.25 2brt n LYS 12 Cb 0.62 -1.39 0.25 0.00 -0.02 0.00 0.00 35.03 34.49 2brt n LYS 12 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2brt n SER 13 N 0.98 0.51 -1.82 4.39 3.41 -0.96 -4.97 113.62 115.17 2brt n SER 13 Ca 0.17 -0.27 -0.02 0.00 -0.26 0.00 0.00 58.87 58.49 2brt n SER 13 Cb 0.51 0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.72 2brt n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2brt n GLY 14 N 1.50 0.34 3.47 5.00 0.00 -1.26 -5.08 105.19 109.16 2brt n GLY 14 Ca 0.06 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 2brt n GLY 14 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2brt s ILE 15 N -3.06 2.90 -0.20 -0.61 -4.36 -1.26 -5.03 121.20 109.58 2brt s ILE 15 Ca 0.07 -1.11 0.13 0.00 -0.26 0.00 0.00 60.65 59.48 2brt s ILE 15 Cb -0.01 -2.22 -0.21 0.00 1.25 0.00 0.00 42.46 41.27 2brt s ILE 15 CO 0.14 0.36 -0.01 2.30 0.24 0.00 0.00 174.94 177.97 2brt n ILE 16 N 1.61 1.30 -5.11 8.37 -6.64 -1.26 -4.88 119.36 112.75 2brt n ILE 16 Ca -0.16 -0.72 -0.29 0.00 -1.77 0.00 0.00 62.75 59.81 2brt n ILE 16 Cb 0.52 -0.73 -0.16 0.00 -1.44 0.00 0.00 39.64 37.84 2brt n ILE 16 CO 0.00 0.00 0.00 -0.44 -1.77 0.00 0.00 176.55 174.34 2brt s SER 17 N -5.57 2.85 0.46 7.28 0.01 -1.26 -4.62 113.70 112.85 2brt s SER 17 Ca -0.15 -0.47 -0.13 0.00 1.31 0.00 0.00 55.95 56.51 2brt s SER 17 Cb 0.06 -0.30 -0.07 0.00 0.21 0.00 0.00 66.02 65.92 2brt s SER 17 CO 0.71 0.28 0.87 0.27 0.41 0.00 0.00 173.24 175.77 2brt s ILE 18 N -0.62 4.68 0.87 1.44 -4.36 -1.26 -5.03 121.20 116.92 2brt s ILE 18 Ca 0.10 0.88 -0.11 0.00 -0.26 0.00 0.00 60.65 61.25 2brt s ILE 18 Cb -0.09 -3.73 0.12 0.00 1.25 0.00 0.00 42.46 40.01 2brt s ILE 18 CO -0.00 -0.61 1.16 -2.65 0.24 0.00 0.00 174.94 173.08 2brt n PRO 19 N -1.45 -0.19 -0.31 0.37 -0.02 -1.26 -4.90 135.00 127.24 2brt n PRO 19 Ca 0.04 0.02 0.07 0.00 -2.02 0.00 0.00 63.50 61.61 2brt n PRO 19 Cb 0.54 -2.39 0.28 0.00 -0.02 0.00 0.00 33.50 31.91 2brt n PRO 19 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2brt h LYS 20 N -1.48 0.88 0.00 -0.52 -0.00 -1.96 -1.76 116.57 111.73 2brt h LYS 20 Ca -0.44 -0.05 -0.00 0.00 -0.00 0.00 0.00 60.65 60.15 2brt h LYS 20 Cb 1.28 -0.20 -0.00 0.00 -0.00 0.00 0.00 32.23 33.31 2brt h LYS 20 CO 0.43 0.59 -0.01 0.93 -0.00 0.00 0.00 179.45 181.38 2brt h GLU 21 N 0.91 0.00 0.00 0.07 3.07 -1.91 -2.43 114.58 114.30 2brt h GLU 21 Ca 0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 2brt h GLU 21 Cb 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 2brt h GLU 21 CO -0.20 0.01 -0.74 0.66 -1.40 0.00 0.00 179.01 177.34 2brt n TYR 22 N -3.16 0.01 -2.74 4.33 4.02 -0.67 -0.63 117.16 118.32 2brt n TYR 22 Ca -0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.46 2brt n TYR 22 Cb 0.16 -0.15 -0.04 0.00 -0.02 0.00 0.00 39.34 39.30 2brt n TYR 22 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2brt s ILE 23 N -3.01 4.66 0.68 -0.72 1.01 -0.91 -4.27 121.20 118.63 2brt s ILE 23 Ca 0.09 2.03 -0.11 0.00 0.00 0.00 0.00 60.65 62.67 2brt s ILE 23 Cb 0.17 -4.31 -0.00 0.00 0.01 0.00 0.00 42.46 38.33 2brt s ILE 23 CO 0.78 0.26 1.05 -0.13 0.00 0.00 0.00 174.94 176.90 2brt s ARG 24 N 0.38 3.07 0.56 2.79 1.81 -0.60 -4.99 118.95 121.97 2brt s ARG 24 Ca 0.48 0.94 -0.20 0.00 -1.72 0.00 0.00 55.73 55.23 2brt s ARG 24 Cb -0.22 -2.01 -0.06 0.00 -0.45 0.00 0.00 34.95 32.21 2brt s ARG 24 CO 0.29 -0.99 1.07 -2.30 -0.68 0.00 0.00 175.30 172.68 2brt n PRO 25 N -2.98 1.18 0.25 3.54 -0.02 -1.26 -4.71 135.00 130.99 2brt n PRO 25 Ca 0.07 0.44 0.10 0.00 -2.02 0.00 0.00 63.50 62.10 2brt n PRO 25 Cb 0.54 -2.25 0.70 0.00 -0.02 0.00 0.00 33.50 32.47 2brt n PRO 25 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2brt h LYS 26 N 0.91 0.00 -0.53 -0.52 2.10 -2.00 0.63 116.57 117.17 2brt h LYS 26 Ca -0.48 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.11 2brt h LYS 26 Cb 1.34 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.65 2brt h LYS 26 CO 0.53 0.00 0.12 0.93 -2.00 0.00 0.00 179.45 179.03 2brt h GLU 27 N 0.00 0.85 0.00 0.07 3.07 -2.04 -3.16 114.58 113.37 2brt h GLU 27 Ca 0.01 -0.21 -0.12 0.00 -0.50 0.00 0.00 59.36 58.54 2brt h GLU 27 Cb 0.06 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 2brt h GLU 27 CO -0.00 0.82 -0.59 1.49 -1.40 0.00 0.00 179.01 179.33 2brt h GLU 28 N 0.75 0.00 -0.32 2.33 4.81 -1.24 -3.15 114.58 117.76 2brt h GLU 28 Ca 0.16 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.46 2brt h GLU 28 Cb 0.36 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 2brt h GLU 28 CO 0.00 0.59 0.22 -0.07 -0.73 0.00 0.00 179.01 179.03 2brt h LEU 29 N 0.00 0.11 -0.95 1.64 3.38 -1.35 -2.58 115.31 115.56 2brt h LEU 29 Ca -0.01 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.19 2brt h LEU 29 Cb 1.08 -0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.69 2brt h LEU 29 CO 0.08 0.07 0.51 -0.33 0.09 0.00 0.00 178.44 178.86 2brt h GLU 30 N 0.13 0.51 -0.01 1.13 4.39 -1.64 -2.77 114.58 116.32 2brt h GLU 30 Ca 0.15 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2brt h GLU 30 Cb 0.41 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 2brt h GLU 30 CO -0.02 0.34 -0.30 -1.13 -1.16 0.00 0.00 179.01 176.73 2brt n SER 31 N -4.94 1.02 -4.60 1.42 3.41 -0.97 -4.83 113.62 104.13 2brt n SER 31 Ca 0.24 -0.86 -0.39 0.00 -0.26 0.00 0.00 58.87 57.60 2brt n SER 31 Cb 0.68 0.18 -0.09 0.00 -0.26 0.00 0.00 64.21 64.72 2brt n SER 31 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2brt s ILE 32 N -2.56 5.15 0.39 -1.33 1.01 -1.05 -5.00 121.20 117.81 2brt s ILE 32 Ca 0.22 0.55 0.07 0.00 0.00 0.00 0.00 60.65 61.49 2brt s ILE 32 Cb 0.19 -3.74 -0.08 0.00 0.01 0.00 0.00 42.46 38.84 2brt s ILE 32 CO 0.55 0.10 0.01 0.20 0.00 0.00 0.00 174.94 175.80 2brt s ASN 33 N 1.65 3.59 -0.38 3.58 0.02 -1.26 -4.92 114.94 117.22 2brt s ASN 33 Ca 0.16 -1.36 -0.37 0.00 -1.02 0.00 0.00 52.86 50.27 2brt s ASN 33 Cb -0.16 -0.34 -0.13 0.00 0.02 0.00 0.00 41.25 40.64 2brt s ASN 33 CO 0.10 -0.46 2.16 -0.67 0.02 0.00 0.00 177.10 178.25 2brt n ASP 34 N -0.90 1.83 0.08 -1.22 2.03 -1.26 -4.83 116.55 112.28 2brt n ASP 34 Ca -0.05 0.50 0.04 0.00 0.52 0.00 0.00 54.79 55.81 2brt n ASP 34 Cb 0.67 -1.17 0.45 0.00 -0.72 0.00 0.00 41.12 40.35 2brt n ASP 34 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2brt h VAL 35 N 6.99 1.10 -0.10 5.18 3.04 -1.95 -0.73 116.25 129.78 2brt h VAL 35 Ca -0.24 -0.32 -0.03 0.00 -1.01 0.00 0.00 66.70 65.11 2brt h VAL 35 Cb 1.34 0.79 -0.00 0.00 -2.01 0.00 0.00 31.29 31.41 2brt h VAL 35 CO 1.03 0.12 -0.04 -0.26 -1.01 0.00 0.00 177.57 177.41 2brt h PHE 36 N 0.37 0.23 -0.47 3.17 0.05 -1.93 -0.72 116.94 117.64 2brt h PHE 36 Ca 0.09 -0.06 0.03 0.00 3.82 0.00 0.00 57.97 61.86 2brt h PHE 36 Cb 0.07 -0.05 -0.04 0.00 2.00 0.00 0.00 35.95 37.93 2brt h PHE 36 CO 0.00 0.55 0.25 -0.07 -0.18 0.00 0.00 178.31 178.86 2brt h LEU 37 N -0.16 0.37 -2.24 1.54 3.38 -1.91 -2.45 115.31 113.85 2brt h LEU 37 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2brt h LEU 37 Cb 0.49 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2brt h LEU 37 CO 0.01 0.26 0.00 -0.33 0.09 0.00 0.00 178.44 178.48 2brt h GLU 38 N 0.50 0.00 0.00 1.13 5.08 -1.01 -0.78 114.58 119.50 2brt h GLU 38 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2brt h GLU 38 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2brt h GLU 38 CO -0.13 0.00 0.00 1.49 -1.00 0.00 0.00 179.01 179.37 2brt h GLU 39 N 0.00 0.00 -0.19 2.33 4.81 -0.63 -3.21 114.58 117.69 2brt h GLU 39 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2brt h GLU 39 Cb 0.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2brt h GLU 39 CO -0.00 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.91 2brt n LYS 40 N -2.76 2.37 -3.19 1.92 5.02 -0.30 -4.89 118.16 116.33 2brt n LYS 40 Ca 0.02 -2.03 -0.39 0.00 -2.02 0.00 0.00 58.31 53.89 2brt n LYS 40 Cb 0.34 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.81 2brt n LYS 40 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2brt s LYS 41 N -1.77 4.29 0.00 1.97 -0.14 -1.21 -4.93 119.74 117.95 2brt s LYS 41 Ca 0.33 0.57 0.09 0.00 -1.36 0.00 0.00 55.97 55.61 2brt s LYS 41 Cb 0.21 -3.51 0.15 0.00 -1.68 0.00 0.00 37.83 33.01 2brt s LYS 41 CO 0.31 -0.05 0.98 0.39 -0.76 0.00 0.00 175.35 176.22 2brt n GLU 42 N 4.35 1.44 -3.01 1.68 1.02 -1.26 -5.00 120.64 119.85 2brt n GLU 42 Ca -0.04 -1.45 -0.39 0.00 -0.02 0.00 0.00 57.16 55.26 2brt n GLU 42 Cb 0.51 -1.20 -0.06 0.00 -0.02 0.00 0.00 31.44 30.67 2brt n GLU 42 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 2brt s ASP 43 N -0.87 7.32 0.00 1.62 -4.77 -1.26 -4.92 116.67 113.78 2brt s ASP 43 Ca 0.15 1.59 0.00 0.00 -3.30 0.00 0.00 52.55 50.99 2brt s ASP 43 Cb 0.09 -2.48 0.00 0.00 -1.09 0.00 0.00 42.92 39.44 2brt s ASP 43 CO 0.12 0.18 0.00 0.61 0.70 0.00 0.00 175.17 176.79 2brt n GLY 44 N 1.46 -1.52 3.56 2.12 0.00 -1.26 -4.90 105.19 104.65 2brt n GLY 44 Ca -0.05 -1.53 -0.45 0.00 0.00 0.00 0.00 46.02 43.98 2brt n GLY 44 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2brt n PRO 45 N -1.60 1.13 -4.24 1.61 -0.02 -1.26 -5.02 135.00 125.60 2brt n PRO 45 Ca 0.00 0.40 -0.19 0.00 -2.02 0.00 0.00 63.50 61.68 2brt n PRO 45 Cb 0.00 -1.73 -0.12 0.00 -0.02 0.00 0.00 33.50 31.64 2brt n PRO 45 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2brt s GLN 46 N -1.35 1.02 0.33 -0.52 -1.52 -1.26 -4.91 119.66 111.45 2brt s GLN 46 Ca 0.61 -1.17 -0.29 0.00 -1.95 0.00 0.00 55.36 52.55 2brt s GLN 46 Cb -0.75 -1.01 -0.11 0.00 -0.22 0.00 0.00 33.01 30.91 2brt s GLN 46 CO 0.59 0.21 1.54 0.08 -0.25 0.00 0.00 175.29 177.46 2brt s VAL 47 N -1.74 2.08 0.45 1.09 1.01 -1.26 -4.97 120.40 117.04 2brt s VAL 47 Ca 0.06 0.07 -0.24 0.00 0.00 0.00 0.00 61.98 61.88 2brt s VAL 47 Cb -0.07 -3.04 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 2brt s VAL 47 CO 0.03 0.01 1.18 -2.84 0.00 0.00 0.00 175.10 173.49 2brt s PRO 48 N -1.24 3.82 -0.19 2.72 0.02 -1.26 -4.86 135.00 134.01 2brt s PRO 48 Ca 0.58 1.83 -0.12 0.00 0.02 0.00 0.00 61.00 63.32 2brt s PRO 48 Cb -0.47 -2.49 -0.05 0.00 0.02 0.00 0.00 34.50 31.51 2brt s PRO 48 CO 0.55 -0.52 0.20 0.99 -0.33 0.00 0.00 177.00 177.89 2brt s THR 49 N -1.49 5.37 -0.17 0.99 2.01 -1.26 -0.90 115.64 120.19 2brt s THR 49 Ca 0.62 0.33 0.01 0.00 0.31 0.00 0.00 61.69 62.96 2brt s THR 49 Cb -0.30 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 68.69 2brt s THR 49 CO 0.37 0.42 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.90 2brt s ILE 50 N 0.44 2.20 -0.25 1.82 -1.09 0.29 -4.92 121.20 119.68 2brt s ILE 50 Ca 0.11 -0.90 -0.21 0.00 -2.23 0.00 0.00 60.65 57.42 2brt s ILE 50 Cb -0.12 -1.92 -0.02 0.00 -1.58 0.00 0.00 42.46 38.82 2brt s ILE 50 CO 0.00 0.53 0.65 -0.62 -1.23 0.00 0.00 174.94 174.27 2brt s ASP 51 N 1.16 6.60 0.00 3.58 3.68 -1.26 -1.25 116.67 129.18 2brt s ASP 51 Ca 0.02 0.74 0.20 0.00 2.13 0.00 0.00 52.55 55.64 2brt s ASP 51 Cb -0.14 -2.35 0.20 0.00 -1.45 0.00 0.00 42.92 39.18 2brt s ASP 51 CO -0.09 -0.38 1.18 0.18 0.13 0.00 0.00 175.17 176.19 2brt n LEU 52 N 5.72 2.79 -0.15 -1.34 4.77 -0.55 -4.66 117.00 123.58 2brt n LEU 52 Ca -0.00 -1.09 -0.01 0.00 -0.03 0.00 0.00 56.01 54.88 2brt n LEU 52 Cb 0.49 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 2brt n LEU 52 CO 0.43 0.50 0.22 1.17 -1.33 0.00 0.00 177.39 178.39 2brt n LYS 53 N 1.17 -0.11 -0.64 3.23 4.81 -1.02 -1.13 118.16 124.48 2brt n LYS 53 Ca 0.13 0.60 0.09 0.00 -0.87 0.00 0.00 58.31 58.26 2brt n LYS 53 Cb 0.52 -0.89 0.36 0.00 0.02 0.00 0.00 35.03 35.03 2brt n LYS 53 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2brt n ASN 54 N -4.57 4.78 -0.30 3.14 4.13 -1.26 -4.57 115.26 116.61 2brt n ASN 54 Ca 0.03 -2.48 0.17 0.00 1.68 0.00 0.00 54.58 53.98 2brt n ASN 54 Cb 0.15 -0.59 0.43 0.00 -1.54 0.00 0.00 39.78 38.23 2brt n ASN 54 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2brt h ILE 55 N 4.02 0.66 -0.35 2.41 2.10 -1.41 -0.60 117.51 124.35 2brt h ILE 55 Ca 0.00 -0.19 0.00 0.00 1.08 0.00 0.00 64.86 65.75 2brt h ILE 55 Cb 1.49 0.06 0.00 0.00 -1.09 0.00 0.00 36.82 37.28 2brt h ILE 55 CO 0.26 0.10 0.00 -0.62 -1.08 0.00 0.00 178.15 176.81 2brt n GLU 56 N -4.63 3.11 -1.72 2.19 1.02 -1.26 -4.96 120.64 114.40 2brt n GLU 56 Ca 0.22 -2.62 -0.39 0.00 -0.02 0.00 0.00 57.16 54.35 2brt n GLU 56 Cb 0.68 -1.70 0.04 0.00 -0.02 0.00 0.00 31.44 30.44 2brt n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2brt n SER 57 N 0.05 2.37 0.04 1.62 2.88 -0.23 -4.92 113.62 115.44 2brt n SER 57 Ca 0.19 0.98 0.13 0.00 -1.33 0.00 0.00 58.87 58.84 2brt n SER 57 Cb 0.77 -1.53 0.39 0.00 -0.75 0.00 0.00 64.21 63.08 2brt n SER 57 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2brt n ASP 58 N -0.75 0.46 -4.52 -3.46 9.92 -1.26 -4.41 116.55 112.53 2brt n ASP 58 Ca 0.10 0.27 -0.43 0.00 -0.53 0.00 0.00 54.79 54.20 2brt n ASP 58 Cb 0.44 -0.26 -0.06 0.00 -0.64 0.00 0.00 41.12 40.60 2brt n ASP 58 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 2brt s ASP 59 N -3.63 6.36 0.25 -2.24 1.11 -1.26 -4.95 116.67 112.31 2brt s ASP 59 Ca 0.11 -0.28 -0.04 0.00 0.18 0.00 0.00 52.55 52.52 2brt s ASP 59 Cb 0.16 -2.35 0.37 0.00 1.07 0.00 0.00 42.92 42.17 2brt s ASP 59 CO 0.63 -0.87 1.85 1.05 1.18 0.00 0.00 175.17 179.01 2brt h GLU 60 N 8.95 0.96 -0.88 8.23 -0.00 -1.99 0.21 114.58 130.06 2brt h GLU 60 Ca -0.25 -0.06 0.20 0.00 -0.00 0.00 0.00 59.36 59.25 2brt h GLU 60 Cb 1.09 -0.22 -0.12 0.00 -0.00 0.00 0.00 28.75 29.51 2brt h GLU 60 CO 0.93 0.64 0.40 1.57 -0.00 0.00 0.00 179.01 182.55 2brt h LYS 61 N 0.99 0.45 0.00 1.06 5.09 -1.95 -1.16 116.57 121.06 2brt h LYS 61 Ca 0.40 -0.03 -0.17 0.00 0.09 0.00 0.00 60.65 60.94 2brt h LYS 61 Cb 0.21 -0.10 -0.03 0.00 0.10 0.00 0.00 32.23 32.41 2brt h LYS 61 CO -0.19 0.30 -1.52 -0.89 -2.09 0.00 0.00 179.45 175.06 2brt n ILE 62 N -5.00 1.12 0.14 0.07 5.41 -0.21 -2.48 119.36 118.41 2brt n ILE 62 Ca 0.20 -0.69 -0.13 0.00 1.00 0.00 0.00 62.75 63.13 2brt n ILE 62 Cb 0.59 -0.66 -0.08 0.00 -0.71 0.00 0.00 39.64 38.77 2brt n ILE 62 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 2brt h ARG 63 N 0.00 -0.34 -0.65 0.38 2.43 -0.97 -3.16 114.38 112.07 2brt h ARG 63 Ca -0.18 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.11 2brt h ARG 63 Cb 1.59 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 31.14 2brt h ARG 63 CO 0.04 -0.03 0.27 0.93 -1.51 0.00 0.00 179.97 179.67 2brt h GLU 64 N -0.68 0.45 -0.79 0.20 5.08 -1.30 0.04 114.58 117.59 2brt h GLU 64 Ca -0.04 -0.03 0.19 0.00 -1.00 0.00 0.00 59.36 58.48 2brt h GLU 64 Cb 0.47 -0.10 -0.13 0.00 0.50 0.00 0.00 28.75 29.49 2brt h GLU 64 CO 0.06 0.30 0.10 -0.91 -1.00 0.00 0.00 179.01 177.56 2brt h ASN 65 N 0.46 -0.19 -0.15 1.42 -0.26 -1.53 -1.66 115.58 113.68 2brt h ASN 65 Ca 0.33 0.19 -0.03 0.00 -0.56 0.00 0.00 56.30 56.23 2brt h ASN 65 Cb 0.40 0.30 -0.01 0.00 -1.06 0.00 0.00 38.32 37.95 2brt h ASN 65 CO -0.31 -0.15 -0.01 0.00 -1.06 0.00 0.00 177.43 175.90 2brt h ILE 67 N -0.00 0.84 -0.37 0.00 2.04 -0.70 -1.68 117.51 117.63 2brt h ILE 67 Ca 0.04 -0.29 -0.10 0.00 1.00 0.00 0.00 64.86 65.51 2brt h ILE 67 Cb 0.41 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 2brt h ILE 67 CO 0.01 0.15 -0.18 -0.33 0.00 0.00 0.00 178.15 177.81 2brt h GLU 68 N 0.83 0.78 -0.74 2.37 4.39 -1.02 -0.08 114.58 121.10 2brt h GLU 68 Ca 0.50 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.82 2brt h GLU 68 Cb 0.67 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.26 2brt h GLU 68 CO -0.26 0.96 0.29 0.93 -1.16 0.00 0.00 179.01 179.77 2brt h GLU 69 N 0.57 1.11 -0.20 2.33 4.39 -1.08 0.20 114.58 121.89 2brt h GLU 69 Ca 0.08 -0.19 -0.11 0.00 0.34 0.00 0.00 59.36 59.48 2brt h GLU 69 Cb 0.72 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2brt h GLU 69 CO 0.05 0.90 -0.29 1.25 -1.16 0.00 0.00 179.01 179.76 2brt h LEU 70 N 1.08 0.61 0.83 1.33 5.85 -1.29 -1.81 115.31 121.91 2brt h LEU 70 Ca 0.25 -0.51 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 2brt h LEU 70 Cb 0.21 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.07 2brt h LEU 70 CO -0.02 1.01 -0.40 0.11 -0.34 0.00 0.00 178.44 178.80 2brt h LYS 71 N 0.23 -1.07 -1.02 1.25 1.79 -0.77 -1.26 116.57 115.72 2brt h LYS 71 Ca 0.02 0.07 0.26 0.00 -2.18 0.00 0.00 60.65 58.82 2brt h LYS 71 Cb 0.87 0.24 -0.11 0.00 -1.58 0.00 0.00 32.23 31.65 2brt h LYS 71 CO 0.07 -0.71 0.63 0.87 -1.08 0.00 0.00 179.45 179.22 2brt h LYS 72 N -1.14 0.49 -0.37 3.15 6.56 -0.62 0.22 116.57 124.86 2brt h LYS 72 Ca -0.11 -0.03 -0.11 0.00 -1.06 0.00 0.00 60.65 59.34 2brt h LYS 72 Cb 0.86 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 32.39 2brt h LYS 72 CO 0.19 0.33 -0.20 0.00 -2.06 0.00 0.00 179.45 177.70 2brt h ALA 73 N 1.69 0.94 -0.07 3.86 0.00 -1.01 -2.37 119.26 122.30 2brt h ALA 73 Ca 0.63 -0.35 -0.22 0.00 0.00 0.00 0.00 54.91 54.97 2brt h ALA 73 Cb 1.35 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.99 2brt h ALA 73 CO -0.41 0.61 -0.84 0.77 0.00 0.00 0.00 179.25 179.37 2brt h SER 74 N 0.64 0.71 1.28 0.00 0.02 0.53 -0.52 113.55 116.21 2brt h SER 74 Ca 0.09 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.48 2brt h SER 74 Cb 0.69 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2brt h SER 74 CO 0.05 1.29 -0.26 -0.07 -1.14 0.00 0.00 176.83 176.70 2brt h LEU 75 N 0.37 0.00 0.00 5.07 3.38 -0.79 -2.58 115.31 120.76 2brt h LEU 75 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2brt h LEU 75 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2brt h LEU 75 CO 0.16 0.26 -0.80 -0.67 0.09 0.00 0.00 178.44 177.48 2brt n ASP 76 N -3.27 1.73 -0.11 -0.43 4.64 -0.90 -4.70 116.55 113.51 2brt n ASP 76 Ca 0.01 0.37 -0.18 0.00 -1.38 0.00 0.00 54.79 53.62 2brt n ASP 76 Cb 0.53 -0.75 -0.10 0.00 -1.04 0.00 0.00 41.12 39.77 2brt n ASP 76 CO 0.00 0.00 0.00 0.79 -0.82 0.00 0.00 177.20 177.17 2brt n TRP 77 N -4.30 0.00 -1.37 -0.67 7.02 -0.82 -4.97 117.44 112.33 2brt n TRP 77 Ca -0.11 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.24 2brt n TRP 77 Cb 0.41 -0.84 -0.05 0.00 -2.42 0.00 0.00 31.31 28.41 2brt n TRP 77 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2brt n GLY 78 N 2.22 1.32 3.27 6.99 0.00 -0.27 -4.42 105.19 114.31 2brt n GLY 78 Ca -0.41 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.20 2brt n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2brt s VAL 79 N -2.38 0.08 -0.17 1.61 0.11 -1.26 -0.93 120.40 117.45 2brt s VAL 79 Ca 0.00 -0.63 -0.30 0.00 -2.93 0.00 0.00 61.98 58.12 2brt s VAL 79 Cb 0.00 -0.93 0.14 0.00 -1.53 0.00 0.00 36.38 34.06 2brt s VAL 79 CO 0.00 -0.35 1.09 0.00 -3.33 0.00 0.00 175.10 172.52 2brt s MET 80 N -2.51 0.46 -0.18 1.54 0.23 -1.02 -4.41 119.30 113.40 2brt s MET 80 Ca -0.05 0.03 -0.26 0.00 -1.03 0.00 0.00 55.69 54.38 2brt s MET 80 Cb -0.01 0.22 -0.01 0.00 -1.53 0.00 0.00 34.83 33.50 2brt s MET 80 CO -0.03 -0.16 0.85 -1.01 -2.03 0.00 0.00 175.02 172.64 2brt s HIS 81 N -1.49 3.40 -0.17 3.16 3.76 -0.08 -1.27 115.29 122.60 2brt s HIS 81 Ca 0.03 1.27 -0.18 0.00 -0.15 0.00 0.00 55.06 56.02 2brt s HIS 81 Cb -0.01 -3.04 -0.04 0.00 1.11 0.00 0.00 32.58 30.60 2brt s HIS 81 CO -0.02 -0.28 0.50 -0.51 -0.85 0.00 0.00 174.74 173.57 2brt s LEU 82 N 2.33 4.19 0.21 0.89 1.43 0.21 0.10 118.68 128.04 2brt s LEU 82 Ca 0.39 0.71 0.11 0.00 -1.03 0.00 0.00 54.13 54.30 2brt s LEU 82 Cb -0.16 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 2brt s LEU 82 CO 0.11 -0.12 -0.19 0.27 0.23 0.00 0.00 176.35 176.66 2brt s ILE 83 N 1.29 2.61 -1.17 -0.59 -4.36 -0.38 -1.40 121.20 117.20 2brt s ILE 83 Ca 0.24 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.56 2brt s ILE 83 Cb -0.15 -2.29 -0.03 0.00 1.25 0.00 0.00 42.46 41.24 2brt s ILE 83 CO 0.10 -0.17 0.84 0.59 0.24 0.00 0.00 174.94 176.53 2brt n ASN 84 N 0.02 -4.11 -0.61 4.36 5.03 -1.26 -1.48 115.26 117.21 2brt n ASN 84 Ca -0.11 -0.80 0.07 0.00 0.87 0.00 0.00 54.58 54.61 2brt n ASN 84 Cb 0.57 -4.43 0.07 0.00 -1.02 0.00 0.00 39.78 34.97 2brt n ASN 84 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2brt n HIS 85 N -3.88 0.04 -0.81 3.10 1.44 -1.26 -2.43 115.22 111.41 2brt n HIS 85 Ca -0.17 -0.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.51 2brt n HIS 85 Cb 0.64 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.75 2brt n HIS 85 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2brt n GLY 86 N 0.83 0.71 3.66 -1.39 0.00 -1.26 -4.90 105.19 102.85 2brt n GLY 86 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2brt n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2brt s ILE 87 N -2.62 5.22 0.34 -0.61 -1.09 -1.26 -5.03 121.20 116.15 2brt s ILE 87 Ca 0.00 0.61 -0.27 0.00 -2.23 0.00 0.00 60.65 58.76 2brt s ILE 87 Cb 0.00 -3.69 -0.13 0.00 -1.58 0.00 0.00 42.46 37.06 2brt s ILE 87 CO 0.00 0.26 1.07 -2.65 -1.23 0.00 0.00 174.94 172.39 2brt n PRO 88 N 4.53 1.53 0.07 2.79 -0.02 -1.26 -4.85 135.00 137.78 2brt n PRO 88 Ca -0.09 0.54 -0.02 0.00 -2.02 0.00 0.00 63.50 61.90 2brt n PRO 88 Cb 0.51 -2.00 0.23 0.00 -0.02 0.00 0.00 33.50 32.22 2brt n PRO 88 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2brt h ALA 89 N 1.99 1.15 -0.45 3.55 0.00 -1.95 -1.84 119.26 121.71 2brt h ALA 89 Ca -0.42 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.04 2brt h ALA 89 Cb 1.33 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2brt h ALA 89 CO 0.60 0.55 -0.02 0.38 0.00 0.00 0.00 179.25 180.76 2brt h ASP 90 N 0.28 0.79 -0.27 0.00 2.03 -2.00 -2.35 116.42 114.91 2brt h ASP 90 Ca 0.04 -0.32 -0.15 0.00 -0.73 0.00 0.00 57.03 55.87 2brt h ASP 90 Cb 0.72 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 39.00 2brt h ASP 90 CO 0.05 0.92 -0.38 0.25 -1.03 0.00 0.00 179.24 179.06 2brt h LEU 91 N 0.64 0.86 -1.40 0.15 5.85 -1.88 -1.90 115.31 117.63 2brt h LEU 91 Ca 0.12 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.50 2brt h LEU 91 Cb 0.53 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 2brt h LEU 91 CO 0.03 1.14 0.44 0.24 -0.34 0.00 0.00 178.44 179.94 2brt h MET 92 N 0.67 0.74 -0.19 1.25 2.86 -1.15 -2.45 114.93 116.66 2brt h MET 92 Ca 0.06 -0.04 -0.20 0.00 -2.06 0.00 0.00 59.70 57.46 2brt h MET 92 Cb 0.94 -0.17 0.01 0.00 0.06 0.00 0.00 31.60 32.44 2brt h MET 92 CO 0.09 0.49 -0.65 0.93 1.06 0.00 0.00 176.91 178.82 2brt h GLU 93 N 0.76 0.78 -0.58 1.72 4.39 -1.02 -2.34 114.58 118.29 2brt h GLU 93 Ca 0.27 -0.58 0.10 0.00 0.34 0.00 0.00 59.36 59.49 2brt h GLU 93 Cb 0.13 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 28.81 2brt h GLU 93 CO -0.08 1.20 0.15 0.00 -1.16 0.00 0.00 179.01 179.12 2brt h ARG 94 N 0.51 0.29 0.03 2.33 3.08 -1.14 0.13 114.38 119.61 2brt h ARG 94 Ca -0.03 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2brt h ARG 94 Cb 1.28 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.26 2brt h ARG 94 CO 0.14 0.19 -0.01 0.28 -1.07 0.00 0.00 179.97 179.50 2brt h VAL 95 N 0.30 1.08 -0.45 2.04 2.07 -1.38 -0.57 116.25 119.33 2brt h VAL 95 Ca 0.30 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 2brt h VAL 95 Cb 0.42 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 2brt h VAL 95 CO -0.36 0.09 0.27 0.11 0.02 0.00 0.00 177.57 177.70 2brt h LYS 96 N -0.19 0.62 -0.71 1.57 1.57 -1.09 -1.18 116.57 117.16 2brt h LYS 96 Ca -0.00 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2brt h LYS 96 Cb 0.18 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.31 2brt h LYS 96 CO 0.01 0.47 0.44 -0.22 -0.57 0.00 0.00 179.45 179.57 2brt h LYS 97 N 0.60 0.82 -0.21 3.15 3.64 -0.65 0.31 116.57 124.23 2brt h LYS 97 Ca 0.16 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.42 2brt h LYS 97 Cb 0.01 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2brt h LYS 97 CO -0.03 0.54 -0.20 0.00 -2.27 0.00 0.00 179.45 177.49 2brt h ALA 98 N 1.31 1.27 0.04 5.00 0.00 -0.62 -1.44 119.26 124.83 2brt h ALA 98 Ca 0.29 -0.29 -0.25 0.00 0.00 0.00 0.00 54.91 54.66 2brt h ALA 98 Cb 0.05 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.74 2brt h ALA 98 CO -0.12 0.48 -1.06 0.78 0.00 0.00 0.00 179.25 179.34 2brt h GLY 99 N 0.95 0.51 0.98 0.00 0.00 -0.24 -2.25 103.07 103.01 2brt h GLY 99 Ca 0.06 -0.97 -0.04 0.00 0.00 0.00 0.00 47.33 46.37 2brt h GLY 99 CO 0.04 0.86 0.16 0.83 0.00 0.00 0.00 176.54 178.43 2brt h GLU 100 N 0.23 0.80 -0.54 4.80 5.08 -0.25 -2.36 114.58 122.34 2brt h GLU 100 Ca -0.11 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2brt h GLU 100 Cb 1.71 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.82 2brt h GLU 100 CO 0.19 0.74 0.35 0.93 -1.00 0.00 0.00 179.01 180.21 2brt h GLU 101 N 0.70 0.72 -0.35 2.33 5.08 -1.25 -1.52 114.58 120.29 2brt h GLU 101 Ca 0.16 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2brt h GLU 101 Cb 0.28 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2brt h GLU 101 CO -0.01 0.49 0.22 0.35 -1.00 0.00 0.00 179.01 179.06 2brt h PHE 102 N 0.73 0.41 0.00 4.33 3.57 -1.35 -2.65 116.94 121.98 2brt h PHE 102 Ca 0.20 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2brt h PHE 102 Cb -0.06 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.54 2brt h PHE 102 CO -0.03 0.25 0.00 1.19 -2.23 0.00 0.00 178.31 177.49 2brt n PHE 103 N -4.87 0.34 1.30 0.41 3.01 -0.89 -2.24 117.46 114.51 2brt n PHE 103 Ca -0.00 0.12 0.13 0.00 1.01 0.00 0.00 57.45 58.71 2brt n PHE 103 Cb 0.04 -0.69 0.40 0.00 -0.01 0.00 0.00 39.48 39.22 2brt n PHE 103 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2brt n SER 104 N -1.79 1.20 -4.71 4.37 3.41 -0.59 -4.83 113.62 110.68 2brt n SER 104 Ca 0.04 -1.08 -0.31 0.00 -0.26 0.00 0.00 58.87 57.26 2brt n SER 104 Cb 0.26 0.11 0.14 0.00 -0.26 0.00 0.00 64.21 64.45 2brt n SER 104 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2brt s LEU 105 N -2.37 2.95 0.89 1.04 1.43 -0.95 -4.99 118.68 116.67 2brt s LEU 105 Ca 0.28 2.10 -0.10 0.00 -1.03 0.00 0.00 54.13 55.37 2brt s LEU 105 Cb 0.20 -4.56 0.13 0.00 0.03 0.00 0.00 46.19 41.99 2brt s LEU 105 CO 0.47 -2.71 1.13 -0.94 0.23 0.00 0.00 176.35 174.53 2brt s SER 106 N -2.83 3.27 0.30 2.29 1.04 -1.26 -4.83 113.70 111.67 2brt s SER 106 Ca 0.66 2.05 0.01 0.00 0.48 0.00 0.00 55.95 59.15 2brt s SER 106 Cb -0.22 -2.53 0.55 0.00 0.10 0.00 0.00 66.02 63.92 2brt s SER 106 CO 0.56 -2.86 1.88 0.58 0.98 0.00 0.00 173.24 174.38 2brt h VAL 107 N -1.70 1.01 -0.03 5.02 2.07 -1.94 -2.24 116.25 118.43 2brt h VAL 107 Ca -0.44 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 2brt h VAL 107 Cb 1.26 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2brt h VAL 107 CO 0.45 0.18 -0.13 -0.33 0.02 0.00 0.00 177.57 177.76 2brt h GLU 108 N 1.01 0.05 0.00 1.57 4.39 -1.99 0.34 114.58 119.94 2brt h GLU 108 Ca 0.43 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.99 2brt h GLU 108 Cb 0.32 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2brt h GLU 108 CO -0.18 0.18 -0.81 0.93 -1.16 0.00 0.00 179.01 177.96 2brt h GLU 109 N 0.05 0.00 -0.11 2.33 4.39 -1.84 -3.28 114.58 116.12 2brt h GLU 109 Ca 0.01 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.48 2brt h GLU 109 Cb 0.26 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2brt h GLU 109 CO 0.02 0.48 -0.85 0.87 -1.16 0.00 0.00 179.01 178.37 2brt h LYS 110 N 0.00 0.74 -0.15 2.33 1.57 -0.57 -3.17 116.57 117.32 2brt h LYS 110 Ca -0.05 -0.65 0.04 0.00 -1.87 0.00 0.00 60.65 58.12 2brt h LYS 110 Cb 1.48 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.93 2brt h LYS 110 CO 0.06 1.25 0.44 0.93 -0.57 0.00 0.00 179.45 181.57 2brt h GLU 111 N 0.48 0.00 0.00 3.15 4.39 -0.45 0.56 114.58 122.71 2brt h GLU 111 Ca -0.07 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 2brt h GLU 111 Cb 1.48 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.13 2brt h GLU 111 CO 0.17 0.00 -0.06 0.87 -1.16 0.00 0.00 179.01 178.83 2brt h LYS 112 N 0.00 0.00 -0.54 2.33 6.56 -1.67 -1.45 116.57 121.79 2brt h LYS 112 Ca 0.07 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.66 2brt h LYS 112 Cb 0.95 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.61 2brt h LYS 112 CO -0.00 0.06 0.00 0.66 -2.06 0.00 0.00 179.45 178.11 2brt n TYR 113 N -3.30 0.87 -1.73 -1.35 4.02 0.19 -5.01 117.16 110.86 2brt n TYR 113 Ca -0.01 -0.54 -0.42 0.00 -0.01 0.00 0.00 57.90 56.91 2brt n TYR 113 Cb 0.24 -0.07 -0.02 0.00 -0.02 0.00 0.00 39.34 39.48 2brt n TYR 113 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2brt n ALA 114 N 0.99 2.20 -1.08 -0.72 0.00 -0.55 -0.60 120.51 120.75 2brt n ALA 114 Ca 0.20 0.38 -0.29 0.00 0.00 0.00 0.00 53.44 53.72 2brt n ALA 114 Cb 0.61 -2.41 0.22 0.00 0.00 0.00 0.00 19.45 17.87 2brt n ALA 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2brt s ASN 115 N 0.34 1.47 -0.38 0.00 2.20 -0.11 -4.69 114.94 113.77 2brt s ASN 115 Ca 0.63 0.86 0.04 0.00 -0.94 0.00 0.00 52.86 53.45 2brt s ASN 115 Cb -0.53 -1.29 0.16 0.00 -2.00 0.00 0.00 41.25 37.59 2brt s ASN 115 CO 0.51 -3.81 0.42 -0.62 -2.94 0.00 0.00 177.10 170.66 2brt s ASP 116 N -3.66 0.74 0.45 3.54 2.15 0.22 -4.98 116.67 115.13 2brt s ASP 116 Ca 0.69 -1.46 0.24 0.00 0.43 0.00 0.00 52.55 52.45 2brt s ASP 116 Cb -0.14 0.78 1.00 0.00 -0.30 0.00 0.00 42.92 44.26 2brt s ASP 116 CO 0.57 -0.24 1.86 1.56 -0.17 0.00 0.00 175.17 178.75 2brt h GLN 117 N 7.05 0.00 0.00 4.34 4.20 -1.93 0.17 115.11 128.93 2brt h GLN 117 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2brt h GLN 117 Cb 1.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.85 2brt h GLN 117 CO 0.18 0.22 0.00 0.00 -0.67 0.00 0.00 178.83 178.56 2brt h ALA 118 N 1.78 1.00 -0.10 3.87 0.00 -1.95 -2.24 119.26 121.62 2brt h ALA 118 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2brt h ALA 118 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2brt h ALA 118 CO 0.03 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.53 2brt n THR 119 N -2.46 1.32 -1.08 0.00 -2.24 -0.62 -4.98 114.28 104.21 2brt n THR 119 Ca 0.01 -1.36 -0.03 0.00 -2.27 0.00 0.00 64.05 60.40 2brt n THR 119 Cb 0.23 0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.72 2brt n THR 119 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2brt n GLY 120 N -0.49 0.60 3.46 3.38 0.00 -0.84 -4.97 105.19 106.33 2brt n GLY 120 Ca 0.08 -0.56 -0.44 0.00 0.00 0.00 0.00 46.02 45.11 2brt n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2brt s LYS 121 N -1.68 3.66 0.20 1.61 1.02 -0.05 -4.84 119.74 119.66 2brt s LYS 121 Ca 0.00 -1.83 0.14 0.00 0.02 0.00 0.00 55.97 54.30 2brt s LYS 121 Cb 0.00 -4.96 -0.03 0.00 -0.52 0.00 0.00 37.83 32.32 2brt s LYS 121 CO 0.00 -1.79 1.27 -0.84 -0.92 0.00 0.00 175.35 173.07 2brt h ILE 122 N 5.75 0.93 -3.86 2.17 3.07 -1.93 0.63 117.51 124.26 2brt h ILE 122 Ca 0.18 -2.39 -0.47 0.00 1.55 0.00 0.00 64.86 63.73 2brt h ILE 122 Cb 1.01 2.42 -0.02 0.00 -0.27 0.00 0.00 36.82 39.95 2brt h ILE 122 CO 1.14 0.53 0.34 -1.10 -1.05 0.00 0.00 178.15 178.01 2brt s GLN 123 N -2.90 4.62 0.00 0.16 -0.21 -1.26 -4.85 119.66 115.22 2brt s GLN 123 Ca 0.02 1.34 0.00 0.00 0.02 0.00 0.00 55.36 56.74 2brt s GLN 123 Cb 0.08 -2.86 0.00 0.00 1.00 0.00 0.00 33.01 31.23 2brt s GLN 123 CO 0.77 0.31 0.00 0.41 -2.12 0.00 0.00 175.29 174.67 2brt n GLY 124 N 0.69 0.78 3.72 3.09 0.00 0.18 -4.20 105.19 109.45 2brt n GLY 124 Ca 0.01 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 2brt n GLY 124 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2brt s TYR 125 N -1.04 3.44 0.36 1.61 5.04 0.23 -1.70 117.35 125.28 2brt s TYR 125 Ca 0.00 1.35 -0.17 0.00 -2.44 0.00 0.00 57.07 55.81 2brt s TYR 125 Cb 0.00 -3.43 0.05 0.00 0.35 0.00 0.00 41.96 38.93 2brt s TYR 125 CO 0.00 -1.26 0.77 0.20 -1.34 0.00 0.00 175.55 173.92 2brt s GLY 126 N 0.60 0.25 -0.11 8.97 0.00 0.14 -0.94 107.32 116.23 2brt s GLY 126 Ca 0.56 -0.63 -0.18 0.00 0.00 0.00 0.00 44.72 44.47 2brt s GLY 126 CO 0.33 -0.24 0.45 -0.45 0.00 0.00 0.00 173.10 173.19 2brt s SER 127 N -3.03 -0.43 -0.10 1.64 0.15 -1.26 -0.43 113.70 110.24 2brt s SER 127 Ca 0.14 0.67 -0.30 0.00 0.70 0.00 0.00 55.95 57.17 2brt s SER 127 Cb -0.05 0.72 -0.02 0.00 -1.71 0.00 0.00 66.02 64.96 2brt s SER 127 CO 0.10 -0.30 1.12 -0.75 1.20 0.00 0.00 173.24 174.61 2brt s LYS 128 N -0.38 4.36 0.44 5.44 2.20 -1.26 -5.01 119.74 125.53 2brt s LYS 128 Ca -0.05 1.55 -0.20 0.00 -0.36 0.00 0.00 55.97 56.90 2brt s LYS 128 Cb -0.03 -3.57 -0.11 0.00 -1.51 0.00 0.00 37.83 32.61 2brt s LYS 128 CO 0.03 -0.43 0.96 -0.51 -0.36 0.00 0.00 175.35 175.03 2brt s LEU 129 N 2.31 3.89 0.32 5.43 1.02 -1.26 -4.78 118.68 125.62 2brt s LEU 129 Ca 0.52 1.67 -0.29 0.00 0.02 0.00 0.00 54.13 56.05 2brt s LEU 129 Cb -0.21 -4.54 -0.10 0.00 0.02 0.00 0.00 46.19 41.36 2brt s LEU 129 CO 0.19 -0.39 1.40 0.00 0.02 0.00 0.00 176.35 177.56 2brt s ALA 130 N -2.25 3.56 -0.00 4.21 0.00 -1.26 -4.91 121.76 121.11 2brt s ALA 130 Ca 0.62 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.96 2brt s ALA 130 Cb -0.09 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.49 2brt s ALA 130 CO 0.16 -0.80 0.66 0.27 0.00 0.00 0.00 175.76 176.04 2brt n ASN 131 N 1.11 0.21 -1.97 0.00 0.23 -1.26 -5.07 115.26 108.51 2brt n ASN 131 Ca 0.02 -1.33 -0.05 0.00 -0.53 0.00 0.00 54.58 52.70 2brt n ASN 131 Cb 0.40 -0.05 0.02 0.00 -2.08 0.00 0.00 39.78 38.07 2brt n ASN 131 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2brt n ASN 132 N -0.07 -1.22 -0.33 0.53 0.23 -1.26 -4.93 115.26 108.21 2brt n ASN 132 Ca 0.00 -1.83 -0.04 0.00 -0.53 0.00 0.00 54.58 52.18 2brt n ASN 132 Cb 0.52 2.03 0.09 0.00 -2.08 0.00 0.00 39.78 40.34 2brt n ASN 132 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2brt h ALA 133 N 2.00 1.14 -2.72 -2.53 0.00 -1.97 -3.38 119.26 111.80 2brt h ALA 133 Ca -0.18 -0.13 -0.52 0.00 0.00 0.00 0.00 54.91 54.08 2brt h ALA 133 Cb 0.66 -0.36 0.07 0.00 0.00 0.00 0.00 17.79 18.16 2brt h ALA 133 CO 0.23 0.64 0.94 -1.54 0.00 0.00 0.00 179.25 179.52 2brt s SER 134 N -6.20 6.40 -0.05 0.00 1.04 -1.26 -4.92 113.70 108.70 2brt s SER 134 Ca -0.13 2.88 0.01 0.00 0.48 0.00 0.00 55.95 59.19 2brt s SER 134 Cb 0.17 -2.61 0.09 0.00 0.10 0.00 0.00 66.02 63.77 2brt s SER 134 CO 0.83 -0.93 0.98 0.61 0.98 0.00 0.00 173.24 175.70 2brt n GLY 135 N 3.16 2.13 3.74 7.32 0.00 -1.26 -4.66 105.19 115.61 2brt n GLY 135 Ca 0.12 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2brt n GLY 135 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2brt s GLN 136 N -0.68 4.11 0.26 1.61 -1.52 -1.26 -4.82 119.66 117.36 2brt s GLN 136 Ca 0.07 2.61 0.11 0.00 -1.95 0.00 0.00 55.36 56.21 2brt s GLN 136 Cb 0.06 -3.03 -0.05 0.00 -0.22 0.00 0.00 33.01 29.77 2brt s GLN 136 CO 0.02 -0.69 -0.17 -0.51 -0.25 0.00 0.00 175.29 173.69 2brt s LEU 137 N 0.03 2.68 0.09 2.90 1.43 0.20 -4.62 118.68 121.39 2brt s LEU 137 Ca 0.67 -0.93 0.06 0.00 -1.03 0.00 0.00 54.13 52.91 2brt s LEU 137 Cb -0.49 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2brt s LEU 137 CO 0.43 0.05 -0.08 -1.61 0.23 0.00 0.00 176.35 175.37 2brt s GLU 138 N -3.40 2.25 -1.52 1.70 8.01 -1.26 -4.35 118.70 120.12 2brt s GLU 138 Ca 0.29 -0.96 -0.12 0.00 0.01 0.00 0.00 54.97 54.19 2brt s GLU 138 Cb -0.06 -2.37 -0.00 0.00 -4.31 0.00 0.00 34.13 27.39 2brt s GLU 138 CO 0.15 0.52 2.53 1.87 0.01 0.00 0.00 175.26 180.34 2brt n TRP 139 N 0.75 3.00 -3.52 1.61 -0.00 0.77 -4.82 117.44 115.23 2brt n TRP 139 Ca -0.13 -3.01 -0.17 0.00 -0.00 0.00 0.00 57.50 54.18 2brt n TRP 139 Cb 0.52 -2.48 -0.06 0.00 -0.00 0.00 0.00 31.31 29.30 2brt n TRP 139 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 177.69 175.86 2brt s GLU 140 N 2.45 1.07 0.23 5.87 -1.05 -1.26 -4.37 118.70 121.64 2brt s GLU 140 Ca 0.57 0.15 0.08 0.00 -0.15 0.00 0.00 54.97 55.62 2brt s GLU 140 Cb 0.16 0.50 -0.04 0.00 -0.44 0.00 0.00 34.13 34.31 2brt s GLU 140 CO -0.07 -0.35 0.01 -0.51 0.95 0.00 0.00 175.26 175.29 2brt s ASP 141 N -1.39 4.71 0.13 0.83 1.01 0.17 -4.46 116.67 117.68 2brt s ASP 141 Ca -0.10 -0.51 -0.04 0.00 0.71 0.00 0.00 52.55 52.62 2brt s ASP 141 Cb -0.00 -0.96 -0.03 0.00 1.01 0.00 0.00 42.92 42.94 2brt s ASP 141 CO 0.07 0.04 0.12 -0.72 0.21 0.00 0.00 175.17 174.89 2brt s TYR 142 N -2.05 0.66 -0.09 4.23 -0.85 0.42 0.14 117.35 119.81 2brt s TYR 142 Ca 0.30 -1.05 0.01 0.00 -0.52 0.00 0.00 57.07 55.81 2brt s TYR 142 Cb -0.08 -0.33 0.02 0.00 0.38 0.00 0.00 41.96 41.95 2brt s TYR 142 CO 0.20 -0.57 -0.10 0.12 -1.52 0.00 0.00 175.55 173.68 2brt s PHE 143 N -4.00 1.47 -0.05 -3.49 5.36 -0.06 -0.68 117.98 116.52 2brt s PHE 143 Ca 0.19 -0.63 0.01 0.00 -0.96 0.00 0.00 56.93 55.55 2brt s PHE 143 Cb 0.06 -1.14 0.02 0.00 -0.34 0.00 0.00 43.02 41.63 2brt s PHE 143 CO -0.01 -0.38 -0.06 0.12 -1.46 0.00 0.00 175.22 173.44 2brt s PHE 144 N 1.09 0.91 0.01 10.12 5.36 -0.69 0.40 117.98 135.18 2brt s PHE 144 Ca -0.07 -0.29 -0.24 0.00 -0.96 0.00 0.00 56.93 55.37 2brt s PHE 144 Cb -0.14 -0.78 0.05 0.00 -0.34 0.00 0.00 43.02 41.81 2brt s PHE 144 CO -0.01 -0.24 0.54 -3.38 -1.46 0.00 0.00 175.22 170.67 2brt s HIS 145 N 1.00 -0.47 0.33 10.12 -3.43 -0.15 0.48 115.29 123.17 2brt s HIS 145 Ca -0.10 0.65 -0.29 0.00 -0.80 0.00 0.00 55.06 54.52 2brt s HIS 145 Cb -0.14 0.33 -0.10 0.00 -1.43 0.00 0.00 32.58 31.24 2brt s HIS 145 CO -0.00 -0.60 1.34 -1.17 -2.00 0.00 0.00 174.74 172.31 2brt s LEU 146 N -1.65 4.41 -0.03 5.38 0.20 -1.26 -0.07 118.68 125.67 2brt s LEU 146 Ca -0.08 2.72 0.00 0.00 0.69 0.00 0.00 54.13 57.46 2brt s LEU 146 Cb -0.01 -3.65 -0.02 0.00 -0.43 0.00 0.00 46.19 42.08 2brt s LEU 146 CO 0.03 -0.58 -0.02 0.00 -0.29 0.00 0.00 176.35 175.48 2brt n ALA 147 N 0.95 1.94 -3.00 5.97 0.00 0.01 -4.75 120.51 121.63 2brt n ALA 147 Ca 0.01 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.22 2brt n ALA 147 Cb 0.41 0.41 -0.12 0.00 0.00 0.00 0.00 19.45 20.15 2brt n ALA 147 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2brt s TYR 148 N -2.05 -0.07 0.64 0.00 5.04 -1.17 -4.65 117.35 115.09 2brt s TYR 148 Ca -0.03 0.17 -0.09 0.00 -2.44 0.00 0.00 57.07 54.68 2brt s TYR 148 Cb 0.01 0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.33 2brt s TYR 148 CO 0.06 -0.10 1.00 -1.25 -1.34 0.00 0.00 175.55 173.92 2brt s PRO 149 N -0.25 3.01 0.46 4.97 0.05 -1.26 -1.90 135.00 140.08 2brt s PRO 149 Ca -0.03 0.31 0.13 0.00 0.05 0.00 0.00 61.00 61.46 2brt s PRO 149 Cb -0.02 -2.14 1.05 0.00 0.05 0.00 0.00 34.50 33.43 2brt s PRO 149 CO 0.00 -0.80 2.05 0.93 0.05 0.00 0.00 177.00 179.23 2brt h GLU 150 N -0.38 0.11 0.00 4.56 4.39 -1.99 -1.63 114.58 119.64 2brt h GLU 150 Ca -0.45 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.23 2brt h GLU 150 Cb 1.24 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2brt h GLU 150 CO 0.62 0.17 0.00 0.93 -1.16 0.00 0.00 179.01 179.57 2brt h GLU 151 N 0.11 0.00 -0.32 2.33 3.07 -1.97 -2.85 114.58 114.96 2brt h GLU 151 Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 2brt h GLU 151 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2brt h GLU 151 CO 0.01 0.00 0.00 1.63 -1.40 0.00 0.00 179.01 179.25 2brt n LYS 152 N -2.61 2.30 -3.05 2.33 5.02 -0.61 -4.97 118.16 116.56 2brt n LYS 152 Ca 0.03 -2.11 -0.39 0.00 -2.02 0.00 0.00 58.31 53.82 2brt n LYS 152 Cb 0.35 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.85 2brt n LYS 152 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2brt s ARG 153 N -1.40 4.48 -0.71 1.97 0.52 -1.08 -4.97 118.95 117.76 2brt s ARG 153 Ca 0.33 1.06 -0.15 0.00 -0.52 0.00 0.00 55.73 56.45 2brt s ARG 153 Cb 0.20 -3.25 0.17 0.00 0.52 0.00 0.00 34.95 32.59 2brt s ARG 153 CO 0.28 0.59 0.69 0.34 0.02 0.00 0.00 175.30 177.21 2brt s ASP 154 N -1.15 6.51 0.46 0.23 2.15 -1.26 -4.92 116.67 118.69 2brt s ASP 154 Ca 0.34 -2.23 0.30 0.00 0.43 0.00 0.00 52.55 51.39 2brt s ASP 154 Cb -0.22 -2.23 1.17 0.00 -0.30 0.00 0.00 42.92 41.34 2brt s ASP 154 CO 0.25 -0.75 1.88 -0.07 -0.17 0.00 0.00 175.17 176.31 2brt h LEU 155 N 8.51 0.00 -1.46 -1.34 3.38 -1.96 -2.67 115.31 119.77 2brt h LEU 155 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2brt h LEU 155 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2brt h LEU 155 CO 0.90 0.00 0.00 0.77 0.09 0.00 0.00 178.44 180.20 2brt h SER 156 N 0.00 0.00 0.00 -0.43 4.64 -2.02 -0.22 113.55 115.52 2brt h SER 156 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2brt h SER 156 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2brt h SER 156 CO 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 175.93 2brt n ILE 157 N -2.89 0.00 -3.00 0.95 0.13 -1.00 -4.93 119.36 108.62 2brt n ILE 157 Ca 0.00 -0.29 -0.34 0.00 -1.10 0.00 0.00 62.75 61.03 2brt n ILE 157 Cb 0.26 0.68 -0.06 0.00 -0.84 0.00 0.00 39.64 39.68 2brt n ILE 157 CO 0.00 0.00 0.00 0.26 2.80 0.00 0.00 176.55 179.61 2brt s TRP 158 N -2.05 3.49 0.08 9.51 0.52 -0.09 -4.85 118.94 125.55 2brt s TRP 158 Ca 0.35 1.44 -0.34 0.00 0.02 0.00 0.00 56.10 57.57 2brt s TRP 158 Cb 0.21 -2.69 -0.13 0.00 -1.15 0.00 0.00 33.47 29.71 2brt s TRP 158 CO 0.35 0.14 1.66 -2.30 0.02 0.00 0.00 176.95 176.82 2brt n PRO 159 N 0.03 2.13 -0.01 4.98 -0.02 -1.26 -4.88 135.00 135.97 2brt n PRO 159 Ca 0.02 0.77 -0.01 0.00 -2.02 0.00 0.00 63.50 62.27 2brt n PRO 159 Cb 0.52 -2.56 -0.12 0.00 -0.02 0.00 0.00 33.50 31.32 2brt n PRO 159 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2brt n LYS 160 N 4.37 0.65 -4.13 -0.52 4.01 -1.26 -4.29 118.16 116.99 2brt n LYS 160 Ca 0.19 0.09 -0.33 0.00 -0.51 0.00 0.00 58.31 57.75 2brt n LYS 160 Cb 0.29 -1.68 -0.16 0.00 -0.51 0.00 0.00 35.03 32.97 2brt n LYS 160 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2brt s THR 161 N -2.91 2.33 0.44 -0.18 2.01 -1.26 -2.70 115.64 113.37 2brt s THR 161 Ca -0.06 -0.85 -0.23 0.00 0.31 0.00 0.00 61.69 60.86 2brt s THR 161 Cb 0.09 -2.00 -0.08 0.00 0.01 0.00 0.00 72.50 70.52 2brt s THR 161 CO 0.83 0.52 1.13 -2.16 -0.69 0.00 0.00 174.62 174.25 2brt s PRO 162 N 1.28 3.88 0.43 4.92 0.04 -1.26 -4.61 135.00 139.68 2brt s PRO 162 Ca 0.04 1.70 0.18 0.00 0.04 0.00 0.00 61.00 62.96 2brt s PRO 162 Cb -0.13 -2.45 1.11 0.00 0.04 0.00 0.00 34.50 33.06 2brt s PRO 162 CO -0.10 -0.43 1.87 0.66 0.04 0.00 0.00 177.00 179.04 2brt h SER 163 N 2.19 0.38 0.16 6.66 4.64 -1.85 -0.58 113.55 125.14 2brt h SER 163 Ca -0.49 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2brt h SER 163 Cb 1.24 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2brt h SER 163 CO 0.61 0.16 -0.00 -0.67 -0.87 0.00 0.00 176.83 176.05 2brt n ASP 164 N -4.49 0.06 0.13 4.97 4.64 -1.26 -4.18 116.55 116.42 2brt n ASP 164 Ca 0.18 -0.78 -0.13 0.00 -1.38 0.00 0.00 54.79 52.68 2brt n ASP 164 Cb 0.69 -0.08 -0.06 0.00 -1.04 0.00 0.00 41.12 40.63 2brt n ASP 164 CO 0.00 0.00 0.00 0.22 -0.82 0.00 0.00 177.20 176.60 2brt h TYR 165 N 0.09 -0.66 -0.27 -0.67 3.20 -1.36 -1.79 116.97 115.51 2brt h TYR 165 Ca 0.00 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 2brt h TYR 165 Cb 0.10 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 2brt h TYR 165 CO 0.00 -0.35 0.14 0.82 -1.64 0.00 0.00 178.16 177.13 2brt h ILE 166 N -0.48 1.13 -0.27 1.81 2.04 -1.75 -1.46 117.51 118.54 2brt h ILE 166 Ca 0.02 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 2brt h ILE 166 Cb 0.48 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 2brt h ILE 166 CO -0.11 0.13 -0.03 -0.33 0.00 0.00 0.00 178.15 177.82 2brt h GLU 167 N 0.31 0.49 0.03 2.37 3.07 -1.82 -1.51 114.58 117.52 2brt h GLU 167 Ca 0.09 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.36 58.78 2brt h GLU 167 Cb 0.09 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 2brt h GLU 167 CO -0.01 0.67 -0.01 0.00 -1.40 0.00 0.00 179.01 178.26 2brt h ALA 168 N 0.80 -0.04 -0.36 3.43 0.00 -1.26 -1.99 119.26 119.84 2brt h ALA 168 Ca 0.07 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2brt h ALA 168 Cb 0.47 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2brt h ALA 168 CO 0.02 -0.46 0.07 1.15 0.00 0.00 0.00 179.25 180.03 2brt h THR 169 N -0.16 1.23 0.00 0.00 2.02 -1.27 -1.52 112.91 113.21 2brt h THR 169 Ca -0.00 -0.82 0.00 0.00 0.77 0.00 0.00 66.41 66.36 2brt h THR 169 Cb 0.15 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2brt h THR 169 CO 0.01 0.28 0.00 -1.54 0.37 0.00 0.00 175.52 174.63 2brt n SER 170 N -4.58 0.00 0.01 4.18 3.41 -0.57 -1.27 113.62 114.80 2brt n SER 170 Ca -0.01 0.48 -0.10 0.00 -0.26 0.00 0.00 58.87 58.97 2brt n SER 170 Cb 0.22 -0.49 -0.14 0.00 -0.26 0.00 0.00 64.21 63.54 2brt n SER 170 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2brt h GLU 171 N 0.00 0.05 0.00 4.33 4.57 -1.09 -2.90 114.58 119.54 2brt h GLU 171 Ca 0.00 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2brt h GLU 171 Cb 0.41 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 2brt h GLU 171 CO 0.00 0.73 -0.00 -0.92 -1.18 0.00 0.00 179.01 177.64 2brt h TYR 172 N 0.01 -0.00 0.32 0.92 3.20 -0.92 -0.75 116.97 119.75 2brt h TYR 172 Ca -0.23 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.64 2brt h TYR 172 Cb 1.96 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 40.20 2brt h TYR 172 CO 0.01 0.34 -0.50 0.00 -1.64 0.00 0.00 178.16 176.37 2brt h ALA 173 N 0.66 -1.02 -0.70 1.82 0.00 -1.33 0.50 119.26 119.18 2brt h ALA 173 Ca -0.00 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2brt h ALA 173 Cb 0.34 0.78 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 2brt h ALA 173 CO 0.00 -1.13 -0.42 1.63 0.00 0.00 0.00 179.25 179.33 2brt n LYS 174 N -5.52 -0.31 -0.33 0.00 5.02 -1.10 -0.43 118.16 115.49 2brt n LYS 174 Ca -0.10 1.11 0.01 0.00 -2.02 0.00 0.00 58.31 57.31 2brt n LYS 174 Cb 0.43 -1.63 0.18 0.00 -0.02 0.00 0.00 35.03 33.99 2brt n LYS 174 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2brt h LEU 176 N 1.18 0.01 -0.39 0.00 3.38 0.25 -2.48 115.31 117.25 2brt h LEU 176 Ca 0.37 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.20 2brt h LEU 176 Cb 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2brt h LEU 176 CO -0.11 0.26 -0.28 -0.09 0.09 0.00 0.00 178.44 178.31 2brt h ARG 177 N 0.01 0.88 -0.12 1.13 9.65 -0.39 -1.63 114.38 123.90 2brt h ARG 177 Ca -0.00 -0.42 -0.00 0.00 -1.10 0.00 0.00 59.98 58.45 2brt h ARG 177 Cb 0.45 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 2brt h ARG 177 CO 0.03 1.07 0.06 -0.07 2.80 0.00 0.00 179.97 183.87 2brt h LEU 178 N 0.69 0.14 -1.08 3.80 3.38 -1.46 -1.29 115.31 119.50 2brt h LEU 178 Ca 0.08 -0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.08 2brt h LEU 178 Cb 0.85 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.49 2brt h LEU 178 CO 0.07 0.19 0.62 0.25 0.09 0.00 0.00 178.44 179.66 2brt h LEU 179 N 0.09 0.88 -0.40 1.67 5.85 -1.39 -2.04 115.31 119.97 2brt h LEU 179 Ca 0.04 0.04 -0.16 0.00 0.84 0.00 0.00 57.88 58.64 2brt h LEU 179 Cb 0.07 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 2brt h LEU 179 CO -0.01 0.47 -0.44 0.00 -0.34 0.00 0.00 178.44 178.13 2brt h ALA 180 N 1.55 0.58 -0.87 1.25 0.00 -0.89 0.66 119.26 121.54 2brt h ALA 180 Ca 0.48 -0.47 0.08 0.00 0.00 0.00 0.00 54.91 55.00 2brt h ALA 180 Cb 0.50 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 2brt h ALA 180 CO -0.24 0.68 0.52 1.15 0.00 0.00 0.00 179.25 181.36 2brt h THR 181 N 0.70 0.97 -0.05 0.00 2.02 -0.72 -0.38 112.91 115.45 2brt h THR 181 Ca 0.05 -0.31 -0.08 0.00 0.77 0.00 0.00 66.41 66.84 2brt h THR 181 Cb 1.02 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2brt h THR 181 CO 0.10 0.16 -0.28 0.11 0.37 0.00 0.00 175.52 175.99 2brt h LYS 182 N 0.90 0.27 -0.32 6.66 1.57 -0.82 -1.59 116.57 123.23 2brt h LYS 182 Ca 0.40 -0.23 0.07 0.00 -1.87 0.00 0.00 60.65 59.02 2brt h LYS 182 Cb 0.30 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.59 2brt h LYS 182 CO -0.22 0.89 -0.09 0.28 -0.57 0.00 0.00 179.45 179.74 2brt h VAL 183 N -0.27 0.67 -0.84 0.50 2.07 -0.78 -0.88 116.25 116.71 2brt h VAL 183 Ca -0.02 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.52 2brt h VAL 183 Cb 0.95 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 2brt h VAL 183 CO 0.06 0.00 0.56 -0.26 0.02 0.00 0.00 177.57 177.94 2brt h PHE 184 N -0.01 1.03 0.48 1.57 0.05 -1.07 0.47 116.94 119.47 2brt h PHE 184 Ca 0.16 0.02 -0.02 0.00 3.82 0.00 0.00 57.97 61.95 2brt h PHE 184 Cb 0.24 -0.35 -0.00 0.00 2.00 0.00 0.00 35.95 37.84 2brt h PHE 184 CO -0.31 0.62 -0.29 0.87 -0.18 0.00 0.00 178.31 179.02 2brt h LYS 185 N 1.08 -0.71 -0.85 1.51 1.57 -0.84 -0.02 116.57 118.32 2brt h LYS 185 Ca 0.32 0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 59.12 2brt h LYS 185 Cb -0.03 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 2brt h LYS 185 CO -0.09 -0.47 0.41 0.00 -0.57 0.00 0.00 179.45 178.73 2brt h ALA 186 N -0.26 1.09 -0.71 3.86 0.00 -0.40 -2.04 119.26 120.79 2brt h ALA 186 Ca -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2brt h ALA 186 Cb 0.60 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2brt h ALA 186 CO 0.06 0.65 0.35 -0.07 0.00 0.00 0.00 179.25 180.25 2brt h LEU 187 N 1.20 0.92 0.07 0.00 3.38 -0.90 0.65 115.31 120.63 2brt h LEU 187 Ca 0.29 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.15 2brt h LEU 187 Cb 0.11 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2brt h LEU 187 CO -0.04 0.79 -0.11 0.28 0.09 0.00 0.00 178.44 179.44 2brt h SER 188 N 0.99 -0.31 -0.40 -0.43 0.02 -0.47 -1.65 113.55 111.30 2brt h SER 188 Ca 0.25 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.24 2brt h SER 188 Cb 0.10 0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 2brt h SER 188 CO -0.03 -0.17 0.25 0.58 -1.14 0.00 0.00 176.83 176.32 2brt h VAL 189 N -0.23 1.08 -0.87 2.27 2.07 -1.07 0.42 116.25 119.92 2brt h VAL 189 Ca 0.02 -0.17 0.20 0.00 0.82 0.00 0.00 66.70 67.57 2brt h VAL 189 Cb 0.24 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.48 2brt h VAL 189 CO -0.06 0.09 0.59 1.23 0.02 0.00 0.00 177.57 179.44 2brt h GLY 190 N 0.51 0.69 1.39 2.17 0.00 -0.63 0.25 103.07 107.45 2brt h GLY 190 Ca 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2brt h GLY 190 CO -0.05 -0.00 -0.56 1.41 0.00 0.00 0.00 176.54 177.34 2brt h LEU 191 N 0.33 0.00 0.00 3.11 3.38 -0.60 -3.48 115.31 118.04 2brt h LEU 191 Ca 0.45 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2brt h LEU 191 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2brt h LEU 191 CO -0.14 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.03 2brt n GLY 192 N 1.21 0.85 3.97 0.83 0.00 0.89 -5.09 105.19 107.84 2brt n GLY 192 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 2brt n GLY 192 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2brt s LEU 193 N 0.00 2.87 0.62 0.99 1.43 0.04 -4.95 118.68 119.68 2brt s LEU 193 Ca 0.00 -0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 52.86 2brt s LEU 193 Cb 0.00 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 44.02 2brt s LEU 193 CO 0.00 -2.16 1.10 -1.61 0.23 0.00 0.00 176.35 173.91 2brt s GLU 194 N -5.42 3.03 0.45 1.70 0.41 -1.26 -4.05 118.70 113.55 2brt s GLU 194 Ca 0.69 1.41 0.25 0.00 -0.41 0.00 0.00 54.97 56.91 2brt s GLU 194 Cb -0.05 -1.98 0.85 0.00 -1.78 0.00 0.00 34.13 31.17 2brt s GLU 194 CO 0.48 -1.07 1.79 -1.00 -0.49 0.00 0.00 175.26 174.97 2brt h PRO 195 N 0.40 0.00 -0.00 0.39 0.13 -1.92 -2.61 132.00 128.39 2brt h PRO 195 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2brt h PRO 195 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2brt h PRO 195 CO 0.55 0.18 -0.11 -0.25 -0.23 0.00 0.00 178.00 178.15 2brt n ASP 196 N -3.28 0.18 0.34 1.44 8.00 -1.26 -4.19 116.55 117.78 2brt n ASP 196 Ca 0.01 0.05 -0.14 0.00 0.71 0.00 0.00 54.79 55.42 2brt n ASP 196 Cb 0.45 -0.25 -0.07 0.00 -0.02 0.00 0.00 41.12 41.24 2brt n ASP 196 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2brt h ARG 197 N 0.11 -0.87 -0.87 -1.24 9.65 -1.80 -2.82 114.38 116.54 2brt h ARG 197 Ca 0.00 0.06 0.12 0.00 -1.10 0.00 0.00 59.98 59.06 2brt h ARG 197 Cb 0.44 0.20 -0.08 0.00 -1.39 0.00 0.00 29.97 29.13 2brt h ARG 197 CO 0.00 -0.58 0.49 -0.07 2.80 0.00 0.00 179.97 182.61 2brt h LEU 198 N -1.18 0.67 -0.24 3.80 3.38 -1.83 0.16 115.31 120.06 2brt h LEU 198 Ca -0.09 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2brt h LEU 198 Cb 0.69 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2brt h LEU 198 CO 0.15 0.34 0.15 -0.08 0.09 0.00 0.00 178.44 179.10 2brt h GLU 199 N 0.77 0.32 0.00 1.13 4.81 -1.84 -1.31 114.58 118.46 2brt h GLU 199 Ca 0.44 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.59 2brt h GLU 199 Cb 0.50 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2brt h GLU 199 CO -0.29 0.24 -0.25 0.87 -0.73 0.00 0.00 179.01 178.85 2brt h LYS 200 N 0.31 0.00 0.00 1.92 1.79 -1.04 0.66 116.57 120.21 2brt h LYS 200 Ca 0.09 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.48 2brt h LYS 200 Cb -0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 2brt h LYS 200 CO -0.02 0.25 -0.36 0.93 -1.08 0.00 0.00 179.45 179.17 2brt h GLU 201 N 0.00 0.00 -0.01 3.15 4.39 -0.30 -2.89 114.58 118.93 2brt h GLU 201 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2brt h GLU 201 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2brt h GLU 201 CO 0.03 0.36 -0.59 1.33 -1.16 0.00 0.00 179.01 178.99 2brt n VAL 202 N -3.45 0.00 0.00 3.13 0.24 -0.56 -4.97 118.33 112.72 2brt n VAL 202 Ca 0.00 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 2brt n VAL 202 Cb 0.53 0.83 0.00 0.00 -1.47 0.00 0.00 33.84 33.73 2brt n VAL 202 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2brt n GLY 203 N 1.44 0.68 1.92 7.63 0.00 -0.25 -4.22 105.19 112.39 2brt n GLY 203 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.23 2brt n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2brt n GLY 204 N 0.00 -1.87 0.39 -0.02 0.00 0.21 -1.58 105.19 102.32 2brt n GLY 204 Ca 0.00 -1.21 0.25 0.00 0.00 0.00 0.00 46.02 45.06 2brt n GLY 204 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2brt h LEU 205 N 0.00 0.46 0.37 0.99 3.38 -1.94 -2.43 115.31 116.14 2brt h LEU 205 Ca 0.02 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2brt h LEU 205 Cb 0.92 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2brt h LEU 205 CO 0.01 -0.04 -0.18 1.05 0.09 0.00 0.00 178.44 179.37 2brt h GLU 206 N 0.34 -0.48 0.00 1.13 4.11 -1.99 -3.39 114.58 114.30 2brt h GLU 206 Ca 0.69 0.03 0.00 0.00 0.07 0.00 0.00 59.36 60.16 2brt h GLU 206 Cb 1.74 0.11 0.00 0.00 0.50 0.00 0.00 28.75 31.10 2brt h GLU 206 CO -0.45 -0.32 -0.84 0.39 0.07 0.00 0.00 179.01 177.86 2brt n GLU 207 N -3.33 1.48 -2.48 1.06 -0.58 -0.61 -4.97 120.64 111.21 2brt n GLU 207 Ca -0.06 -0.01 -0.40 0.00 -0.42 0.00 0.00 57.16 56.27 2brt n GLU 207 Cb 0.19 -1.29 -0.04 0.00 -0.57 0.00 0.00 31.44 29.74 2brt n GLU 207 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2brt s LEU 208 N -2.86 4.54 0.01 -4.62 1.98 -0.93 -4.00 118.68 112.80 2brt s LEU 208 Ca 0.05 2.24 0.04 0.00 -2.89 0.00 0.00 54.13 53.57 2brt s LEU 208 Cb 0.12 -3.62 -0.03 0.00 0.66 0.00 0.00 46.19 43.32 2brt s LEU 208 CO 0.68 -0.15 -0.10 -0.76 -1.89 0.00 0.00 176.35 174.13 2brt s LEU 209 N -1.25 3.00 -0.16 -0.68 1.43 0.23 -4.52 118.68 116.73 2brt s LEU 209 Ca 0.45 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.35 2brt s LEU 209 Cb -0.31 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.19 2brt s LEU 209 CO 0.40 0.28 -0.18 -0.76 0.23 0.00 0.00 176.35 176.32 2brt s LEU 210 N -1.36 2.27 -0.13 1.79 1.43 -0.80 -0.58 118.68 121.31 2brt s LEU 210 Ca 0.16 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 2brt s LEU 210 Cb -0.11 -1.51 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 2brt s LEU 210 CO 0.06 0.05 -0.09 -1.10 0.23 0.00 0.00 176.35 175.51 2brt s GLN 211 N 1.00 3.35 -0.17 1.70 -1.52 0.30 -0.81 119.66 123.51 2brt s GLN 211 Ca -0.02 -0.60 -0.11 0.00 -1.95 0.00 0.00 55.36 52.67 2brt s GLN 211 Cb -0.15 -2.72 -0.05 0.00 -0.22 0.00 0.00 33.01 29.88 2brt s GLN 211 CO -0.05 0.31 0.20 1.41 -0.25 0.00 0.00 175.29 176.91 2brt s MET 212 N 0.13 4.14 -0.14 2.91 -2.45 0.90 -1.09 119.30 123.69 2brt s MET 212 Ca -0.04 -0.08 -0.01 0.00 -1.25 0.00 0.00 55.69 54.31 2brt s MET 212 Cb -0.14 -3.39 0.04 0.00 1.25 0.00 0.00 34.83 32.58 2brt s MET 212 CO 0.04 0.33 -0.03 0.21 1.05 0.00 0.00 175.02 176.62 2brt s LYS 213 N 0.23 1.10 -0.34 4.11 2.20 -0.31 -0.98 119.74 125.76 2brt s LYS 213 Ca 0.12 -0.30 -0.19 0.00 -0.36 0.00 0.00 55.97 55.25 2brt s LYS 213 Cb -0.12 -1.69 -0.01 0.00 -1.51 0.00 0.00 37.83 34.50 2brt s LYS 213 CO 0.01 -0.41 0.54 0.42 -0.36 0.00 0.00 175.35 175.55 2brt s ILE 214 N 1.77 5.00 -0.23 5.43 1.01 0.16 -1.33 121.20 133.01 2brt s ILE 214 Ca 0.02 0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.98 2brt s ILE 214 Cb -0.14 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 2brt s ILE 214 CO -0.07 -0.19 0.41 0.20 0.00 0.00 0.00 174.94 175.28 2brt s ASN 215 N 1.74 6.38 -0.27 3.58 -0.87 -0.15 -0.88 114.94 124.47 2brt s ASN 215 Ca 0.20 0.44 0.01 0.00 -1.57 0.00 0.00 52.86 51.94 2brt s ASN 215 Cb -0.15 -2.23 0.05 0.00 -0.02 0.00 0.00 41.25 38.90 2brt s ASN 215 CO 0.13 -0.14 -0.08 -0.47 -2.57 0.00 0.00 177.10 173.97 2brt s TYR 216 N 1.70 3.22 -0.53 2.20 5.04 0.12 -1.60 117.35 127.50 2brt s TYR 216 Ca 0.18 -2.09 -0.10 0.00 -2.44 0.00 0.00 57.07 52.62 2brt s TYR 216 Cb -0.15 -1.99 0.13 0.00 0.35 0.00 0.00 41.96 40.30 2brt s TYR 216 CO 0.09 -0.84 0.41 0.71 -1.34 0.00 0.00 175.55 174.58 2brt s TYR 217 N 1.18 3.44 0.97 4.97 1.51 0.90 -0.65 117.35 129.66 2brt s TYR 217 Ca -0.06 -1.91 -0.11 0.00 -1.01 0.00 0.00 57.07 53.98 2brt s TYR 217 Cb -0.19 -3.54 0.18 0.00 -0.11 0.00 0.00 41.96 38.30 2brt s TYR 217 CO -0.04 -0.98 1.10 -2.14 -1.11 0.00 0.00 175.55 172.38 2brt s PRO 218 N 1.13 0.57 0.68 -1.71 0.02 -1.26 -1.93 135.00 132.50 2brt s PRO 218 Ca 0.08 1.24 -0.17 0.00 0.02 0.00 0.00 61.00 62.17 2brt s PRO 218 Cb -0.24 -1.70 -0.00 0.00 0.02 0.00 0.00 34.50 32.57 2brt s PRO 218 CO -0.01 -2.83 1.09 1.63 -0.33 0.00 0.00 177.00 176.54 2brt n LYS 219 N -4.34 0.74 -4.07 5.54 5.02 -1.26 -4.64 118.16 115.15 2brt n LYS 219 Ca 0.09 0.31 -0.20 0.00 -2.02 0.00 0.00 58.31 56.48 2brt n LYS 219 Cb 0.53 -2.33 -0.17 0.00 -0.02 0.00 0.00 35.03 33.04 2brt n LYS 219 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2brt h PRO 221 N 7.43 0.00 -2.10 0.00 0.13 -1.88 -3.22 132.00 132.36 2brt h PRO 221 Ca -0.34 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.22 2brt h PRO 221 Cb 1.15 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.87 2brt h PRO 221 CO 0.43 0.18 -0.90 1.04 -0.23 0.00 0.00 178.00 178.52 2brt n GLN 222 N -3.26 1.67 0.12 0.86 6.02 -1.26 -4.97 117.38 116.55 2brt n GLN 222 Ca 0.01 -3.93 0.05 0.00 -0.01 0.00 0.00 57.00 53.12 2brt n GLN 222 Cb 0.46 -1.76 0.50 0.00 1.02 0.00 0.00 30.24 30.45 2brt n GLN 222 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2brt h PRO 223 N 3.76 0.28 0.00 -1.09 0.13 -1.86 -2.40 132.00 130.82 2brt h PRO 223 Ca 0.12 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2brt h PRO 223 Cb 0.77 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2brt h PRO 223 CO 0.64 0.23 0.00 0.39 -0.23 0.00 0.00 178.00 179.03 2brt n GLU 224 N -4.46 0.89 0.00 0.86 1.02 -1.26 -2.09 120.64 115.60 2brt n GLU 224 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 2brt n GLU 224 Cb 0.11 -1.18 -0.05 0.00 -0.02 0.00 0.00 31.44 30.30 2brt n GLU 224 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2brt n LEU 225 N -0.68 1.12 -4.31 -4.62 4.77 -0.90 -4.82 117.00 107.56 2brt n LEU 225 Ca 0.08 -0.61 -0.16 0.00 -0.03 0.00 0.00 56.01 55.28 2brt n LEU 225 Cb 0.04 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.02 2brt n LEU 225 CO 0.06 0.24 -0.25 0.00 -1.33 0.00 0.00 177.39 176.10 2brt s ALA 226 N -2.24 1.69 0.01 -1.18 0.00 -0.89 -1.56 121.76 117.60 2brt s ALA 226 Ca 0.09 -1.86 0.06 0.00 0.00 0.00 0.00 51.96 50.26 2brt s ALA 226 Cb 0.12 1.06 -0.02 0.00 0.00 0.00 0.00 23.12 24.29 2brt s ALA 226 CO 0.54 -0.46 -0.19 -0.51 0.00 0.00 0.00 175.76 175.13 2brt s LEU 227 N -3.30 2.10 0.04 0.00 1.43 -1.26 -4.64 118.68 113.04 2brt s LEU 227 Ca 0.38 -0.42 -0.27 0.00 -1.03 0.00 0.00 54.13 52.79 2brt s LEU 227 Cb 0.08 -0.96 -0.17 0.00 0.03 0.00 0.00 46.19 45.17 2brt s LEU 227 CO 0.13 0.19 1.48 1.23 0.23 0.00 0.00 176.35 179.62 2brt h GLY 228 N 5.31 -0.41 -5.68 -3.19 0.00 -0.56 0.22 103.07 98.76 2brt h GLY 228 Ca -0.40 0.15 -0.36 0.00 0.00 0.00 0.00 47.33 46.73 2brt h GLY 228 CO 0.46 -0.15 -0.76 0.54 0.00 0.00 0.00 176.54 176.63 2brt s VAL 229 N -5.41 0.46 1.05 4.60 0.11 -1.04 -3.77 120.40 116.41 2brt s VAL 229 Ca -0.15 -0.19 -0.12 0.00 -2.93 0.00 0.00 61.98 58.60 2brt s VAL 229 Cb 0.03 -0.43 0.22 0.00 -1.53 0.00 0.00 36.38 34.67 2brt s VAL 229 CO 0.61 0.16 1.07 -1.83 -3.33 0.00 0.00 175.10 171.78 2brt s GLU 230 N 0.26 -0.06 0.09 1.54 -1.05 -1.26 -1.76 118.70 116.46 2brt s GLU 230 Ca -0.03 1.04 -0.31 0.00 -0.15 0.00 0.00 54.97 55.53 2brt s GLU 230 Cb -0.07 -1.64 -0.09 0.00 -0.44 0.00 0.00 34.13 31.89 2brt s GLU 230 CO -0.00 -3.20 1.77 0.00 0.95 0.00 0.00 175.26 174.78 2brt s ALA 231 N -2.59 3.72 0.18 -0.84 0.00 -1.26 -4.41 121.76 116.56 2brt s ALA 231 Ca 0.67 1.34 -0.24 0.00 0.00 0.00 0.00 51.96 53.74 2brt s ALA 231 Cb -0.23 -3.75 0.06 0.00 0.00 0.00 0.00 23.12 19.20 2brt s ALA 231 CO 0.62 -1.21 0.76 -3.38 0.00 0.00 0.00 175.76 172.54 2brt s HIS 232 N 2.86 -0.31 0.10 0.00 -0.00 -0.43 -4.93 115.29 112.59 2brt s HIS 232 Ca 0.79 0.00 0.03 0.00 -0.00 0.00 0.00 55.06 55.88 2brt s HIS 232 Cb -0.43 0.62 -0.04 0.00 -0.00 0.00 0.00 32.58 32.73 2brt s HIS 232 CO 0.35 -0.94 0.10 0.95 -0.00 0.00 0.00 174.74 175.21 2brt s THR 233 N -3.62 4.58 0.24 -5.38 -4.23 -1.26 -1.36 115.64 104.60 2brt s THR 233 Ca 0.07 -0.82 -0.28 0.00 -1.18 0.00 0.00 61.69 59.49 2brt s THR 233 Cb -0.03 -3.24 -0.09 0.00 1.34 0.00 0.00 72.50 70.49 2brt s THR 233 CO -0.02 0.07 0.90 -1.81 -0.54 0.00 0.00 174.62 173.21 2brt s ASP 234 N -2.57 7.52 0.14 3.99 -0.00 -1.26 -4.94 116.67 119.55 2brt s ASP 234 Ca 0.30 1.84 0.27 0.00 -0.00 0.00 0.00 52.55 54.96 2brt s ASP 234 Cb -0.12 -2.57 0.90 0.00 -0.00 0.00 0.00 42.92 41.13 2brt s ASP 234 CO 0.23 0.13 1.79 1.33 -0.00 0.00 0.00 175.17 178.64 2brt n VAL 235 N 1.33 0.40 -0.43 -1.27 0.24 -1.26 -0.25 118.33 117.08 2brt n VAL 235 Ca -0.02 -0.20 -0.29 0.00 -2.04 0.00 0.00 64.34 61.80 2brt n VAL 235 Cb 0.48 -0.52 0.27 0.00 -1.47 0.00 0.00 33.84 32.60 2brt n VAL 235 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2brt n SER 236 N -2.01 -2.35 -0.02 -1.34 3.41 -1.26 -2.73 113.62 107.32 2brt n SER 236 Ca 0.06 -0.33 -0.09 0.00 -0.26 0.00 0.00 58.87 58.25 2brt n SER 236 Cb 0.40 -1.18 -0.08 0.00 -0.26 0.00 0.00 64.21 63.10 2brt n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2brt h ALA 237 N -2.88 -0.09 -3.39 7.33 0.00 -1.47 -0.99 119.26 117.77 2brt h ALA 237 Ca -0.59 -0.27 -0.29 0.00 0.00 0.00 0.00 54.91 53.76 2brt h ALA 237 Cb 1.34 0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.93 2brt h ALA 237 CO 0.45 -0.12 -0.74 -0.51 0.00 0.00 0.00 179.25 178.32 2brt s LEU 238 N -8.62 2.19 -0.07 0.00 1.43 -1.15 -1.80 118.68 110.66 2brt s LEU 238 Ca -0.12 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 52.60 2brt s LEU 238 Cb -0.01 -0.21 -0.00 0.00 0.03 0.00 0.00 46.19 46.00 2brt s LEU 238 CO 0.44 -0.12 -0.21 -0.89 0.23 0.00 0.00 176.35 175.80 2brt s THR 239 N -1.02 1.75 -0.11 5.49 2.01 -0.93 -0.13 115.64 122.69 2brt s THR 239 Ca -0.06 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.08 2brt s THR 239 Cb -0.08 -1.52 -0.02 0.00 0.01 0.00 0.00 72.50 70.90 2brt s THR 239 CO 0.00 0.49 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.95 2brt s PHE 240 N 0.24 2.83 -0.08 4.92 0.40 0.23 -1.16 117.98 125.36 2brt s PHE 240 Ca -0.12 -0.45 0.03 0.00 -0.60 0.00 0.00 56.93 55.79 2brt s PHE 240 Cb -0.15 -1.81 0.01 0.00 0.51 0.00 0.00 43.02 41.58 2brt s PHE 240 CO 0.06 -0.07 -0.15 0.42 0.70 0.00 0.00 175.22 176.17 2brt s ILE 241 N 0.05 1.40 0.14 0.64 1.09 0.17 -0.66 121.20 124.04 2brt s ILE 241 Ca -0.04 -0.63 0.03 0.00 -1.10 0.00 0.00 60.65 58.92 2brt s ILE 241 Cb -0.14 -1.26 -0.04 0.00 -1.06 0.00 0.00 42.46 39.96 2brt s ILE 241 CO 0.04 0.41 0.21 -0.76 -0.10 0.00 0.00 174.94 174.74 2brt s LEU 242 N 0.64 4.11 0.21 2.97 1.43 -0.11 -1.45 118.68 126.47 2brt s LEU 242 Ca -0.14 0.05 -0.08 0.00 -1.03 0.00 0.00 54.13 52.93 2brt s LEU 242 Cb -0.16 -2.70 -0.02 0.00 0.03 0.00 0.00 46.19 43.34 2brt s LEU 242 CO 0.04 0.07 0.32 -1.38 0.23 0.00 0.00 176.35 175.64 2brt s HIS 243 N -1.71 0.59 -0.28 0.29 -3.43 -1.26 -0.45 115.29 109.03 2brt s HIS 243 Ca 0.33 -0.91 0.02 0.00 -0.80 0.00 0.00 55.06 53.69 2brt s HIS 243 Cb -0.11 -0.09 0.37 0.00 -1.43 0.00 0.00 32.58 31.32 2brt s HIS 243 CO 0.26 -0.81 1.62 0.27 -2.00 0.00 0.00 174.74 174.09 2brt n ASN 244 N -0.30 4.02 -1.89 7.38 6.94 -0.75 -4.85 115.26 125.83 2brt n ASN 244 Ca -0.03 -2.98 -0.16 0.00 -0.02 0.00 0.00 54.58 51.39 2brt n ASN 244 Cb 0.63 -0.76 0.00 0.00 -2.36 0.00 0.00 39.78 37.29 2brt n ASN 244 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2brt n MET 245 N -0.36 -1.77 -4.85 -3.83 2.81 -1.26 -4.96 117.12 102.89 2brt n MET 245 Ca 0.35 0.74 -0.33 0.00 -1.81 0.00 0.00 57.70 56.65 2brt n MET 245 Cb 1.08 -5.10 -0.14 0.00 -0.71 0.00 0.00 33.22 28.35 2brt n MET 245 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2brt s VAL 246 N -2.83 2.96 0.50 2.03 1.01 -1.26 -5.02 120.40 117.80 2brt s VAL 246 Ca 0.05 -0.72 -0.20 0.00 0.00 0.00 0.00 61.98 61.12 2brt s VAL 246 Cb -0.02 -2.21 -0.08 0.00 0.00 0.00 0.00 36.38 34.07 2brt s VAL 246 CO 0.06 0.55 1.06 -2.16 0.00 0.00 0.00 175.10 174.61 2brt s PRO 247 N -0.00 3.70 0.00 2.72 0.04 -1.26 -4.82 135.00 135.38 2brt s PRO 247 Ca -0.04 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2brt s PRO 247 Cb -0.14 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2brt s PRO 247 CO 0.04 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 176.97 2brt n GLY 248 N -0.20 0.10 3.69 0.56 0.00 -1.26 -4.90 105.19 103.17 2brt n GLY 248 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2brt n GLY 248 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2brt s LEU 249 N 0.00 4.34 0.06 0.99 2.96 -1.26 -1.29 118.68 124.48 2brt s LEU 249 Ca 0.00 2.32 0.05 0.00 -0.22 0.00 0.00 54.13 56.28 2brt s LEU 249 Cb 0.00 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.10 2brt s LEU 249 CO 0.00 -0.80 -0.15 -1.10 -1.32 0.00 0.00 176.35 172.98 2brt s GLN 250 N 2.40 0.89 -0.02 1.98 -0.21 -0.31 -0.63 119.66 123.76 2brt s GLN 250 Ca 0.69 -0.89 0.05 0.00 0.02 0.00 0.00 55.36 55.23 2brt s GLN 250 Cb -0.36 -0.91 -0.01 0.00 1.00 0.00 0.00 33.01 32.73 2brt s GLN 250 CO 0.30 0.21 -0.17 -0.51 -2.12 0.00 0.00 175.29 173.00 2brt s LEU 251 N -1.50 2.00 -0.52 2.90 2.01 -0.51 -0.53 118.68 122.54 2brt s LEU 251 Ca -0.00 -0.32 -0.17 0.00 0.01 0.00 0.00 54.13 53.65 2brt s LEU 251 Cb -0.09 -0.90 0.08 0.00 0.01 0.00 0.00 46.19 45.29 2brt s LEU 251 CO 0.02 0.20 0.55 0.12 1.01 0.00 0.00 176.35 178.25 2brt s PHE 252 N -0.29 3.13 -0.03 0.29 5.36 0.38 0.47 117.98 127.29 2brt s PHE 252 Ca 0.04 -0.87 0.03 0.00 -0.96 0.00 0.00 56.93 55.16 2brt s PHE 252 Cb -0.08 -3.57 0.01 0.00 -0.34 0.00 0.00 43.02 39.04 2brt s PHE 252 CO 0.00 -1.01 -0.10 -0.47 -1.46 0.00 0.00 175.22 172.18 2brt s TYR 253 N 2.17 1.07 -0.28 10.12 5.04 -0.09 -4.61 117.35 130.77 2brt s TYR 253 Ca 0.09 -0.29 -0.05 0.00 -2.44 0.00 0.00 57.07 54.37 2brt s TYR 253 Cb -0.24 -0.77 0.01 0.00 0.35 0.00 0.00 41.96 41.31 2brt s TYR 253 CO 0.08 -0.13 0.17 0.39 -1.34 0.00 0.00 175.55 174.72 2brt n GLU 254 N 3.39 -0.65 -0.52 4.97 1.02 -1.26 -1.42 120.64 126.17 2brt n GLU 254 Ca -0.19 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 56.83 2brt n GLU 254 Cb 0.54 -0.25 0.00 0.00 -0.02 0.00 0.00 31.44 31.71 2brt n GLU 254 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2brt n GLY 255 N -1.05 1.86 3.14 0.62 0.00 -1.26 -4.97 105.19 103.53 2brt n GLY 255 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2brt n GLY 255 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2brt s LYS 256 N -0.02 0.75 -0.43 1.61 3.01 -0.51 -5.13 119.74 119.03 2brt s LYS 256 Ca 0.00 -1.25 -0.19 0.00 -1.01 0.00 0.00 55.97 53.52 2brt s LYS 256 Cb 0.00 -0.12 0.02 0.00 -1.01 0.00 0.00 37.83 36.72 2brt s LYS 256 CO 0.00 -0.03 0.55 -1.58 0.51 0.00 0.00 175.35 174.80 2brt s TRP 257 N -3.47 3.11 -0.09 3.18 0.52 -1.26 -0.91 118.94 120.02 2brt s TRP 257 Ca 0.09 -0.16 -0.17 0.00 0.02 0.00 0.00 56.10 55.87 2brt s TRP 257 Cb 0.04 -3.14 -0.05 0.00 -1.15 0.00 0.00 33.47 29.17 2brt s TRP 257 CO -0.05 -0.78 0.44 0.08 0.02 0.00 0.00 176.95 176.65 2brt s VAL 258 N 2.52 5.15 -0.08 4.03 1.01 0.18 -4.86 120.40 128.36 2brt s VAL 258 Ca 0.18 0.88 -0.18 0.00 0.00 0.00 0.00 61.98 62.86 2brt s VAL 258 Cb -0.15 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 2brt s VAL 258 CO 0.16 0.40 0.49 -0.89 0.00 0.00 0.00 175.10 175.27 2brt s THR 259 N 0.16 5.11 0.35 3.92 2.01 -1.26 -1.42 115.64 124.51 2brt s THR 259 Ca 0.24 1.00 -0.28 0.00 0.31 0.00 0.00 61.69 62.96 2brt s THR 259 Cb -0.15 -3.83 -0.10 0.00 0.01 0.00 0.00 72.50 68.43 2brt s THR 259 CO 0.10 0.38 1.25 0.00 -0.69 0.00 0.00 174.62 175.66 2brt s ALA 260 N 0.25 3.39 0.53 7.40 0.00 0.20 -4.84 121.76 128.70 2brt s ALA 260 Ca 0.27 1.16 -0.03 0.00 0.00 0.00 0.00 51.96 53.35 2brt s ALA 260 Cb -0.16 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.53 2brt s ALA 260 CO 0.12 -0.58 0.80 0.15 0.00 0.00 0.00 175.76 176.25 2brt s LYS 261 N -1.89 2.94 -0.73 0.00 -0.14 -1.26 -4.72 119.74 113.93 2brt s LYS 261 Ca 0.51 -0.26 -0.16 0.00 -1.36 0.00 0.00 55.97 54.70 2brt s LYS 261 Cb -0.37 -2.40 0.17 0.00 -1.68 0.00 0.00 37.83 33.55 2brt s LYS 261 CO 0.48 -0.54 0.75 0.00 -0.76 0.00 0.00 175.35 175.28 2brt s VAL 263 N 1.31 4.92 0.31 0.00 1.01 -1.26 -5.06 120.40 121.64 2brt s VAL 263 Ca 0.15 1.14 -0.29 0.00 0.00 0.00 0.00 61.98 62.98 2brt s VAL 263 Cb -0.16 -4.01 -0.10 0.00 0.00 0.00 0.00 36.38 32.11 2brt s VAL 263 CO -0.03 -0.06 1.26 -2.84 0.00 0.00 0.00 175.10 173.42 2brt s PRO 264 N 2.64 4.42 -0.74 2.72 0.02 -1.26 -3.36 135.00 139.43 2brt s PRO 264 Ca 0.28 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.42 2brt s PRO 264 Cb -0.15 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.26 2brt s PRO 264 CO 0.10 -0.11 0.00 -0.25 -0.33 0.00 0.00 177.00 176.41 2brt n ASP 265 N 1.03 -4.19 -4.86 2.53 10.43 -1.26 -5.00 116.55 115.23 2brt n ASP 265 Ca 0.00 0.17 -0.24 0.00 2.57 0.00 0.00 54.79 57.30 2brt n ASP 265 Cb 0.42 -2.30 -0.03 0.00 1.84 0.00 0.00 41.12 41.06 2brt n ASP 265 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2brt s SER 266 N -2.67 4.73 -0.06 -2.24 1.04 -1.22 -4.71 113.70 108.57 2brt s SER 266 Ca 0.00 -1.05 -0.01 0.00 0.48 0.00 0.00 55.95 55.38 2brt s SER 266 Cb 0.00 -0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.06 2brt s SER 266 CO 0.00 -0.85 -0.02 -0.63 0.98 0.00 0.00 173.24 172.72 2brt s ILE 267 N -2.64 0.45 0.05 -1.02 1.01 -0.49 -4.85 121.20 113.70 2brt s ILE 267 Ca 0.40 0.03 -0.31 0.00 0.00 0.00 0.00 60.65 60.78 2brt s ILE 267 Cb -0.01 -0.56 -0.06 0.00 0.01 0.00 0.00 42.46 41.84 2brt s ILE 267 CO 0.24 0.25 1.38 -0.69 0.00 0.00 0.00 174.94 176.12 2brt s VAL 268 N 1.63 3.59 -0.08 2.92 1.01 -0.53 0.68 120.40 129.63 2brt s VAL 268 Ca -0.00 1.06 0.05 0.00 0.00 0.00 0.00 61.98 63.09 2brt s VAL 268 Cb -0.13 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 2brt s VAL 268 CO -0.04 0.03 -0.23 -0.32 0.00 0.00 0.00 175.10 174.54 2brt s MET 269 N 1.84 2.81 -0.10 2.72 1.75 -0.40 0.45 119.30 128.38 2brt s MET 269 Ca 0.64 -0.87 -0.03 0.00 -1.25 0.00 0.00 55.69 54.17 2brt s MET 269 Cb -0.33 -2.26 -0.03 0.00 2.84 0.00 0.00 34.83 35.05 2brt s MET 269 CO 0.28 0.29 0.03 -1.01 -0.65 0.00 0.00 175.02 173.96 2brt s HIS 270 N 0.06 3.24 0.16 4.11 3.76 -0.31 -2.43 115.29 123.87 2brt s HIS 270 Ca -0.10 0.22 -0.30 0.00 -0.15 0.00 0.00 55.06 54.72 2brt s HIS 270 Cb -0.16 -1.85 -0.07 0.00 1.11 0.00 0.00 32.58 31.61 2brt s HIS 270 CO 0.06 0.46 1.19 0.42 -0.85 0.00 0.00 174.74 176.02 2brt s ILE 271 N -0.74 3.71 0.46 0.60 -1.09 -0.11 -2.20 121.20 121.83 2brt s ILE 271 Ca 0.12 1.39 0.06 0.00 -2.23 0.00 0.00 60.65 59.99 2brt s ILE 271 Cb -0.12 -3.89 -0.02 0.00 -1.58 0.00 0.00 42.46 36.86 2brt s ILE 271 CO 0.02 0.20 0.28 -0.83 -1.23 0.00 0.00 174.94 173.38 2brt s GLY 272 N 0.32 2.36 0.32 6.18 0.00 -0.75 -4.20 107.32 111.54 2brt s GLY 272 Ca 0.54 -1.69 0.02 0.00 0.00 0.00 0.00 44.72 43.59 2brt s GLY 272 CO 0.35 -1.90 1.92 -0.55 0.00 0.00 0.00 173.10 172.91 2brt h ASP 273 N 1.14 0.84 -0.23 1.64 3.32 0.20 -1.64 116.42 121.69 2brt h ASP 273 Ca -0.41 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.57 2brt h ASP 273 Cb 1.27 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.64 2brt h ASP 273 CO 0.64 0.53 -0.12 0.74 -1.72 0.00 0.00 179.24 179.31 2brt h THR 274 N 0.95 1.25 -0.13 0.35 2.02 -1.01 0.07 112.91 116.40 2brt h THR 274 Ca 0.38 -1.10 -0.20 0.00 0.77 0.00 0.00 66.41 66.26 2brt h THR 274 Cb 0.25 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2brt h THR 274 CO -0.15 0.37 -0.72 -0.07 0.37 0.00 0.00 175.52 175.32 2brt h LEU 275 N 0.58 0.72 -1.10 2.58 3.38 -1.45 -2.85 115.31 117.17 2brt h LEU 275 Ca 0.10 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 2brt h LEU 275 Cb 0.55 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 2brt h LEU 275 CO 0.03 1.22 0.40 -0.08 0.09 0.00 0.00 178.44 180.11 2brt h GLU 276 N 0.43 1.03 -0.03 1.13 4.81 -0.92 0.87 114.58 121.90 2brt h GLU 276 Ca -0.03 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 2brt h GLU 276 Cb 1.32 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 2brt h GLU 276 CO 0.14 0.76 -0.01 0.82 -0.73 0.00 0.00 179.01 179.99 2brt h ILE 277 N 1.04 1.29 -0.40 2.32 2.04 -1.04 0.16 117.51 122.92 2brt h ILE 277 Ca 0.26 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 2brt h ILE 277 Cb 0.03 1.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2brt h ILE 277 CO -0.04 0.23 0.14 -0.07 0.00 0.00 0.00 178.15 178.42 2brt h LEU 278 N -0.30 0.51 -0.80 1.44 3.38 -1.24 -2.46 115.31 115.83 2brt h LEU 278 Ca 0.01 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2brt h LEU 278 Cb 0.38 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2brt h LEU 278 CO 0.00 0.48 -0.07 -1.54 0.09 0.00 0.00 178.44 177.39 2brt n SER 279 N -4.37 1.32 -3.03 -0.43 3.41 0.27 -1.34 113.62 109.45 2brt n SER 279 Ca 0.03 -1.30 -0.22 0.00 -0.26 0.00 0.00 58.87 57.12 2brt n SER 279 Cb 0.15 0.04 0.04 0.00 -0.26 0.00 0.00 64.21 64.18 2brt n SER 279 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2brt n ASN 280 N -0.10 -6.07 0.00 4.04 5.15 -0.49 -3.28 115.26 114.51 2brt n ASN 280 Ca 0.17 -0.32 0.00 0.00 -0.60 0.00 0.00 54.58 53.83 2brt n ASN 280 Cb 0.35 -4.85 0.00 0.00 -0.53 0.00 0.00 39.78 34.75 2brt n ASN 280 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2brt n GLY 281 N -1.59 0.86 0.38 8.20 0.00 0.43 -4.80 105.19 108.67 2brt n GLY 281 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 2brt n GLY 281 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2brt h LYS 282 N 3.75 -0.54 -6.38 1.61 6.56 -1.80 -3.41 116.57 116.37 2brt h LYS 282 Ca 0.00 0.04 -0.55 0.00 -1.06 0.00 0.00 60.65 59.08 2brt h LYS 282 Cb 0.00 0.12 -0.04 0.00 -0.57 0.00 0.00 32.23 31.75 2brt h LYS 282 CO 0.00 -0.36 0.10 0.71 -2.06 0.00 0.00 179.45 177.84 2brt s TYR 283 N -5.16 3.84 -0.22 -1.35 4.12 -1.26 -4.34 117.35 112.98 2brt s TYR 283 Ca -0.13 1.48 -0.09 0.00 0.02 0.00 0.00 57.07 58.35 2brt s TYR 283 Cb 0.05 -2.68 -0.04 0.00 -1.52 0.00 0.00 41.96 37.77 2brt s TYR 283 CO 0.48 0.50 0.11 0.15 0.02 0.00 0.00 175.55 176.81 2brt s LYS 284 N -0.94 3.95 -0.71 -0.62 -0.14 -0.98 -4.17 119.74 116.13 2brt s LYS 284 Ca 0.34 -0.34 -0.18 0.00 -1.36 0.00 0.00 55.97 54.43 2brt s LYS 284 Cb -0.21 -3.39 0.13 0.00 -1.68 0.00 0.00 37.83 32.68 2brt s LYS 284 CO 0.23 0.08 0.82 0.45 -0.76 0.00 0.00 175.35 176.17 2brt s SER 285 N 0.94 6.38 0.45 2.83 0.15 -1.26 -4.20 113.70 118.99 2brt s SER 285 Ca 0.06 -1.76 -0.22 0.00 0.70 0.00 0.00 55.95 54.73 2brt s SER 285 Cb -0.14 -2.31 -0.09 0.00 -1.71 0.00 0.00 66.02 61.78 2brt s SER 285 CO 0.03 -1.03 1.05 -0.51 1.20 0.00 0.00 173.24 173.98 2brt s ILE 286 N 2.33 3.73 0.24 6.45 2.07 -1.26 -4.87 121.20 129.89 2brt s ILE 286 Ca 0.18 1.17 -0.30 0.00 -1.41 0.00 0.00 60.65 60.29 2brt s ILE 286 Cb -0.17 -3.53 -0.09 0.00 0.13 0.00 0.00 42.46 38.80 2brt s ILE 286 CO 0.00 -0.14 1.10 -0.76 -1.91 0.00 0.00 174.94 173.23 2brt s LEU 287 N -3.17 4.54 0.20 8.50 1.43 -1.26 -4.44 118.68 124.48 2brt s LEU 287 Ca 0.64 2.20 -0.19 0.00 -1.03 0.00 0.00 54.13 55.75 2brt s LEU 287 Cb -0.19 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.45 2brt s LEU 287 CO 0.23 -0.16 0.57 -1.38 0.23 0.00 0.00 176.35 175.84 2brt s HIS 288 N -0.85 -0.22 0.35 0.29 -3.43 -0.46 -0.47 115.29 110.50 2brt s HIS 288 Ca 0.46 -0.11 -0.09 0.00 -0.80 0.00 0.00 55.06 54.51 2brt s HIS 288 Cb -0.31 0.48 0.04 0.00 -1.43 0.00 0.00 32.58 31.35 2brt s HIS 288 CO 0.39 -0.95 0.63 2.89 -2.00 0.00 0.00 174.74 175.69 2brt n ARG 289 N -0.37 0.90 -3.85 -0.38 1.85 0.32 -1.31 116.66 113.83 2brt n ARG 289 Ca -0.11 -2.23 -0.20 0.00 -1.00 0.00 0.00 57.85 54.32 2brt n ARG 289 Cb 0.62 2.52 -0.17 0.00 -1.05 0.00 0.00 32.46 34.39 2brt n ARG 289 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2brt s GLY 290 N -2.93 0.32 0.16 2.89 0.00 -0.72 -1.17 107.32 105.87 2brt s GLY 290 Ca 0.19 0.07 -0.04 0.00 0.00 0.00 0.00 44.72 44.94 2brt s GLY 290 CO 0.14 0.91 0.38 1.08 0.00 0.00 0.00 173.10 175.60 2brt s LEU 291 N 1.52 4.25 0.49 0.66 1.43 -0.41 0.10 118.68 126.72 2brt s LEU 291 Ca -0.03 0.54 0.06 0.00 -1.03 0.00 0.00 54.13 53.67 2brt s LEU 291 Cb -0.13 -3.27 0.01 0.00 0.03 0.00 0.00 46.19 42.82 2brt s LEU 291 CO -0.03 0.02 0.32 0.68 0.23 0.00 0.00 176.35 177.57 2brt s VAL 292 N -1.73 1.92 0.29 -1.59 -7.23 -1.26 -4.56 120.40 106.25 2brt s VAL 292 Ca 0.40 -1.55 -0.06 0.00 -1.81 0.00 0.00 61.98 58.96 2brt s VAL 292 Cb -0.12 -2.47 -0.00 0.00 0.56 0.00 0.00 36.38 34.35 2brt s VAL 292 CO 0.26 0.00 0.44 0.54 -0.31 0.00 0.00 175.10 176.04 2brt s ASN 293 N -4.14 0.44 0.21 4.85 2.20 -1.26 -4.73 114.94 112.49 2brt s ASN 293 Ca 0.36 -1.26 0.22 0.00 -0.94 0.00 0.00 52.86 51.23 2brt s ASN 293 Cb -0.01 0.61 0.01 0.00 -2.00 0.00 0.00 41.25 39.86 2brt s ASN 293 CO 0.21 -1.20 1.06 0.07 -2.94 0.00 0.00 177.10 174.31 2brt h LYS 294 N 2.22 0.00 0.05 3.55 5.09 -1.93 0.34 116.57 125.89 2brt h LYS 294 Ca -0.28 0.00 -0.36 0.00 0.09 0.00 0.00 60.65 60.09 2brt h LYS 294 Cb 1.25 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 33.53 2brt h LYS 294 CO 0.39 0.03 -2.06 0.39 -2.09 0.00 0.00 179.45 176.11 2brt n GLU 295 N -2.73 0.67 -4.30 0.07 1.02 -1.26 -4.65 120.64 109.45 2brt n GLU 295 Ca -0.01 0.29 -0.20 0.00 -0.02 0.00 0.00 57.16 57.22 2brt n GLU 295 Cb 0.58 -1.64 -0.16 0.00 -0.02 0.00 0.00 31.44 30.20 2brt n GLU 295 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2brt s LYS 296 N -2.50 0.97 0.09 3.49 3.01 -1.26 -5.02 119.74 118.52 2brt s LYS 296 Ca -0.29 -0.22 -0.31 0.00 -1.01 0.00 0.00 55.97 54.14 2brt s LYS 296 Cb 0.08 -0.91 -0.09 0.00 -1.01 0.00 0.00 37.83 35.90 2brt s LYS 296 CO 0.65 0.01 1.81 0.08 0.51 0.00 0.00 175.35 178.41 2brt s VAL 297 N 0.56 2.78 -0.08 3.17 1.01 -1.26 -4.48 120.40 122.10 2brt s VAL 297 Ca -0.09 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 2brt s VAL 297 Cb -0.12 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 2brt s VAL 297 CO 0.01 -0.00 0.26 -0.60 0.00 0.00 0.00 175.10 174.76 2brt s ARG 298 N 3.09 3.74 -0.02 2.72 3.52 -0.81 -4.90 118.95 126.29 2brt s ARG 298 Ca 0.80 0.10 0.02 0.00 -0.13 0.00 0.00 55.73 56.52 2brt s ARG 298 Cb -0.43 -3.24 0.00 0.00 -1.56 0.00 0.00 34.95 29.72 2brt s ARG 298 CO 0.36 0.66 -0.06 0.42 -0.81 0.00 0.00 175.30 175.87 2brt s ILE 299 N -0.82 0.56 0.10 4.11 1.01 -1.26 -0.07 121.20 124.83 2brt s ILE 299 Ca 0.18 -0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.63 2brt s ILE 299 Cb -0.14 -0.52 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 2brt s ILE 299 CO 0.07 0.19 -0.10 -0.94 0.00 0.00 0.00 174.94 174.16 2brt s SER 300 N 0.22 1.47 -0.28 3.58 1.04 -0.63 -1.81 113.70 117.29 2brt s SER 300 Ca -0.03 -0.80 0.03 0.00 0.48 0.00 0.00 55.95 55.63 2brt s SER 300 Cb -0.07 0.00 0.07 0.00 0.10 0.00 0.00 66.02 66.13 2brt s SER 300 CO -0.00 -0.25 -0.04 0.26 0.98 0.00 0.00 173.24 174.19 2brt s TRP 301 N -2.35 3.22 -0.23 5.02 0.51 0.40 -0.98 118.94 124.53 2brt s TRP 301 Ca 0.05 -2.43 -0.07 0.00 -2.12 0.00 0.00 56.10 51.53 2brt s TRP 301 Cb -0.03 -2.18 -0.03 0.00 -0.81 0.00 0.00 33.47 30.41 2brt s TRP 301 CO 0.00 -0.89 0.05 0.00 -0.51 0.00 0.00 176.95 175.61 2brt s ALA 302 N 1.11 3.13 -0.24 0.98 0.00 -0.44 -0.94 121.76 125.36 2brt s ALA 302 Ca -0.01 -1.08 -0.07 0.00 0.00 0.00 0.00 51.96 50.80 2brt s ALA 302 Cb -0.19 -1.99 -0.03 0.00 0.00 0.00 0.00 23.12 20.91 2brt s ALA 302 CO -0.07 -0.37 0.05 0.08 0.00 0.00 0.00 175.76 175.45 2brt s VAL 303 N 1.41 4.16 -0.27 0.00 1.01 0.17 -1.16 120.40 125.71 2brt s VAL 303 Ca 0.05 -0.22 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 2brt s VAL 303 Cb -0.15 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 2brt s VAL 303 CO 0.03 0.35 0.17 -0.36 0.00 0.00 0.00 175.10 175.29 2brt s PHE 304 N 1.58 3.21 -0.41 5.22 0.40 -0.25 -0.60 117.98 127.13 2brt s PHE 304 Ca 0.06 0.04 -0.16 0.00 -0.60 0.00 0.00 56.93 56.28 2brt s PHE 304 Cb -0.15 -2.35 0.02 0.00 0.51 0.00 0.00 43.02 41.05 2brt s PHE 304 CO 0.02 -0.17 0.34 0.00 0.70 0.00 0.00 175.22 176.12 2brt s GLU 306 N 1.84 1.01 0.89 0.00 -1.05 0.25 -1.27 118.70 120.38 2brt s GLU 306 Ca 0.08 -1.29 -0.12 0.00 -0.15 0.00 0.00 54.97 53.48 2brt s GLU 306 Cb -0.18 -0.77 0.12 0.00 -0.44 0.00 0.00 34.13 32.86 2brt s GLU 306 CO 0.11 0.13 1.13 -1.25 0.95 0.00 0.00 175.26 176.33 2brt s PRO 307 N -3.00 1.35 0.50 -4.83 0.04 -1.26 -0.60 135.00 127.20 2brt s PRO 307 Ca 0.11 0.36 -0.23 0.00 0.04 0.00 0.00 61.00 61.28 2brt s PRO 307 Cb -0.03 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 2brt s PRO 307 CO 0.02 -2.07 1.36 -0.35 0.04 0.00 0.00 177.00 176.00 2brt n PRO 308 N -3.69 1.89 -0.11 0.56 -0.04 -1.26 -4.75 135.00 127.60 2brt n PRO 308 Ca 0.07 0.68 -0.12 0.00 -0.04 0.00 0.00 63.50 64.09 2brt n PRO 308 Cb 0.59 -2.56 -0.03 0.00 -0.04 0.00 0.00 33.50 31.45 2brt n PRO 308 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 2brt h LYS 309 N 1.77 0.66 -5.60 0.54 2.10 -1.95 -3.40 116.57 110.68 2brt h LYS 309 Ca -0.50 -0.27 -0.45 0.00 -2.00 0.00 0.00 60.65 57.42 2brt h LYS 309 Cb 1.29 -0.03 -0.19 0.00 -0.90 0.00 0.00 32.23 32.40 2brt h LYS 309 CO 0.58 0.86 -0.78 -0.51 -2.00 0.00 0.00 179.45 177.60 2brt s ASP 310 N -6.32 2.13 0.00 7.07 1.11 -1.26 -1.14 116.67 118.27 2brt s ASP 310 Ca -0.13 -0.76 0.00 0.00 0.18 0.00 0.00 52.55 51.84 2brt s ASP 310 Cb 0.09 -0.09 0.00 0.00 1.07 0.00 0.00 42.92 43.99 2brt s ASP 310 CO 0.80 -0.08 0.00 0.29 1.18 0.00 0.00 175.17 177.36 2brt n LYS 311 N 0.71 0.00 -3.84 8.23 5.02 -1.26 -5.06 118.16 121.96 2brt n LYS 311 Ca -0.17 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.76 2brt n LYS 311 Cb 0.56 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.44 2brt n LYS 311 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2brt s ILE 312 N 0.00 3.66 -0.49 -0.18 1.01 -1.26 -5.06 121.20 118.87 2brt s ILE 312 Ca 0.00 -0.54 -0.28 0.00 0.00 0.00 0.00 60.65 59.83 2brt s ILE 312 Cb 0.00 -2.75 0.03 0.00 0.01 0.00 0.00 42.46 39.75 2brt s ILE 312 CO 0.00 0.29 1.08 -0.69 0.00 0.00 0.00 174.94 175.62 2brt s VAL 313 N 1.49 4.27 0.16 2.92 1.01 -1.26 -3.99 120.40 125.00 2brt s VAL 313 Ca 0.04 1.02 -0.28 0.00 0.00 0.00 0.00 61.98 62.76 2brt s VAL 313 Cb -0.15 -4.57 -0.07 0.00 0.00 0.00 0.00 36.38 31.59 2brt s VAL 313 CO -0.01 -1.00 0.88 -0.76 0.00 0.00 0.00 175.10 174.22 2brt s LEU 314 N 4.29 4.56 -0.00 3.92 1.02 0.10 -4.87 118.68 127.70 2brt s LEU 314 Ca 0.44 1.76 -0.29 0.00 0.02 0.00 0.00 54.13 56.06 2brt s LEU 314 Cb -0.08 -3.48 0.10 0.00 0.02 0.00 0.00 46.19 42.75 2brt s LEU 314 CO 0.29 0.08 0.92 -1.59 0.02 0.00 0.00 176.35 176.07 2brt s LYS 315 N -0.65 0.82 0.30 1.70 -2.85 -1.26 -0.86 119.74 116.93 2brt s LYS 315 Ca 0.41 -0.32 -0.27 0.00 -1.00 0.00 0.00 55.97 54.79 2brt s LYS 315 Cb -0.24 0.36 -0.14 0.00 -2.06 0.00 0.00 37.83 35.76 2brt s LYS 315 CO 0.29 -0.36 0.92 -2.30 0.10 0.00 0.00 175.35 173.99 2brt n PRO 316 N -0.26 1.14 -2.54 1.78 -0.02 -1.01 -4.30 135.00 129.79 2brt n PRO 316 Ca -0.08 0.40 -0.34 0.00 -2.02 0.00 0.00 63.50 61.46 2brt n PRO 316 Cb 0.61 -1.74 -0.04 0.00 -0.02 0.00 0.00 33.50 32.32 2brt n PRO 316 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2brt s LEU 317 N 0.76 3.90 0.23 2.45 1.43 -0.45 -4.92 118.68 122.07 2brt s LEU 317 Ca 0.60 1.95 -0.05 0.00 -1.03 0.00 0.00 54.13 55.60 2brt s LEU 317 Cb -0.71 -4.49 0.21 0.00 0.03 0.00 0.00 46.19 41.24 2brt s LEU 317 CO 0.59 -0.73 1.71 1.55 0.23 0.00 0.00 176.35 179.71 2brt h PRO 318 N 1.74 0.94 -0.79 1.29 0.13 -1.91 0.55 132.00 133.94 2brt h PRO 318 Ca -0.49 -0.27 0.23 0.00 -0.87 0.00 0.00 66.00 64.60 2brt h PRO 318 Cb 1.22 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 2brt h PRO 318 CO 0.60 0.91 0.71 0.93 -0.23 0.00 0.00 178.00 180.92 2brt h GLU 319 N 0.87 0.00 -0.03 0.86 3.07 -1.97 -2.82 114.58 114.56 2brt h GLU 319 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 2brt h GLU 319 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 2brt h GLU 319 CO 0.02 0.00 -0.02 -1.33 -1.40 0.00 0.00 179.01 176.28 2brt n MET 320 N -3.82 1.93 -4.36 2.33 2.81 0.19 -4.91 117.12 111.29 2brt n MET 320 Ca 0.16 -1.74 -0.28 0.00 -1.81 0.00 0.00 57.70 54.04 2brt n MET 320 Cb 0.99 -1.41 -0.12 0.00 -0.71 0.00 0.00 33.22 31.98 2brt n MET 320 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2brt s VAL 321 N -1.79 2.62 0.36 2.03 -7.23 -1.07 -4.76 120.40 110.56 2brt s VAL 321 Ca 0.25 -1.74 -0.03 0.00 -1.81 0.00 0.00 61.98 58.64 2brt s VAL 321 Cb 0.18 -2.22 0.01 0.00 0.56 0.00 0.00 36.38 34.91 2brt s VAL 321 CO 0.28 0.00 0.53 -0.94 -0.31 0.00 0.00 175.10 174.66 2brt s SER 322 N -2.38 0.93 0.16 4.85 1.04 0.22 -4.96 113.70 113.56 2brt s SER 322 Ca 0.19 -1.50 -0.15 0.00 0.48 0.00 0.00 55.95 54.97 2brt s SER 322 Cb -0.09 0.71 0.04 0.00 0.10 0.00 0.00 66.02 66.77 2brt s SER 322 CO 0.10 -1.38 1.80 1.62 0.98 0.00 0.00 173.24 176.35 2brt h VAL 323 N 2.06 1.15 0.00 5.02 3.04 -2.01 -2.39 116.25 123.12 2brt h VAL 323 Ca -0.29 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 65.07 2brt h VAL 323 Cb 1.24 0.50 0.00 0.00 -2.01 0.00 0.00 31.29 31.02 2brt h VAL 323 CO 0.39 0.15 0.00 -0.62 -1.01 0.00 0.00 177.57 176.48 2brt n GLU 324 N -4.71 0.19 -3.01 4.17 -0.58 -1.26 -4.02 120.64 111.41 2brt n GLU 324 Ca 0.02 0.43 -0.08 0.00 -0.42 0.00 0.00 57.16 57.11 2brt n GLU 324 Cb 0.05 -1.87 -0.02 0.00 -0.57 0.00 0.00 31.44 29.03 2brt n GLU 324 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2brt s SER 325 N -4.23 -0.72 1.00 1.62 1.04 -1.15 -5.16 113.70 106.10 2brt s SER 325 Ca 0.04 -1.75 -0.15 0.00 0.48 0.00 0.00 55.95 54.58 2brt s SER 325 Cb 0.09 1.40 0.19 0.00 0.10 0.00 0.00 66.02 67.80 2brt s SER 325 CO 0.38 -0.12 1.17 -2.16 0.98 0.00 0.00 173.24 173.50 2brt s PRO 326 N 1.00 0.38 0.12 4.02 0.04 -0.91 -0.61 135.00 139.04 2brt s PRO 326 Ca 0.26 0.04 -0.35 0.00 0.04 0.00 0.00 61.00 60.99 2brt s PRO 326 Cb -0.02 -1.77 -0.15 0.00 0.04 0.00 0.00 34.50 32.60 2brt s PRO 326 CO -0.07 -2.66 1.49 0.00 0.04 0.00 0.00 177.00 175.79 2brt n ALA 327 N -4.04 0.40 0.59 8.56 0.00 -1.26 -4.83 120.51 119.92 2brt n ALA 327 Ca 0.10 0.47 0.12 0.00 0.00 0.00 0.00 53.44 54.13 2brt n ALA 327 Cb 0.59 -2.24 0.12 0.00 0.00 0.00 0.00 19.45 17.92 2brt n ALA 327 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2brt n LYS 328 N 3.12 0.28 -4.03 0.00 5.02 -1.26 -4.90 118.16 116.38 2brt n LYS 328 Ca 0.18 0.05 -0.18 0.00 -2.02 0.00 0.00 58.31 56.34 2brt n LYS 328 Cb 0.25 -1.64 -0.16 0.00 -0.02 0.00 0.00 35.03 33.45 2brt n LYS 328 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2brt s PHE 329 N -3.17 0.47 0.82 2.13 0.40 -1.26 -5.12 117.98 112.24 2brt s PHE 329 Ca 0.05 -0.08 -0.12 0.00 -0.60 0.00 0.00 56.93 56.19 2brt s PHE 329 Cb 0.14 -0.47 0.08 0.00 0.51 0.00 0.00 43.02 43.28 2brt s PHE 329 CO 0.75 -0.13 1.14 -1.25 0.70 0.00 0.00 175.22 176.43 2brt s PRO 330 N 0.84 1.91 0.20 0.24 0.04 -1.26 -4.34 135.00 132.62 2brt s PRO 330 Ca -0.09 0.28 -0.30 0.00 0.04 0.00 0.00 61.00 60.93 2brt s PRO 330 Cb -0.13 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 2brt s PRO 330 CO -0.01 -1.67 1.25 -2.14 0.04 0.00 0.00 177.00 174.47 2brt s PRO 331 N -5.41 4.44 -0.02 0.56 0.02 -1.26 -4.79 135.00 128.54 2brt s PRO 331 Ca 0.62 1.96 -0.05 0.00 0.02 0.00 0.00 61.00 63.55 2brt s PRO 331 Cb -0.12 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.19 2brt s PRO 331 CO 0.51 -0.16 0.10 1.03 -0.33 0.00 0.00 177.00 178.16 2brt s ARG 332 N -0.26 0.27 0.97 5.54 0.52 -0.04 -4.98 118.95 120.97 2brt s ARG 332 Ca 0.54 -0.12 -0.12 0.00 -0.52 0.00 0.00 55.73 55.51 2brt s ARG 332 Cb -0.34 0.12 0.17 0.00 0.52 0.00 0.00 34.95 35.41 2brt s ARG 332 CO 0.38 -0.05 1.09 0.95 0.02 0.00 0.00 175.30 177.68 2brt s THR 333 N -0.61 2.38 0.13 0.02 -4.23 -1.26 0.00 115.64 112.07 2brt s THR 333 Ca -0.07 0.12 -0.22 0.00 -1.18 0.00 0.00 61.69 60.34 2brt s THR 333 Cb -0.04 -2.49 -0.01 0.00 1.34 0.00 0.00 72.50 71.29 2brt s THR 333 CO 0.00 -0.16 1.66 0.15 -0.54 0.00 0.00 174.62 175.74 2brt h PHE 334 N -1.84 -0.42 -0.48 3.99 3.57 -1.67 0.31 116.94 120.40 2brt h PHE 334 Ca -0.52 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.01 2brt h PHE 334 Cb 1.30 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 40.22 2brt h PHE 334 CO 0.37 -0.23 0.31 0.00 -2.23 0.00 0.00 178.31 176.53 2brt h ALA 335 N 0.86 0.61 -0.89 2.41 0.00 -1.43 -1.80 119.26 119.03 2brt h ALA 335 Ca 0.10 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.06 2brt h ALA 335 Cb 0.34 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 2brt h ALA 335 CO -0.26 0.03 0.55 1.96 0.00 0.00 0.00 179.25 181.53 2brt h GLN 336 N 0.63 0.93 -0.52 0.00 4.20 -1.76 -1.72 115.11 116.87 2brt h GLN 336 Ca 0.18 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 2brt h GLN 336 Cb -0.04 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2brt h GLN 336 CO -0.06 0.62 0.28 1.25 -0.67 0.00 0.00 178.83 180.25 2brt h HIS 337 N 0.96 0.71 -0.83 2.96 2.76 -0.37 0.18 115.15 121.53 2brt h HIS 337 Ca 0.40 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.55 2brt h HIS 337 Cb 0.25 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 28.94 2brt h HIS 337 CO -0.03 0.53 0.52 0.82 -1.30 0.00 0.00 177.93 178.47 2brt h ILE 338 N 0.69 1.22 -0.33 6.26 2.04 -1.13 -2.08 117.51 124.18 2brt h ILE 338 Ca 0.18 -0.45 -0.16 0.00 1.00 0.00 0.00 64.86 65.43 2brt h ILE 338 Cb 0.06 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.17 2brt h ILE 338 CO -0.03 0.23 -0.43 -0.08 0.00 0.00 0.00 178.15 177.84 2brt h GLU 339 N 1.13 0.87 -0.93 2.37 4.57 -0.89 -1.77 114.58 119.93 2brt h GLU 339 Ca 0.30 -0.50 -0.01 0.00 -1.18 0.00 0.00 59.36 57.98 2brt h GLU 339 Cb -0.08 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.50 2brt h GLU 339 CO -0.06 1.14 0.56 1.25 -1.18 0.00 0.00 179.01 180.72 2brt h HIS 340 N 0.66 1.23 0.18 0.92 2.76 -0.66 0.17 115.15 120.42 2brt h HIS 340 Ca 0.04 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 2brt h HIS 340 Cb 1.03 -0.40 0.00 0.00 1.55 0.00 0.00 27.41 29.59 2brt h HIS 340 CO 0.07 0.82 -0.09 0.87 -1.30 0.00 0.00 177.93 178.30 2brt h LYS 341 N 1.29 -0.24 -0.30 5.26 1.57 -1.21 -1.52 116.57 121.42 2brt h LYS 341 Ca 0.34 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.19 2brt h LYS 341 Cb -0.06 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.23 2brt h LYS 341 CO -0.06 -0.05 -0.38 -0.07 -0.57 0.00 0.00 179.45 178.31 2brt h LEU 342 N -0.38 -1.25 -0.53 2.94 3.38 -1.00 -1.73 115.31 116.73 2brt h LEU 342 Ca -0.03 0.19 0.10 0.00 0.09 0.00 0.00 57.88 58.24 2brt h LEU 342 Cb 0.30 0.54 -0.11 0.00 0.09 0.00 0.00 40.66 41.48 2brt h LEU 342 CO 0.04 -0.37 -0.26 0.15 0.09 0.00 0.00 178.44 178.09 2brt h PHE 343 N -0.36 -0.67 -0.09 1.13 3.57 -0.64 0.75 116.94 120.62 2brt h PHE 343 Ca 0.13 0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.73 2brt h PHE 343 Cb 0.58 0.37 -0.06 0.00 2.79 0.00 0.00 35.95 39.63 2brt h PHE 343 CO -0.54 -0.33 -0.39 0.78 -2.23 0.00 0.00 178.31 175.60 2brt h GLY 344 N -0.13 -0.65 1.02 2.40 0.00 -1.00 -2.80 103.07 101.91 2brt h GLY 344 Ca 0.24 0.48 0.02 0.00 0.00 0.00 0.00 47.33 48.07 2brt h GLY 344 CO -0.61 -0.23 0.61 1.70 0.00 0.00 0.00 176.54 178.01 2brt h LYS 345 N -0.49 1.18 -5.90 4.80 3.64 -0.97 -3.35 116.57 115.49 2brt h LYS 345 Ca 0.07 -0.07 -0.51 0.00 -1.27 0.00 0.00 60.65 58.88 2brt h LYS 345 Cb 0.61 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2brt h LYS 345 CO -0.36 0.78 1.45 -1.21 -2.27 0.00 0.00 179.45 177.84 2brt s GLU 346 N -6.01 2.60 0.00 1.90 2.02 0.22 -4.02 118.70 115.41 2brt s GLU 346 Ca -0.12 1.15 0.00 0.00 0.02 0.00 0.00 54.97 56.02 2brt s GLU 346 Cb 0.18 -4.43 0.00 0.00 0.10 0.00 0.00 34.13 29.99 2brt s GLU 346 CO 0.81 -2.73 0.00 0.00 0.02 0.00 0.00 175.26 173.35 2brt n GLN 347 N 8.97 0.00 -3.51 1.61 0.00 -1.26 -4.85 117.38 118.34 2brt n GLN 347 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 57.00 56.86 2brt n GLN 347 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.68 2brt n GLN 347 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2brt s GLU 348 N 0.00 2.61 0.00 2.61 2.02 -1.26 -5.13 118.70 119.55 2brt s GLU 348 Ca 0.00 -1.81 0.00 0.00 0.02 0.00 0.00 54.97 53.18 2brt s GLU 348 Cb 0.00 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 30.23 2brt s GLU 348 CO 0.00 -1.22 0.00 -0.85 0.02 0.00 0.00 175.26 173.21