#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jan h LEU 6 N 0.00 0.00 0.08 9.51 4.07 -2.00 -1.07 115.31 125.90 2jan h LEU 6 Ca 0.00 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.72 2jan h LEU 6 Cb 0.00 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.76 2jan h LEU 6 CO 0.00 0.46 -0.99 0.44 -1.08 0.00 0.00 178.44 177.27 2jan h ASP 7 N 0.00 0.73 -0.02 -0.43 3.32 -2.03 -1.04 116.42 116.95 2jan h ASP 7 Ca -0.00 -0.82 0.03 0.00 0.02 0.00 0.00 57.03 56.26 2jan h ASP 7 Cb 0.93 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 40.20 2jan h ASP 7 CO 0.06 1.47 -0.40 -0.33 -1.72 0.00 0.00 179.24 178.32 2jan h GLU 8 N 0.08 -0.52 -0.53 3.56 4.39 -1.99 -1.24 114.58 118.33 2jan h GLU 8 Ca -0.15 0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.57 2jan h GLU 8 Cb 1.70 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 30.44 2jan h GLU 8 CO 0.19 -0.35 0.25 -0.07 -1.16 0.00 0.00 179.01 177.87 2jan h LEU 9 N -0.54 0.66 -0.01 1.33 3.38 -1.27 -2.54 115.31 116.32 2jan h LEU 9 Ca 0.05 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jan h LEU 9 Cb 0.63 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2jan h LEU 9 CO -0.32 0.57 0.00 -1.28 0.09 0.00 0.00 178.44 177.50 2jan h SER 10 N 0.74 0.01 0.31 -0.43 0.87 -0.59 0.10 113.55 114.56 2jan h SER 10 Ca 0.18 -0.18 -0.21 0.00 -1.23 0.00 0.00 61.79 60.36 2jan h SER 10 Cb 0.09 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2jan h SER 10 CO -0.02 0.19 -0.87 4.11 -0.53 0.00 0.00 176.83 179.70 2jan h TRP 11 N -0.16 0.58 0.00 2.24 5.08 -1.21 -2.83 115.95 119.65 2jan h TRP 11 Ca 0.00 -0.30 0.00 0.00 1.08 0.00 0.00 58.89 59.67 2jan h TRP 11 Cb 0.18 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 26.26 2jan h TRP 11 CO -0.02 1.10 0.00 0.00 -1.28 0.00 0.00 178.44 178.24 2jan h ARG 12 N 0.25 0.00 -1.22 0.12 3.08 -1.47 -3.46 114.38 111.67 2jan h ARG 12 Ca -0.06 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 2jan h ARG 12 Cb 1.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.54 2jan h ARG 12 CO 0.15 0.00 -0.02 0.41 -1.07 0.00 0.00 179.97 179.44 2jan n GLY 13 N -0.52 0.87 0.72 0.04 0.00 -0.87 -4.77 105.19 100.66 2jan n GLY 13 Ca -0.00 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.49 2jan n GLY 13 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jan n LEU 14 N -0.66 2.48 -4.42 0.99 4.77 -0.03 -4.82 117.00 115.31 2jan n LEU 14 Ca -0.00 -0.90 -0.44 0.00 -0.03 0.00 0.00 56.01 54.64 2jan n LEU 14 Cb 0.50 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 2jan n LEU 14 CO 0.02 0.43 0.64 -0.63 -1.33 0.00 0.00 177.39 176.52 2jan s ILE 15 N -2.05 4.62 0.01 -0.08 1.01 -1.26 -3.96 121.20 119.49 2jan s ILE 15 Ca 0.22 -0.86 -0.20 0.00 0.00 0.00 0.00 60.65 59.82 2jan s ILE 15 Cb 0.18 -4.62 -0.22 0.00 0.01 0.00 0.00 42.46 37.81 2jan s ILE 15 CO 0.38 -1.32 1.12 0.00 0.00 0.00 0.00 174.94 175.12 2jan h ALA 16 N 9.25 0.10 -2.16 9.38 0.00 -1.37 -3.48 119.26 130.98 2jan h ALA 16 Ca -0.21 -0.54 -0.04 0.00 0.00 0.00 0.00 54.91 54.11 2jan h ALA 16 Cb 1.07 0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.70 2jan h ALA 16 CO 1.13 0.33 0.22 -1.14 0.00 0.00 0.00 179.25 179.78 2jan s GLN 17 N -3.31 1.07 0.23 0.00 0.74 -1.21 -4.99 119.66 112.19 2jan s GLN 17 Ca -0.13 0.11 -0.19 0.00 0.05 0.00 0.00 55.36 55.20 2jan s GLN 17 Cb 0.04 0.50 0.02 0.00 1.10 0.00 0.00 33.01 34.67 2jan s GLN 17 CO 0.81 -0.36 0.59 -1.54 -0.55 0.00 0.00 175.29 174.24 2jan s SER 18 N -1.50 -0.27 0.87 6.67 1.04 -1.26 -0.15 113.70 119.10 2jan s SER 18 Ca -0.08 -0.54 -0.13 0.00 0.48 0.00 0.00 55.95 55.67 2jan s SER 18 Cb -0.00 0.63 0.13 0.00 0.10 0.00 0.00 66.02 66.88 2jan s SER 18 CO 0.05 -1.16 1.23 0.42 0.98 0.00 0.00 173.24 174.76 2jan s THR 19 N -3.90 2.01 -0.12 2.02 -4.23 -0.30 -4.92 115.64 106.21 2jan s THR 19 Ca 0.11 -0.01 -0.40 0.00 -1.18 0.00 0.00 61.69 60.20 2jan s THR 19 Cb -0.03 -3.00 -0.18 0.00 1.34 0.00 0.00 72.50 70.63 2jan s THR 19 CO 0.01 0.00 1.36 -0.67 -0.54 0.00 0.00 174.62 174.78 2jan n ASP 20 N -3.48 1.07 -0.05 3.99 -0.08 -1.26 -4.86 116.55 111.87 2jan n ASP 20 Ca 0.11 1.14 -0.13 0.00 -1.51 0.00 0.00 54.79 54.41 2jan n ASP 20 Cb 0.60 -1.02 0.00 0.00 2.34 0.00 0.00 41.12 43.04 2jan n ASP 20 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2jan h LEU 21 N 4.50 0.84 0.32 -2.67 3.38 -1.98 -2.90 115.31 116.79 2jan h LEU 21 Ca -0.48 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.04 2jan h LEU 21 Cb 1.37 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2jan h LEU 21 CO 0.80 1.21 -0.24 0.44 0.09 0.00 0.00 178.44 180.73 2jan h ASP 22 N 0.59 -0.63 -0.71 -0.43 3.32 -1.98 0.69 116.42 117.26 2jan h ASP 22 Ca 0.02 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.20 2jan h ASP 22 Cb 1.11 0.20 -0.07 0.00 0.22 0.00 0.00 39.33 40.80 2jan h ASP 22 CO 0.11 -0.37 0.37 0.74 -1.72 0.00 0.00 179.24 178.37 2jan h THR 23 N -0.57 0.89 -0.35 0.35 2.02 -1.96 0.22 112.91 113.52 2jan h THR 23 Ca -0.02 -0.22 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 2jan h THR 23 Cb 0.49 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2jan h THR 23 CO -0.01 0.12 -0.02 0.25 0.37 0.00 0.00 175.52 176.23 2jan h LEU 24 N 0.64 0.62 -0.20 2.58 5.85 -1.25 -2.19 115.31 121.36 2jan h LEU 24 Ca 0.34 -0.32 0.04 0.00 0.84 0.00 0.00 57.88 58.78 2jan h LEU 24 Cb 0.31 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2jan h LEU 24 CO -0.24 0.79 -0.07 0.00 -0.34 0.00 0.00 178.44 178.58 2jan h ALA 25 N 0.85 0.10 -0.52 1.25 0.00 0.98 -1.68 119.26 120.24 2jan h ALA 25 Ca 0.10 0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.18 2jan h ALA 25 Cb 0.49 0.19 -0.11 0.00 0.00 0.00 0.00 17.79 18.36 2jan h ALA 25 CO 0.02 -0.50 -0.26 0.00 0.00 0.00 0.00 179.25 178.51 2jan h ALA 26 N 1.15 0.07 0.00 0.00 0.00 -0.39 -0.29 119.26 119.80 2jan h ALA 26 Ca 0.10 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 2jan h ALA 26 Cb 0.19 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2jan h ALA 26 CO -0.23 -0.60 -0.25 1.49 0.00 0.00 0.00 179.25 179.66 2jan h GLU 27 N -0.14 0.00 -0.35 0.00 4.81 -1.14 -2.43 114.58 115.33 2jan h GLU 27 Ca 0.23 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.43 2jan h GLU 27 Cb 0.51 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 2jan h GLU 27 CO -0.60 0.25 0.11 0.00 -0.73 0.00 0.00 179.01 178.04 2jan h ALA 28 N 1.75 0.46 0.19 2.92 0.00 -0.11 -3.03 119.26 121.44 2jan h ALA 28 Ca -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2jan h ALA 28 Cb 0.44 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2jan h ALA 28 CO 0.03 0.10 -0.09 1.96 0.00 0.00 0.00 179.25 181.25 2jan h GLN 29 N 0.41 -0.25 -1.28 0.00 7.50 -1.29 -2.71 115.11 117.49 2jan h GLN 29 Ca 0.11 0.02 0.41 0.00 0.50 0.00 0.00 58.65 59.69 2jan h GLN 29 Cb 0.25 0.06 -0.10 0.00 0.05 0.00 0.00 27.48 27.74 2jan h GLN 29 CO -0.00 0.01 0.87 -2.13 -1.50 0.00 0.00 178.83 176.07 2jan n ARG 30 N -5.10 -0.02 0.00 1.46 0.63 -0.93 -4.82 116.66 107.88 2jan n ARG 30 Ca -0.09 0.97 0.00 0.00 -0.92 0.00 0.00 57.85 57.81 2jan n ARG 30 Cb 0.20 -2.01 0.00 0.00 0.45 0.00 0.00 32.46 31.10 2jan n ARG 30 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jan n GLY 31 N -1.53 0.90 3.39 5.14 0.00 -1.02 -5.07 105.19 107.00 2jan n GLY 31 Ca 0.34 -1.99 -0.53 0.00 0.00 0.00 0.00 46.02 43.85 2jan n GLY 31 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jan n PRO 32 N -0.47 0.76 -1.81 1.61 -0.04 -1.26 -4.61 135.00 129.18 2jan n PRO 32 Ca 0.00 0.20 -0.31 0.00 -0.04 0.00 0.00 63.50 63.35 2jan n PRO 32 Cb 0.00 -2.20 0.02 0.00 -0.04 0.00 0.00 33.50 31.28 2jan n PRO 32 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2jan s MET 33 N 6.28 3.39 -0.28 0.54 -1.94 -1.26 -4.87 119.30 121.15 2jan s MET 33 Ca 1.13 0.85 -0.09 0.00 -1.71 0.00 0.00 55.69 55.87 2jan s MET 33 Cb -1.03 -2.05 -0.02 0.00 2.01 0.00 0.00 34.83 33.74 2jan s MET 33 CO 0.53 -0.74 0.12 0.99 -0.01 0.00 0.00 175.02 175.91 2jan s THR 34 N -3.07 4.52 -0.09 2.05 2.01 -1.26 -1.15 115.64 118.65 2jan s THR 34 Ca 0.57 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 62.28 2jan s THR 34 Cb -0.12 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 2jan s THR 34 CO 0.52 0.18 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.86 2jan s VAL 35 N 1.62 3.55 0.15 3.82 1.01 -0.49 -1.45 120.40 128.62 2jan s VAL 35 Ca 0.05 -0.52 0.09 0.00 0.00 0.00 0.00 61.98 61.60 2jan s VAL 35 Cb -0.16 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 2jan s VAL 35 CO 0.05 0.57 -0.20 -0.72 0.00 0.00 0.00 175.10 174.81 2jan s TYR 36 N -0.46 1.88 -0.01 5.22 -0.85 0.20 -1.03 117.35 122.30 2jan s TYR 36 Ca 0.07 -0.44 -0.02 0.00 -0.52 0.00 0.00 57.07 56.15 2jan s TYR 36 Cb -0.12 -0.96 -0.00 0.00 0.38 0.00 0.00 41.96 41.26 2jan s TYR 36 CO 0.02 0.32 0.05 0.00 -1.52 0.00 0.00 175.55 174.42 2jan s ALA 37 N -1.78 -0.11 0.15 9.51 0.00 -0.67 0.36 121.76 129.22 2jan s ALA 37 Ca 0.14 -0.06 0.07 0.00 0.00 0.00 0.00 51.96 52.11 2jan s ALA 37 Cb -0.07 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 2jan s ALA 37 CO 0.06 -0.09 -0.00 0.20 0.00 0.00 0.00 175.76 175.93 2jan s GLY 38 N -0.53 1.77 -0.10 0.00 0.00 -1.26 -0.94 107.32 106.26 2jan s GLY 38 Ca -0.06 -1.31 -0.07 0.00 0.00 0.00 0.00 44.72 43.28 2jan s GLY 38 CO 0.00 -1.31 0.25 -1.36 0.00 0.00 0.00 173.10 170.68 2jan s PHE 39 N -1.61 -0.31 -0.34 1.90 0.08 -0.67 -4.93 117.98 112.11 2jan s PHE 39 Ca 0.27 0.74 0.16 0.00 0.12 0.00 0.00 56.93 58.22 2jan s PHE 39 Cb -0.10 0.08 0.46 0.00 -0.57 0.00 0.00 43.02 42.89 2jan s PHE 39 CO 0.18 -0.19 1.01 -0.25 -0.10 0.00 0.00 175.22 175.87 2jan n ASP 40 N 3.60 2.20 -4.69 1.36 9.92 -1.26 -1.24 116.55 126.44 2jan n ASP 40 Ca -0.19 -2.86 -0.33 0.00 -0.53 0.00 0.00 54.79 50.88 2jan n ASP 40 Cb 0.56 -0.50 0.13 0.00 -0.64 0.00 0.00 41.12 40.66 2jan n ASP 40 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2jan n PRO 41 N -0.22 0.15 0.00 -0.24 -0.04 -1.26 -4.97 135.00 128.41 2jan n PRO 41 Ca 0.16 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2jan n PRO 41 Cb 0.79 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 2jan n PRO 41 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2jan n THR 42 N -3.35 0.00 -1.24 0.52 -2.24 -1.26 -4.87 114.28 101.83 2jan n THR 42 Ca 0.14 0.74 -0.30 0.00 -2.27 0.00 0.00 64.05 62.35 2jan n THR 42 Cb 0.50 -1.51 0.24 0.00 -2.10 0.00 0.00 70.33 67.46 2jan n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jan s ALA 43 N -2.45 0.90 -0.58 6.98 0.00 -1.26 -4.91 121.76 120.43 2jan s ALA 43 Ca 0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 2jan s ALA 43 Cb 0.00 -2.84 0.17 0.00 0.00 0.00 0.00 23.12 20.46 2jan s ALA 43 CO 0.00 -3.44 2.48 -0.35 0.00 0.00 0.00 175.76 174.44 2jan n PRO 44 N -4.63 2.49 -3.59 0.00 -0.04 -1.26 -4.85 135.00 123.13 2jan n PRO 44 Ca 0.15 -2.71 -0.16 0.00 -0.04 0.00 0.00 63.50 60.73 2jan n PRO 44 Cb 0.60 -2.16 -0.07 0.00 -0.04 0.00 0.00 33.50 31.83 2jan n PRO 44 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2jan s SER 45 N -0.19 -0.68 0.60 3.54 0.15 -1.26 -4.58 113.70 111.29 2jan s SER 45 Ca 0.56 1.04 -0.15 0.00 0.70 0.00 0.00 55.95 58.10 2jan s SER 45 Cb 0.40 0.97 -0.03 0.00 -1.71 0.00 0.00 66.02 65.65 2jan s SER 45 CO -0.27 -0.42 1.05 -0.76 1.20 0.00 0.00 173.24 174.04 2jan s LEU 46 N -0.42 3.44 0.45 3.45 1.43 -1.26 -4.92 118.68 120.85 2jan s LEU 46 Ca -0.06 1.74 0.03 0.00 -1.03 0.00 0.00 54.13 54.81 2jan s LEU 46 Cb -0.03 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.65 2jan s LEU 46 CO 0.05 -1.13 0.08 -1.38 0.23 0.00 0.00 176.35 174.20 2jan s HIS 47 N -2.60 1.82 0.47 0.29 -3.43 -1.26 -1.15 115.29 109.43 2jan s HIS 47 Ca 0.62 -1.16 0.26 0.00 -0.80 0.00 0.00 55.06 53.98 2jan s HIS 47 Cb -0.15 -1.34 1.29 0.00 -1.43 0.00 0.00 32.58 30.96 2jan s HIS 47 CO 0.40 -0.09 1.82 0.00 -2.00 0.00 0.00 174.74 174.87 2jan h ALA 48 N 1.61 2.58 -0.39 -1.38 0.00 -1.63 -0.05 119.26 120.00 2jan h ALA 48 Ca -0.39 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.64 2jan h ALA 48 Cb 1.29 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 2jan h ALA 48 CO 0.64 -0.91 0.32 0.78 0.00 0.00 0.00 179.25 180.08 2jan h GLY 49 N 0.21 0.00 1.30 0.00 0.00 -1.87 -1.99 103.07 100.73 2jan h GLY 49 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 2jan h GLY 49 CO -0.14 0.00 -0.43 1.42 0.00 0.00 0.00 176.54 177.39 2jan n HIS 50 N -4.12 0.29 -0.18 5.60 -0.00 -0.03 -4.51 115.22 112.27 2jan n HIS 50 Ca 0.06 0.08 -0.01 0.00 -0.00 0.00 0.00 57.72 57.86 2jan n HIS 50 Cb 0.51 -0.50 0.07 0.00 -0.00 0.00 0.00 29.99 30.07 2jan n HIS 50 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2jan h LEU 51 N 0.00 -0.26 0.41 2.41 3.38 -1.47 -2.36 115.31 117.42 2jan h LEU 51 Ca 0.00 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2jan h LEU 51 Cb 0.61 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2jan h LEU 51 CO 0.00 -0.10 -0.20 0.58 0.09 0.00 0.00 178.44 178.82 2jan h VAL 52 N 0.11 0.55 -0.81 1.22 2.07 -1.80 0.54 116.25 118.12 2jan h VAL 52 Ca 0.28 -0.43 0.13 0.00 0.82 0.00 0.00 66.70 67.49 2jan h VAL 52 Cb 0.43 0.74 -0.09 0.00 -1.52 0.00 0.00 31.29 30.86 2jan h VAL 52 CO -0.47 0.07 0.42 -0.65 0.02 0.00 0.00 177.57 176.96 2jan h PRO 53 N -0.82 0.62 0.17 1.57 0.11 -1.86 0.30 132.00 132.09 2jan h PRO 53 Ca -0.06 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2jan h PRO 53 Cb 0.54 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.51 2jan h PRO 53 CO 0.09 0.41 -0.08 -0.07 -0.21 0.00 0.00 178.00 178.14 2jan h LEU 54 N 0.64 -0.19 -1.86 2.35 3.38 -1.11 0.18 115.31 118.70 2jan h LEU 54 Ca 0.42 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2jan h LEU 54 Cb 0.54 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2jan h LEU 54 CO -0.33 0.19 -0.02 -0.07 0.09 0.00 0.00 178.44 178.30 2jan h LEU 55 N -0.60 0.05 -0.32 1.67 3.38 0.14 -0.05 115.31 119.58 2jan h LEU 55 Ca -0.02 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2jan h LEU 55 Cb 0.45 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2jan h LEU 55 CO 0.04 0.08 -0.14 0.74 0.09 0.00 0.00 178.44 179.25 2jan h THR 56 N 0.06 1.29 -0.72 0.22 2.02 -0.03 -1.51 112.91 114.24 2jan h THR 56 Ca 0.01 -1.24 0.12 0.00 0.77 0.00 0.00 66.41 66.08 2jan h THR 56 Cb 0.08 1.42 -0.08 0.00 -1.74 0.00 0.00 68.15 67.82 2jan h THR 56 CO 0.00 0.40 0.30 -0.07 0.37 0.00 0.00 175.52 176.52 2jan h LEU 57 N 0.42 0.32 -1.09 2.58 3.38 0.24 -1.24 115.31 119.91 2jan h LEU 57 Ca 0.07 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.22 2jan h LEU 57 Cb 0.66 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.40 2jan h LEU 57 CO 0.04 0.15 0.61 -0.09 0.09 0.00 0.00 178.44 179.25 2jan h ARG 58 N 0.48 0.98 -0.64 1.13 2.43 -0.49 -1.48 114.38 116.78 2jan h ARG 58 Ca 0.38 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.46 2jan h ARG 58 Cb 0.51 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 2jan h ARG 58 CO -0.35 0.65 0.27 0.00 -1.51 0.00 0.00 179.97 179.03 2jan h ARG 59 N 1.01 0.95 -0.72 0.20 3.08 -0.22 -0.83 114.38 117.84 2jan h ARG 59 Ca 0.44 -0.16 0.04 0.00 0.07 0.00 0.00 59.98 60.36 2jan h ARG 59 Cb 0.34 -0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 2jan h ARG 59 CO -0.20 0.79 0.45 0.74 -1.07 0.00 0.00 179.97 180.68 2jan h PHE 60 N 0.90 0.84 -0.18 3.04 0.04 -0.79 0.15 116.94 120.94 2jan h PHE 60 Ca 0.22 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 61.00 2jan h PHE 60 Cb 0.18 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.05 2jan h PHE 60 CO 0.01 0.47 0.05 0.37 -0.60 0.00 0.00 178.31 178.61 2jan h GLN 61 N 0.87 0.28 -0.03 1.51 4.15 -1.04 -0.41 115.11 120.44 2jan h GLN 61 Ca 0.30 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.65 2jan h GLN 61 Cb 0.04 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 2jan h GLN 61 CO -0.12 0.40 0.01 -0.09 -1.93 0.00 0.00 178.83 177.10 2jan h ARG 62 N 0.11 0.03 -0.10 1.69 2.43 -0.76 0.81 114.38 118.60 2jan h ARG 62 Ca 0.06 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2jan h ARG 62 Cb 0.24 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2jan h ARG 62 CO -0.00 0.02 0.00 0.00 -1.51 0.00 0.00 179.97 178.48 2jan n ALA 63 N -2.54 2.54 0.00 2.80 0.00 0.49 -4.91 120.51 118.90 2jan n ALA 63 Ca -0.03 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2jan n ALA 63 Cb 0.09 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.41 2jan n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jan n GLY 64 N 0.88 0.38 4.00 0.00 0.00 0.28 -5.00 105.19 105.73 2jan n GLY 64 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 2jan n GLY 64 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jan s HIS 65 N -2.00 2.66 -0.32 1.61 3.76 -0.22 -4.64 115.29 116.14 2jan s HIS 65 Ca 0.00 -0.26 -0.09 0.00 -0.15 0.00 0.00 55.06 54.56 2jan s HIS 65 Cb 0.00 -2.55 0.01 0.00 1.11 0.00 0.00 32.58 31.15 2jan s HIS 65 CO 0.00 -0.73 0.14 0.50 -0.85 0.00 0.00 174.74 173.80 2jan s ARG 66 N -4.58 3.09 0.31 1.40 3.52 -0.30 -3.82 118.95 118.56 2jan s ARG 66 Ca 0.57 -0.88 -0.22 0.00 -0.13 0.00 0.00 55.73 55.07 2jan s ARG 66 Cb -0.10 -3.53 -0.09 0.00 -1.56 0.00 0.00 34.95 29.67 2jan s ARG 66 CO 0.36 -0.51 0.85 -1.25 -0.81 0.00 0.00 175.30 173.95 2jan s PRO 67 N 1.55 4.35 -0.10 5.12 0.04 -1.26 -1.39 135.00 143.31 2jan s PRO 67 Ca 0.03 1.07 0.02 0.00 0.04 0.00 0.00 61.00 62.16 2jan s PRO 67 Cb -0.18 -2.69 0.01 0.00 0.04 0.00 0.00 34.50 31.69 2jan s PRO 67 CO 0.05 0.26 -0.15 0.42 0.04 0.00 0.00 177.00 177.61 2jan s ILE 68 N -1.72 1.44 -0.36 0.56 1.01 -0.19 -2.45 121.20 119.49 2jan s ILE 68 Ca 0.50 -0.62 -0.15 0.00 0.00 0.00 0.00 60.65 60.38 2jan s ILE 68 Cb -0.15 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.00 2jan s ILE 68 CO 0.20 0.43 0.36 -0.69 0.00 0.00 0.00 174.94 175.24 2jan s VAL 69 N 0.89 5.17 -0.42 2.92 1.01 -0.75 -1.67 120.40 127.56 2jan s VAL 69 Ca -0.09 -0.08 -0.17 0.00 0.00 0.00 0.00 61.98 61.64 2jan s VAL 69 Cb -0.15 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.40 2jan s VAL 69 CO 0.00 -0.15 0.41 -0.22 0.00 0.00 0.00 175.10 175.14 2jan s LEU 70 N 1.99 4.93 -0.18 3.92 2.96 -0.12 -2.11 118.68 130.07 2jan s LEU 70 Ca 0.11 -0.74 -0.29 0.00 -0.22 0.00 0.00 54.13 52.99 2jan s LEU 70 Cb -0.17 -2.34 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 2jan s LEU 70 CO 0.12 -0.56 1.20 0.00 -1.32 0.00 0.00 176.35 175.79 2jan s ALA 71 N 2.03 3.66 -1.47 5.97 0.00 0.64 -1.67 121.76 130.92 2jan s ALA 71 Ca 0.10 0.39 -0.10 0.00 0.00 0.00 0.00 51.96 52.35 2jan s ALA 71 Cb -0.18 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.37 2jan s ALA 71 CO 0.13 -1.13 2.49 0.41 0.00 0.00 0.00 175.76 177.66 2jan n GLY 72 N 3.53 4.56 0.32 0.00 0.00 -0.37 -1.19 105.19 112.04 2jan n GLY 72 Ca 0.13 -1.72 0.05 0.00 0.00 0.00 0.00 46.02 44.48 2jan n GLY 72 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jan h GLY 73 N 7.66 0.67 0.51 -0.02 0.00 -1.92 -3.09 103.07 106.88 2jan h GLY 73 Ca 0.69 -0.24 0.09 0.00 0.00 0.00 0.00 47.33 47.87 2jan h GLY 73 CO 1.73 0.22 0.42 0.00 0.00 0.00 0.00 176.54 178.92 2jan h ALA 74 N 1.70 1.10 -0.34 3.60 0.00 -1.86 -2.80 119.26 120.65 2jan h ALA 74 Ca 0.20 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2jan h ALA 74 Cb 0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2jan h ALA 74 CO -0.05 0.04 0.16 1.15 0.00 0.00 0.00 179.25 180.55 2jan h THR 75 N 0.72 1.16 -0.64 0.00 2.02 -1.96 -1.75 112.91 112.45 2jan h THR 75 Ca 0.38 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 67.01 2jan h THR 75 Cb 0.36 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 2jan h THR 75 CO -0.25 0.17 0.14 1.23 0.37 0.00 0.00 175.52 177.18 2jan h GLY 76 N 0.41 1.11 2.00 2.16 0.00 -1.70 0.01 103.07 107.06 2jan h GLY 76 Ca 0.12 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 2jan h GLY 76 CO -0.01 0.65 -0.16 1.98 0.00 0.00 0.00 176.54 179.00 2jan h MET 77 N 0.98 0.00 0.00 4.80 -1.53 -1.22 -2.65 114.93 115.31 2jan h MET 77 Ca 0.20 0.00 -0.20 0.00 -3.44 0.00 0.00 59.70 56.26 2jan h MET 77 Cb 0.38 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.39 2jan h MET 77 CO 0.00 0.16 -1.40 0.82 0.14 0.00 0.00 176.91 176.64 2jan h ILE 78 N 0.00 0.72 0.00 1.77 2.04 -0.88 -3.41 117.51 117.75 2jan h ILE 78 Ca -0.00 -2.33 -0.13 0.00 1.00 0.00 0.00 64.86 63.40 2jan h ILE 78 Cb 0.39 2.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 2jan h ILE 78 CO 0.02 0.41 -0.63 1.23 0.00 0.00 0.00 178.15 179.19 2jan h GLY 79 N 3.58 0.00 -5.63 5.37 0.00 -0.62 -3.43 103.07 102.34 2jan h GLY 79 Ca -0.18 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.58 2jan h GLY 79 CO 0.06 0.00 0.87 0.51 0.00 0.00 0.00 176.54 177.98 2jan s ASP 80 N -6.82 6.90 0.01 0.19 -4.77 -1.24 -4.92 116.67 106.02 2jan s ASP 80 Ca -0.01 1.15 0.11 0.00 -3.30 0.00 0.00 52.55 50.50 2jan s ASP 80 Cb 0.12 -2.54 0.48 0.00 -1.09 0.00 0.00 42.92 39.89 2jan s ASP 80 CO 0.76 -0.89 1.36 -2.65 0.70 0.00 0.00 175.17 174.45 2jan n PRO 81 N 6.89 0.00 -0.99 2.11 -0.02 -1.26 -4.82 135.00 136.91 2jan n PRO 81 Ca 0.13 0.32 -0.35 0.00 -2.02 0.00 0.00 63.50 61.57 2jan n PRO 81 Cb 0.47 -1.51 0.08 0.00 -0.02 0.00 0.00 33.50 32.51 2jan n PRO 81 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2jan n ARG 82 N -1.52 -0.05 -4.45 -0.52 1.74 -1.26 -5.00 116.66 105.60 2jan n ARG 82 Ca 0.03 0.01 -0.23 0.00 -0.77 0.00 0.00 57.85 56.89 2jan n ARG 82 Cb 0.13 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 29.95 2jan n ARG 82 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2jan s ASP 83 N -1.50 3.16 0.63 0.55 1.47 -1.26 -4.76 116.67 114.95 2jan s ASP 83 Ca 0.53 -1.13 0.33 0.00 1.18 0.00 0.00 52.55 53.47 2jan s ASP 83 Cb -0.25 -0.24 1.86 0.00 -0.34 0.00 0.00 42.92 43.95 2jan s ASP 83 CO 0.70 -0.19 2.13 0.58 0.68 0.00 0.00 175.17 179.07 2jan h VAL 84 N 2.26 0.23 -0.98 2.11 2.07 -1.96 0.28 116.25 120.26 2jan h VAL 84 Ca -0.40 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.40 2jan h VAL 84 Cb 1.24 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 2jan h VAL 84 CO 0.65 0.00 1.11 1.23 0.02 0.00 0.00 177.57 180.59 2jan h GLY 85 N 0.00 0.00 0.00 2.17 0.00 -2.02 -3.20 103.07 100.01 2jan h GLY 85 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2jan h GLY 85 CO -0.00 0.00 0.00 -2.21 0.00 0.00 0.00 176.54 174.33 2jan n GLU 86 N -3.34 0.00 0.25 4.80 2.13 -0.01 -4.80 120.64 119.67 2jan n GLU 86 Ca 0.22 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.88 2jan n GLU 86 Cb 1.42 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 33.04 2jan n GLU 86 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2jan h ARG 87 N 0.00 -0.84 0.09 5.31 2.43 -0.65 -3.40 114.38 117.32 2jan h ARG 87 Ca 0.00 0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.24 2jan h ARG 87 Cb 0.00 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 2jan h ARG 87 CO 0.00 -0.56 -0.48 0.66 -1.51 0.00 0.00 179.97 178.08 2jan h SER 88 N -0.87 -1.46 0.00 -3.80 4.64 -1.78 -2.91 113.55 107.37 2jan h SER 88 Ca -0.05 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2jan h SER 88 Cb 0.76 0.54 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2jan h SER 88 CO -0.06 -0.50 0.40 -0.11 -0.87 0.00 0.00 176.83 175.69 2jan n LEU 89 N -5.19 0.12 0.00 5.97 0.00 -1.26 -1.45 117.00 115.19 2jan n LEU 89 Ca -0.08 0.33 0.00 0.00 0.00 0.00 0.00 56.01 56.26 2jan n LEU 89 Cb 0.37 -0.25 0.00 0.00 0.00 0.00 0.00 43.42 43.54 2jan n LEU 89 CO 0.14 -0.37 -0.05 -3.20 0.00 0.00 0.00 177.39 173.91 2jan n ASN 90 N -1.60 0.53 -0.03 1.96 4.05 -1.18 -4.93 115.26 114.05 2jan n ASN 90 Ca -0.00 0.00 -0.09 0.00 0.45 0.00 0.00 54.58 54.94 2jan n ASN 90 Cb 0.41 0.09 -0.03 0.00 1.23 0.00 0.00 39.78 41.48 2jan n ASN 90 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 177.26 173.88 2jan h GLU 91 N 0.00 -0.02 0.00 1.20 4.39 -1.05 -1.40 114.58 117.71 2jan h GLU 91 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 2jan h GLU 91 Cb 0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2jan h GLU 91 CO 0.00 -0.01 -0.89 0.00 -1.16 0.00 0.00 179.01 176.95 2jan h ALA 92 N 1.17 0.65 0.16 3.43 0.00 -1.90 -2.86 119.26 119.90 2jan h ALA 92 Ca 0.09 -0.33 -0.24 0.00 0.00 0.00 0.00 54.91 54.43 2jan h ALA 92 Cb 0.16 0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.05 2jan h ALA 92 CO -0.20 0.38 -1.04 0.22 0.00 0.00 0.00 179.25 178.61 2jan h ASP 93 N 0.00 0.65 0.57 0.00 3.58 -1.84 -2.72 116.42 116.66 2jan h ASP 93 Ca -0.05 -0.90 -0.06 0.00 0.42 0.00 0.00 57.03 56.43 2jan h ASP 93 Cb 1.24 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 42.07 2jan h ASP 93 CO 0.02 1.50 -0.30 0.71 -2.88 0.00 0.00 179.24 178.29 2jan h THR 94 N -0.10 0.91 -0.41 2.25 1.35 -1.31 -1.15 112.91 114.45 2jan h THR 94 Ca -0.17 -1.17 -0.13 0.00 -0.55 0.00 0.00 66.41 64.39 2jan h THR 94 Cb 1.80 1.69 -0.01 0.00 -1.73 0.00 0.00 68.15 69.90 2jan h THR 94 CO 0.20 0.30 -0.27 0.58 -0.25 0.00 0.00 175.52 176.08 2jan h VAL 95 N 0.00 1.28 0.00 6.82 2.07 -1.55 -0.94 116.25 123.92 2jan h VAL 95 Ca -0.00 -1.43 -0.07 0.00 0.82 0.00 0.00 66.70 66.02 2jan h VAL 95 Cb 0.67 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2jan h VAL 95 CO 0.04 0.48 -0.32 0.00 0.02 0.00 0.00 177.57 177.79 2jan h ALA 96 N 0.81 1.07 -0.06 1.67 0.00 -1.20 -2.54 119.26 119.00 2jan h ALA 96 Ca 0.08 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 2jan h ALA 96 Cb 0.84 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2jan h ALA 96 CO 0.07 0.40 -0.28 1.49 0.00 0.00 0.00 179.25 180.94 2jan h GLU 97 N 0.00 0.29 -0.97 0.00 4.81 -1.05 -3.14 114.58 114.53 2jan h GLU 97 Ca -0.00 -0.24 0.14 0.00 -0.13 0.00 0.00 59.36 59.13 2jan h GLU 97 Cb 0.79 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.13 2jan h GLU 97 CO 0.04 0.88 0.61 2.35 -0.73 0.00 0.00 179.01 182.17 2jan h TRP 98 N -0.23 1.03 -0.12 0.92 7.01 -1.09 -2.51 115.95 120.97 2jan h TRP 98 Ca -0.02 0.03 -0.18 0.00 2.11 0.00 0.00 58.89 60.83 2jan h TRP 98 Cb 0.94 -0.32 -0.00 0.00 -2.10 0.00 0.00 29.16 27.67 2jan h TRP 98 CO 0.13 0.37 -0.68 1.15 -2.79 0.00 0.00 178.44 176.62 2jan h THR 99 N 0.87 1.34 -0.05 2.65 2.02 -1.51 -2.93 112.91 115.29 2jan h THR 99 Ca 0.50 -2.01 -0.09 0.00 0.77 0.00 0.00 66.41 65.58 2jan h THR 99 Cb 0.63 1.99 0.00 0.00 -1.74 0.00 0.00 68.15 69.03 2jan h THR 99 CO -0.27 0.61 -0.32 -0.08 0.37 0.00 0.00 175.52 175.84 2jan h GLU 100 N 0.36 0.31 -0.62 6.66 4.57 -1.42 0.20 114.58 124.65 2jan h GLU 100 Ca -0.02 -0.27 0.12 0.00 -1.18 0.00 0.00 59.36 58.01 2jan h GLU 100 Cb 1.26 0.06 -0.12 0.00 -0.16 0.00 0.00 28.75 29.79 2jan h GLU 100 CO 0.12 0.92 -0.19 0.00 -1.18 0.00 0.00 179.01 178.68 2jan h ARG 101 N -0.21 -0.04 -0.58 1.92 3.08 -1.57 0.23 114.38 117.21 2jan h ARG 101 Ca -0.03 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 2jan h ARG 101 Cb 0.99 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.03 2jan h ARG 101 CO 0.07 -0.03 -0.05 0.82 -1.07 0.00 0.00 179.97 179.71 2jan h ILE 102 N -0.04 1.27 0.00 2.04 2.04 -1.44 -2.72 117.51 118.66 2jan h ILE 102 Ca 0.29 -1.21 -0.02 0.00 1.00 0.00 0.00 64.86 64.91 2jan h ILE 102 Cb 0.48 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2jan h ILE 102 CO -0.65 0.44 -0.12 -0.09 0.00 0.00 0.00 178.15 177.73 2jan h ARG 103 N 0.95 0.00 -0.26 2.37 2.43 0.15 0.55 114.38 120.57 2jan h ARG 103 Ca 0.16 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2jan h ARG 103 Cb 0.62 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 2jan h ARG 103 CO 0.04 0.12 -0.07 0.78 -1.51 0.00 0.00 179.97 179.32 2jan h GLY 104 N 0.39 0.55 1.00 2.80 0.00 -0.25 -2.83 103.07 104.74 2jan h GLY 104 Ca -0.00 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 2jan h GLY 104 CO 0.02 0.42 0.15 1.46 0.00 0.00 0.00 176.54 178.59 2jan h GLN 105 N 0.26 0.89 -0.34 4.80 4.20 -1.32 -3.07 115.11 120.53 2jan h GLN 105 Ca 0.06 -0.21 0.09 0.00 0.06 0.00 0.00 58.65 58.66 2jan h GLN 105 Cb 0.55 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2jan h GLN 105 CO 0.03 0.83 0.24 -0.07 -0.67 0.00 0.00 178.83 179.19 2jan h LEU 106 N 0.80 0.04 -2.25 1.46 3.38 -0.80 -1.40 115.31 116.53 2jan h LEU 106 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2jan h LEU 106 Cb 0.33 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2jan h LEU 106 CO -0.00 0.02 0.00 -0.33 0.09 0.00 0.00 178.44 178.22 2jan h GLU 107 N 0.04 0.00 -0.08 1.13 5.08 -1.39 -1.59 114.58 117.76 2jan h GLU 107 Ca 0.16 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.35 2jan h GLU 107 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2jan h GLU 107 CO -0.01 0.00 -0.69 0.00 -1.00 0.00 0.00 179.01 177.31 2jan h ARG 108 N 0.00 0.37 0.00 2.33 2.47 -1.41 -3.36 114.38 114.79 2jan h ARG 108 Ca 0.00 -0.29 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 2jan h ARG 108 Cb 0.19 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 2jan h ARG 108 CO 0.00 0.93 -1.52 1.19 0.56 0.00 0.00 179.97 181.12 2jan n PHE 109 N -3.85 0.22 -3.67 3.04 3.01 -0.63 -4.95 117.46 110.64 2jan n PHE 109 Ca -0.04 0.06 -0.11 0.00 1.01 0.00 0.00 57.45 58.38 2jan n PHE 109 Cb 0.68 -0.51 -0.08 0.00 -0.01 0.00 0.00 39.48 39.56 2jan n PHE 109 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2jan s VAL 110 N -3.37 -0.01 -0.30 -4.37 1.01 -1.00 -4.38 120.40 107.98 2jan s VAL 110 Ca -0.03 0.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.74 2jan s VAL 110 Cb 0.14 -0.84 -0.00 0.00 0.00 0.00 0.00 36.38 35.67 2jan s VAL 110 CO 0.86 0.01 0.78 -1.81 0.00 0.00 0.00 175.10 174.94 2jan s ASP 111 N 1.02 6.66 -0.23 3.32 1.01 -1.26 -4.40 116.67 122.79 2jan s ASP 111 Ca -0.06 0.66 -0.19 0.00 0.71 0.00 0.00 52.55 53.68 2jan s ASP 111 Cb -0.05 -2.40 -0.03 0.00 1.01 0.00 0.00 42.92 41.44 2jan s ASP 111 CO -0.09 -0.60 0.53 -0.36 0.21 0.00 0.00 175.17 174.86 2jan s PHE 112 N 2.93 3.32 -0.16 4.23 0.08 -1.26 -2.54 117.98 124.59 2jan s PHE 112 Ca 0.32 0.73 -0.30 0.00 0.12 0.00 0.00 56.93 57.80 2jan s PHE 112 Cb -0.14 -2.71 0.13 0.00 -0.57 0.00 0.00 43.02 39.73 2jan s PHE 112 CO 0.12 -0.19 1.03 0.16 -0.10 0.00 0.00 175.22 176.24 2jan s ASP 113 N 1.33 -0.33 0.00 1.36 1.47 -1.26 -4.94 116.67 114.30 2jan s ASP 113 Ca 0.23 0.32 -0.30 0.00 1.18 0.00 0.00 52.55 53.98 2jan s ASP 113 Cb -0.15 0.28 -0.06 0.00 -0.34 0.00 0.00 42.92 42.64 2jan s ASP 113 CO 0.09 -0.33 1.48 -1.81 0.68 0.00 0.00 175.17 175.29 2jan s ASP 114 N -1.25 6.78 0.00 2.11 1.11 -1.26 -4.04 116.67 120.11 2jan s ASP 114 Ca 0.00 2.19 0.00 0.00 0.18 0.00 0.00 52.55 54.93 2jan s ASP 114 Cb -0.01 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 2jan s ASP 114 CO -0.00 -0.78 0.00 -0.24 1.18 0.00 0.00 175.17 175.32 2jan n SER 115 N 5.70 0.00 0.02 0.27 2.88 -1.26 -4.97 113.62 116.27 2jan n SER 115 Ca 0.14 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.63 2jan n SER 115 Cb 0.43 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.04 2jan n SER 115 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2jan h PRO 116 N 0.00 0.46 -0.28 -1.46 0.13 -2.01 -2.79 132.00 126.05 2jan h PRO 116 Ca 0.00 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2jan h PRO 116 Cb 0.00 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2jan h PRO 116 CO 0.00 0.78 0.00 -1.33 -0.23 0.00 0.00 178.00 177.22 2jan n MET 117 N -4.03 1.81 -1.99 0.86 2.81 -1.26 -4.71 117.12 110.60 2jan n MET 117 Ca -0.01 -1.24 -0.42 0.00 -1.81 0.00 0.00 57.70 54.22 2jan n MET 117 Cb 0.50 -1.34 -0.03 0.00 -0.71 0.00 0.00 33.22 31.64 2jan n MET 117 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2jan s GLY 118 N -1.25 1.64 0.71 3.03 0.00 -1.06 -4.52 107.32 105.86 2jan s GLY 118 Ca 0.28 1.21 -0.16 0.00 0.00 0.00 0.00 44.72 46.05 2jan s GLY 118 CO 0.21 2.71 1.22 0.00 0.00 0.00 0.00 173.10 177.25 2jan s ALA 119 N 2.03 2.18 -0.02 3.20 0.00 -1.05 -4.75 121.76 123.34 2jan s ALA 119 Ca 0.71 0.94 0.04 0.00 0.00 0.00 0.00 51.96 53.65 2jan s ALA 119 Cb -0.40 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.24 2jan s ALA 119 CO 0.31 -1.80 -0.14 0.42 0.00 0.00 0.00 175.76 174.55 2jan s ILE 120 N -1.87 1.14 -0.29 0.00 1.01 -1.03 -4.65 121.20 115.52 2jan s ILE 120 Ca 0.76 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 60.81 2jan s ILE 120 Cb -0.30 -0.97 0.05 0.00 0.01 0.00 0.00 42.46 41.24 2jan s ILE 120 CO 0.44 0.33 -0.02 -0.69 0.00 0.00 0.00 174.94 175.00 2jan s VAL 121 N -0.09 2.92 0.25 2.92 1.01 -1.26 -1.80 120.40 124.33 2jan s VAL 121 Ca 0.01 -1.32 0.08 0.00 0.00 0.00 0.00 61.98 60.75 2jan s VAL 121 Cb -0.08 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2jan s VAL 121 CO 0.00 -0.04 0.06 -1.61 0.00 0.00 0.00 175.10 173.52 2jan s GLU 122 N 1.26 2.51 -0.16 2.72 2.02 -0.90 -5.00 118.70 121.15 2jan s GLU 122 Ca -0.04 -1.25 -0.02 0.00 0.02 0.00 0.00 54.97 53.68 2jan s GLU 122 Cb -0.19 -2.32 -0.01 0.00 0.10 0.00 0.00 34.13 31.70 2jan s GLU 122 CO -0.02 0.39 -0.10 1.21 0.02 0.00 0.00 175.26 176.77 2jan s ASN 123 N -3.60 4.18 0.00 -0.19 3.84 -1.26 -0.26 114.94 117.65 2jan s ASN 123 Ca 0.31 -0.32 0.09 0.00 0.21 0.00 0.00 52.86 53.15 2jan s ASN 123 Cb -0.07 -1.67 0.54 0.00 -0.55 0.00 0.00 41.25 39.50 2jan s ASN 123 CO 0.21 0.11 1.00 -0.46 -2.79 0.00 0.00 177.10 175.18 2jan n ASN 124 N 3.88 0.00 0.26 -4.21 6.94 -0.34 -1.16 115.26 120.63 2jan n ASN 124 Ca -0.18 -0.26 0.14 0.00 -0.02 0.00 0.00 54.58 54.26 2jan n ASN 124 Cb 0.52 -0.01 0.63 0.00 -2.36 0.00 0.00 39.78 38.56 2jan n ASN 124 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 2jan h LEU 125 N 0.00 0.00 0.00 -4.53 3.38 -1.93 -2.13 115.31 110.10 2jan h LEU 125 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jan h LEU 125 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jan h LEU 125 CO 0.00 0.10 0.00 -0.62 0.09 0.00 0.00 178.44 178.01 2jan n GLU 126 N -3.27 0.02 0.00 1.13 1.02 -0.31 -1.72 120.64 117.50 2jan n GLU 126 Ca -0.00 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2jan n GLU 126 Cb 0.33 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 2jan n GLU 126 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 2jan n TRP 127 N -1.43 0.00 0.11 -0.32 2.14 -1.15 -4.85 117.44 111.94 2jan n TRP 127 Ca 0.01 0.00 -0.03 0.00 2.07 0.00 0.00 57.50 59.55 2jan n TRP 127 Cb 0.04 0.00 0.04 0.00 -0.81 0.00 0.00 31.31 30.58 2jan n TRP 127 CO 0.00 0.00 0.00 1.15 2.07 0.00 0.00 177.69 180.91 2jan h THR 128 N 0.00 1.48 -0.93 -1.67 2.02 -1.41 -2.68 112.91 109.71 2jan h THR 128 Ca 0.00 -2.66 0.06 0.00 0.77 0.00 0.00 66.41 64.58 2jan h THR 128 Cb 0.63 2.46 -0.06 0.00 -1.74 0.00 0.00 68.15 69.44 2jan h THR 128 CO 0.00 0.74 0.61 1.23 0.37 0.00 0.00 175.52 178.47 2jan h GLY 129 N 2.50 1.37 -1.21 2.16 0.00 -1.55 -2.64 103.07 103.71 2jan h GLY 129 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2jan h GLY 129 CO 0.10 0.33 -0.32 -1.14 0.00 0.00 0.00 176.54 175.51 2jan n SER 130 N -4.48 2.23 -4.71 0.19 3.41 -1.22 -4.95 113.62 104.09 2jan n SER 130 Ca 0.14 -1.62 -0.42 0.00 -0.26 0.00 0.00 58.87 56.71 2jan n SER 130 Cb 0.18 0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 2jan n SER 130 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2jan s LEU 131 N -2.24 4.37 0.17 1.04 2.96 -1.00 -5.02 118.68 118.97 2jan s LEU 131 Ca 0.20 2.55 -0.07 0.00 -0.22 0.00 0.00 54.13 56.59 2jan s LEU 131 Cb 0.18 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.22 2jan s LEU 131 CO 0.46 -0.84 0.44 -0.94 -1.32 0.00 0.00 176.35 174.14 2jan s SER 132 N 1.67 6.54 0.30 3.68 1.04 -1.26 -4.93 113.70 120.74 2jan s SER 132 Ca 0.71 0.71 0.05 0.00 0.48 0.00 0.00 55.95 57.90 2jan s SER 132 Cb -0.42 -2.14 0.80 0.00 0.10 0.00 0.00 66.02 64.37 2jan s SER 132 CO 0.32 0.01 1.64 0.00 0.98 0.00 0.00 173.24 176.19 2jan h ALA 133 N 2.75 1.41 0.14 5.32 0.00 -1.99 0.25 119.26 127.15 2jan h ALA 133 Ca -0.46 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2jan h ALA 133 Cb 1.17 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2jan h ALA 133 CO 0.71 -0.51 -0.07 0.82 0.00 0.00 0.00 179.25 180.20 2jan h ILE 134 N 0.20 1.00 -0.40 0.00 2.04 -1.99 -1.51 117.51 116.84 2jan h ILE 134 Ca 0.60 -0.64 0.08 0.00 1.00 0.00 0.00 64.86 65.90 2jan h ILE 134 Cb 1.26 1.39 -0.08 0.00 -0.74 0.00 0.00 36.82 38.65 2jan h ILE 134 CO -0.68 0.15 -0.16 -0.33 0.00 0.00 0.00 178.15 177.14 2jan h GLU 135 N -0.50 -0.07 0.03 2.37 5.08 -1.61 0.37 114.58 120.26 2jan h GLU 135 Ca -0.02 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2jan h GLU 135 Cb 0.39 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 2jan h GLU 135 CO 0.03 -0.05 -0.51 0.35 -1.00 0.00 0.00 179.01 177.84 2jan h PHE 136 N -0.07 -1.49 -0.35 4.33 3.57 -0.49 0.45 116.94 122.89 2jan h PHE 136 Ca 0.20 0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.65 2jan h PHE 136 Cb 0.38 0.64 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 2jan h PHE 136 CO -0.40 -0.55 -0.16 -0.07 -2.23 0.00 0.00 178.31 174.89 2jan h LEU 137 N -0.66 0.63 0.25 0.59 3.38 -1.07 0.47 115.31 118.90 2jan h LEU 137 Ca 0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2jan h LEU 137 Cb 0.70 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2jan h LEU 137 CO -0.32 0.81 -0.12 -0.09 0.09 0.00 0.00 178.44 178.81 2jan h ARG 138 N 0.57 -0.32 0.12 1.13 2.43 -0.68 -3.00 114.38 114.63 2jan h ARG 138 Ca 0.09 0.02 -0.29 0.00 -0.81 0.00 0.00 59.98 59.00 2jan h ARG 138 Cb 0.61 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2jan h ARG 138 CO 0.04 -0.08 -1.39 -0.44 -1.51 0.00 0.00 179.97 176.59 2jan h ASP 139 N -1.03 0.39 0.00 -3.80 3.32 -0.19 -3.37 116.42 111.74 2jan h ASP 139 Ca -0.03 -0.48 -0.33 0.00 0.02 0.00 0.00 57.03 56.22 2jan h ASP 139 Cb 0.38 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.76 2jan h ASP 139 CO 0.06 1.38 -2.12 -0.38 -1.72 0.00 0.00 179.24 176.46 2jan n ILE 140 N -3.48 1.11 0.26 0.35 5.41 -0.69 -4.71 119.36 117.61 2jan n ILE 140 Ca -0.12 -0.33 0.09 0.00 1.00 0.00 0.00 62.75 63.39 2jan n ILE 140 Cb 1.03 -1.58 0.66 0.00 -0.71 0.00 0.00 39.64 39.04 2jan n ILE 140 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2jan h GLY 141 N -0.01 0.00 2.00 7.39 0.00 -0.88 -2.50 103.07 109.06 2jan h GLY 141 Ca -0.49 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 2jan h GLY 141 CO -0.23 0.00 -0.09 0.50 0.00 0.00 0.00 176.54 176.72 2jan h LYS 142 N 0.00 0.00 -0.19 4.80 1.57 -1.69 -2.83 116.57 118.24 2jan h LYS 142 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jan h LYS 142 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 2jan h LYS 142 CO 0.01 0.09 0.00 0.72 -0.57 0.00 0.00 179.45 179.70 2jan n HIS 143 N -3.35 0.25 -5.14 -1.35 8.25 -0.94 -4.83 115.22 108.10 2jan n HIS 143 Ca -0.01 -0.12 -0.32 0.00 -0.26 0.00 0.00 57.72 57.01 2jan n HIS 143 Cb 0.27 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.22 2jan n HIS 143 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2jan s PHE 144 N -1.75 2.59 -0.13 4.41 0.40 -1.07 -5.04 117.98 117.39 2jan s PHE 144 Ca 0.25 -0.91 -0.23 0.00 -0.60 0.00 0.00 56.93 55.44 2jan s PHE 144 Cb 0.13 -1.72 -0.03 0.00 0.51 0.00 0.00 43.02 41.92 2jan s PHE 144 CO 0.19 -0.34 0.71 0.45 0.70 0.00 0.00 175.22 176.93 2jan s SER 145 N 0.24 6.90 0.13 1.36 0.15 -1.26 -4.98 113.70 116.24 2jan s SER 145 Ca -0.15 1.09 -0.19 0.00 0.70 0.00 0.00 55.95 57.40 2jan s SER 145 Cb -0.17 -2.40 -0.05 0.00 -1.71 0.00 0.00 66.02 61.69 2jan s SER 145 CO 0.07 -0.23 1.77 0.58 1.20 0.00 0.00 173.24 176.64 2jan h VAL 146 N 4.98 1.02 -0.49 4.45 2.07 -1.99 -1.29 116.25 125.00 2jan h VAL 146 Ca -0.35 -0.09 0.10 0.00 0.82 0.00 0.00 66.70 67.17 2jan h VAL 146 Cb 1.17 0.73 -0.10 0.00 -1.52 0.00 0.00 31.29 31.57 2jan h VAL 146 CO 0.78 0.05 -0.26 0.78 0.02 0.00 0.00 177.57 178.93 2jan h ASN 147 N 0.26 -0.90 -0.51 0.57 2.35 -1.99 -0.24 115.58 115.11 2jan h ASN 147 Ca 0.09 0.19 0.02 0.00 -0.55 0.00 0.00 56.30 56.05 2jan h ASN 147 Cb -0.00 0.47 -0.03 0.00 0.05 0.00 0.00 38.32 38.80 2jan h ASN 147 CO -0.04 -0.28 0.32 0.58 -1.65 0.00 0.00 177.43 176.36 2jan h VAL 148 N -0.15 1.08 -0.81 2.81 2.07 -1.91 -2.55 116.25 116.78 2jan h VAL 148 Ca 0.22 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2jan h VAL 148 Cb 0.50 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 2jan h VAL 148 CO -0.58 0.12 0.34 0.24 0.02 0.00 0.00 177.57 177.70 2jan h MET 149 N 0.64 1.21 -0.22 1.57 2.86 -0.59 -2.45 114.93 117.94 2jan h MET 149 Ca 0.20 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 2jan h MET 149 Cb -0.01 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 2jan h MET 149 CO -0.08 0.96 -0.09 -0.07 1.06 0.00 0.00 176.91 178.69 2jan h LEU 150 N 1.18 0.32 -0.13 1.22 3.38 -0.90 -3.16 115.31 117.22 2jan h LEU 150 Ca 0.27 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2jan h LEU 150 Cb 0.19 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2jan h LEU 150 CO -0.03 0.46 0.04 0.00 0.09 0.00 0.00 178.44 179.00 2jan h ALA 151 N 1.58 0.18 -1.04 1.53 0.00 -1.02 -3.25 119.26 117.23 2jan h ALA 151 Ca 0.07 -0.12 -0.86 0.00 0.00 0.00 0.00 54.91 53.99 2jan h ALA 151 Cb 0.37 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2jan h ALA 151 CO 0.02 -0.21 0.67 0.54 0.00 0.00 0.00 179.25 180.26 2jan n ARG 152 N -4.86 0.08 0.24 0.00 1.74 -1.11 -4.48 116.66 108.27 2jan n ARG 152 Ca -0.05 0.03 0.14 0.00 -0.77 0.00 0.00 57.85 57.20 2jan n ARG 152 Cb 0.14 -1.54 0.36 0.00 -1.02 0.00 0.00 32.46 30.40 2jan n ARG 152 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2jan h ASP 153 N 5.03 0.00 -0.38 0.55 5.19 -1.89 0.37 116.42 125.29 2jan h ASP 153 Ca -0.45 0.00 0.04 0.00 -0.62 0.00 0.00 57.03 56.01 2jan h ASP 153 Cb 1.37 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.84 2jan h ASP 153 CO 0.96 0.00 0.14 0.74 -3.12 0.00 0.00 179.24 177.96 2jan h THR 154 N 0.00 0.90 -0.06 0.35 2.02 -1.96 -2.36 112.91 111.81 2jan h THR 154 Ca 0.00 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 66.97 2jan h THR 154 Cb 0.81 0.57 0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2jan h THR 154 CO 0.00 0.06 -0.39 0.40 0.37 0.00 0.00 175.52 175.96 2jan h ILE 155 N 0.30 1.43 -0.63 3.11 2.04 -1.65 -2.82 117.51 119.29 2jan h ILE 155 Ca 0.17 -1.82 0.13 0.00 1.00 0.00 0.00 64.86 64.34 2jan h ILE 155 Cb 0.14 2.39 -0.10 0.00 -0.74 0.00 0.00 36.82 38.51 2jan h ILE 155 CO -0.17 0.53 0.04 -0.09 0.00 0.00 0.00 178.15 178.47 2jan h ARG 156 N -0.14 0.15 -0.15 2.37 1.12 -0.25 0.17 114.38 117.66 2jan h ARG 156 Ca -0.03 -0.01 -0.19 0.00 -1.11 0.00 0.00 59.98 58.63 2jan h ARG 156 Cb 1.06 -0.03 0.01 0.00 -0.01 0.00 0.00 29.97 30.99 2jan h ARG 156 CO 0.08 0.10 -0.66 0.00 -3.11 0.00 0.00 179.97 176.38 2jan h ARG 157 N 0.16 0.72 0.00 0.20 3.08 -1.53 -3.23 114.38 113.78 2jan h ARG 157 Ca 0.34 -0.57 0.00 0.00 0.07 0.00 0.00 59.98 59.82 2jan h ARG 157 Cb 0.55 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2jan h ARG 157 CO -0.51 1.18 0.00 -2.13 -1.07 0.00 0.00 179.97 177.44 2jan n ARG 158 N -4.05 0.05 -0.39 0.04 0.63 -0.92 -2.97 116.66 109.06 2jan n ARG 158 Ca -0.07 0.19 0.08 0.00 -0.92 0.00 0.00 57.85 57.13 2jan n ARG 158 Cb 0.69 -1.58 0.26 0.00 0.45 0.00 0.00 32.46 32.28 2jan n ARG 158 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2jan n LEU 159 N -1.68 3.44 -4.74 6.15 7.94 0.57 -4.44 117.00 124.24 2jan n LEU 159 Ca 0.05 -1.73 -0.37 0.00 -1.11 0.00 0.00 56.01 52.84 2jan n LEU 159 Cb 0.26 -0.45 -0.06 0.00 0.53 0.00 0.00 43.42 43.70 2jan n LEU 159 CO 0.20 0.69 0.08 0.00 -1.11 0.00 0.00 177.39 177.26 2jan s ALA 160 N -1.55 3.55 0.00 1.96 0.00 -1.16 -4.53 121.76 120.04 2jan s ALA 160 Ca 0.39 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.04 2jan s ALA 160 Cb 0.23 -2.51 0.00 0.00 0.00 0.00 0.00 23.12 20.84 2jan s ALA 160 CO 0.22 0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.49 2jan n GLY 161 N 3.14 0.98 0.39 0.00 0.00 -1.26 -3.97 105.19 104.46 2jan n GLY 161 Ca -0.10 -1.48 0.19 0.00 0.00 0.00 0.00 46.02 44.63 2jan n GLY 161 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jan h GLU 162 N 0.00 0.21 0.00 1.61 5.08 -1.94 -3.47 114.58 116.07 2jan h GLU 162 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2jan h GLU 162 Cb 0.00 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2jan h GLU 162 CO 0.00 0.14 0.00 0.41 -1.00 0.00 0.00 179.01 178.56 2jan n GLY 163 N -1.59 1.08 3.08 -3.84 0.00 -1.26 -4.93 105.19 97.74 2jan n GLY 163 Ca 0.14 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 2jan n GLY 163 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jan s ILE 164 N 0.00 0.60 0.60 -0.61 1.10 -1.26 -4.90 121.20 116.73 2jan s ILE 164 Ca 0.00 -1.20 -0.14 0.00 -0.51 0.00 0.00 60.65 58.79 2jan s ILE 164 Cb 0.00 -0.78 -0.04 0.00 0.15 0.00 0.00 42.46 41.80 2jan s ILE 164 CO 0.00 -0.43 1.04 -0.94 -2.11 0.00 0.00 174.94 172.50 2jan s SER 165 N -1.78 5.93 0.39 4.50 1.04 -1.26 -4.94 113.70 117.59 2jan s SER 165 Ca -0.07 1.68 0.13 0.00 0.48 0.00 0.00 55.95 58.18 2jan s SER 165 Cb -0.08 -2.51 0.96 0.00 0.10 0.00 0.00 66.02 64.49 2jan s SER 165 CO -0.00 -1.06 1.88 0.22 0.98 0.00 0.00 173.24 175.25 2jan h TYR 166 N 0.23 0.65 0.16 5.02 3.20 -2.01 -2.34 116.97 121.89 2jan h TYR 166 Ca -0.46 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.42 2jan h TYR 166 Cb 1.21 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.28 2jan h TYR 166 CO 0.61 0.22 -0.08 1.15 -1.64 0.00 0.00 178.16 178.42 2jan h THR 167 N 0.53 0.91 -0.29 1.81 2.02 -2.00 -2.62 112.91 113.27 2jan h THR 167 Ca 0.44 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 2jan h THR 167 Cb 0.90 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2jan h THR 167 CO -0.18 0.07 0.15 -0.33 0.37 0.00 0.00 175.52 175.60 2jan h GLU 168 N -0.37 0.40 0.00 6.66 5.08 -1.87 -1.46 114.58 123.02 2jan h GLU 168 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2jan h GLU 168 Cb 0.29 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2jan h GLU 168 CO 0.04 0.31 0.00 0.35 -1.00 0.00 0.00 179.01 178.71 2jan h PHE 169 N 0.40 0.00 0.00 4.33 3.57 -1.33 -3.28 116.94 120.63 2jan h PHE 169 Ca 0.10 0.00 -0.31 0.00 3.53 0.00 0.00 57.97 61.29 2jan h PHE 169 Cb 0.04 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.72 2jan h PHE 169 CO 0.00 0.00 -1.93 0.43 -2.23 0.00 0.00 178.31 174.59 2jan n SER 170 N -3.01 0.58 -0.33 0.41 7.64 -0.57 -4.41 113.62 113.93 2jan n SER 170 Ca 0.01 0.27 0.24 0.00 1.01 0.00 0.00 58.87 60.40 2jan n SER 170 Cb 0.29 0.31 0.47 0.00 -1.01 0.00 0.00 64.21 64.28 2jan n SER 170 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 2jan h TYR 171 N 0.00 0.73 -0.58 1.43 0.05 -1.57 0.18 116.97 117.20 2jan h TYR 171 Ca -0.37 0.04 0.09 0.00 0.05 0.00 0.00 58.73 58.55 2jan h TYR 171 Cb 2.07 -0.15 -0.11 0.00 1.01 0.00 0.00 36.73 39.55 2jan h TYR 171 CO 0.00 -0.31 -0.40 1.25 -1.05 0.00 0.00 178.16 177.65 2jan h LEU 172 N 0.17 -1.37 -0.71 3.88 7.12 -1.82 0.22 115.31 122.79 2jan h LEU 172 Ca 0.74 0.24 0.09 0.00 0.13 0.00 0.00 57.88 59.08 2jan h LEU 172 Cb 1.76 0.64 -0.07 0.00 -0.53 0.00 0.00 40.66 42.46 2jan h LEU 172 CO -0.70 -0.33 0.35 -0.07 -0.13 0.00 0.00 178.44 177.57 2jan h LEU 173 N -0.21 0.46 -0.42 2.25 4.07 -0.94 0.12 115.31 120.65 2jan h LEU 173 Ca 0.20 0.06 -0.15 0.00 0.08 0.00 0.00 57.88 58.07 2jan h LEU 173 Cb 0.56 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.28 2jan h LEU 173 CO -0.69 0.26 -0.33 -0.07 -1.08 0.00 0.00 178.44 176.54 2jan h LEU 174 N 0.60 1.02 0.08 1.67 3.38 -1.21 -0.65 115.31 120.19 2jan h LEU 174 Ca 0.35 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.89 2jan h LEU 174 Cb 0.37 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2jan h LEU 174 CO -0.27 1.24 -0.14 -0.61 0.09 0.00 0.00 178.44 178.75 2jan h GLN 175 N 0.80 -0.27 -0.72 1.13 5.75 0.09 -2.16 115.11 119.72 2jan h GLN 175 Ca 0.08 0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.69 2jan h GLN 175 Cb 0.92 0.06 -0.07 0.00 1.07 0.00 0.00 27.48 29.46 2jan h GLN 175 CO 0.09 -0.18 0.37 0.00 -2.65 0.00 0.00 178.83 176.45 2jan h ALA 176 N 0.59 1.00 -0.25 3.38 0.00 -0.68 -2.31 119.26 121.00 2jan h ALA 176 Ca 0.02 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2jan h ALA 176 Cb 0.30 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jan h ALA 176 CO -0.08 -0.02 -0.03 -0.97 0.00 0.00 0.00 179.25 178.14 2jan h ASN 177 N 0.63 0.35 -0.90 0.00 -1.24 -0.75 -2.18 115.58 111.49 2jan h ASN 177 Ca 0.35 -0.06 0.09 0.00 0.71 0.00 0.00 56.30 57.40 2jan h ASN 177 Cb 0.36 -0.09 -0.07 0.00 0.73 0.00 0.00 38.32 39.25 2jan h ASN 177 CO -0.26 0.44 0.58 0.44 -1.29 0.00 0.00 177.43 177.34 2jan h ASP 178 N 0.37 0.82 -0.19 1.15 3.32 -0.80 -0.02 116.42 121.07 2jan h ASP 178 Ca 0.08 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2jan h ASP 178 Cb 0.30 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 2jan h ASP 178 CO 0.01 0.49 0.06 0.22 -1.72 0.00 0.00 179.24 178.30 2jan h TYR 179 N 0.91 0.30 -0.04 4.55 5.03 -1.45 -0.37 116.97 125.90 2jan h TYR 179 Ca 0.42 -0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.73 2jan h TYR 179 Cb 0.39 -0.09 -0.04 0.00 1.55 0.00 0.00 36.73 38.54 2jan h TYR 179 CO -0.00 0.38 -0.16 0.28 -1.32 0.00 0.00 178.16 177.33 2jan h VAL 180 N 0.14 0.59 -0.68 1.81 2.07 -1.26 -1.13 116.25 117.79 2jan h VAL 180 Ca 0.06 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.53 2jan h VAL 180 Cb 0.21 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 2jan h VAL 180 CO -0.00 0.00 0.24 -0.08 0.02 0.00 0.00 177.57 177.75 2jan h GLU 181 N -0.25 1.05 0.00 1.57 4.57 -0.97 -1.44 114.58 119.11 2jan h GLU 181 Ca 0.06 -0.21 -0.09 0.00 -1.18 0.00 0.00 59.36 57.95 2jan h GLU 181 Cb 0.34 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 2jan h GLU 181 CO -0.18 0.89 -0.41 -0.07 -1.18 0.00 0.00 179.01 178.06 2jan h LEU 182 N 0.99 0.00 -0.47 1.64 3.38 -0.82 -0.84 115.31 119.19 2jan h LEU 182 Ca 0.22 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.02 2jan h LEU 182 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2jan h LEU 182 CO -0.01 0.41 -0.70 -0.74 0.09 0.00 0.00 178.44 177.49 2jan h HIS 183 N 0.00 0.46 0.01 1.13 2.76 -0.74 -1.31 115.15 117.46 2jan h HIS 183 Ca -0.00 -0.20 -0.00 0.00 -2.20 0.00 0.00 60.37 57.97 2jan h HIS 183 Cb 0.82 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.71 2jan h HIS 183 CO 0.00 0.93 -0.00 0.00 -1.30 0.00 0.00 177.93 177.55 2jan h ARG 184 N 0.24 -0.01 0.02 5.26 3.08 -0.90 -2.40 114.38 119.67 2jan h ARG 184 Ca -0.02 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.80 2jan h ARG 184 Cb 1.26 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.28 2jan h ARG 184 CO 0.12 0.26 -1.13 0.00 -1.07 0.00 0.00 179.97 178.14 2jan h ARG 185 N -0.28 0.05 0.00 0.04 3.08 -1.18 -3.38 114.38 112.71 2jan h ARG 185 Ca -0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2jan h ARG 185 Cb 0.28 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2jan h ARG 185 CO 0.00 0.99 -0.11 0.72 -1.07 0.00 0.00 179.97 180.50 2jan n HIS 186 N -3.35 0.00 -1.94 3.04 8.25 -0.51 -4.99 115.22 115.72 2jan n HIS 186 Ca -0.04 -0.21 -0.18 0.00 -0.26 0.00 0.00 57.72 57.04 2jan n HIS 186 Cb 0.97 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 32.00 2jan n HIS 186 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jan n GLY 187 N -0.25 0.68 3.72 -1.41 0.00 -0.90 -4.84 105.19 102.18 2jan n GLY 187 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2jan n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jan n THR 189 N 3.78 0.00 -3.70 0.00 5.66 -0.53 -4.25 114.28 115.24 2jan n THR 189 Ca 0.16 -0.32 -0.12 0.00 -3.05 0.00 0.00 64.05 60.72 2jan n THR 189 Cb 0.34 1.30 -0.10 0.00 -1.55 0.00 0.00 70.33 70.32 2jan n THR 189 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2jan s LEU 190 N -0.24 -0.02 0.01 1.09 2.96 -1.16 -1.73 118.68 119.58 2jan s LEU 190 Ca 0.00 1.00 0.07 0.00 -0.22 0.00 0.00 54.13 54.98 2jan s LEU 190 Cb 0.00 1.64 -0.03 0.00 0.50 0.00 0.00 46.19 48.30 2jan s LEU 190 CO 0.00 -0.18 -0.20 -1.58 -1.32 0.00 0.00 176.35 173.07 2jan s GLN 191 N 0.71 2.12 0.11 1.98 0.74 -1.09 -0.63 119.66 123.60 2jan s GLN 191 Ca -0.04 -0.93 0.07 0.00 0.05 0.00 0.00 55.36 54.51 2jan s GLN 191 Cb -0.05 -2.17 -0.04 0.00 1.10 0.00 0.00 33.01 31.85 2jan s GLN 191 CO -0.05 0.56 -0.17 0.96 -0.55 0.00 0.00 175.29 176.04 2jan s ILE 192 N -0.82 1.47 0.00 -2.34 -4.36 0.16 -2.08 121.20 113.23 2jan s ILE 192 Ca 0.13 -1.59 0.00 0.00 -0.26 0.00 0.00 60.65 58.93 2jan s ILE 192 Cb -0.10 -1.47 0.00 0.00 1.25 0.00 0.00 42.46 42.13 2jan s ILE 192 CO 0.03 -0.24 0.00 0.61 0.24 0.00 0.00 174.94 175.58 2jan n GLY 193 N 0.86 2.39 3.78 6.27 0.00 -1.19 -4.22 105.19 113.08 2jan n GLY 193 Ca -0.18 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 2jan n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jan s GLY 194 N -0.59 1.58 0.17 -0.02 0.00 -1.26 -0.43 107.32 106.77 2jan s GLY 194 Ca 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 44.72 44.08 2jan s GLY 194 CO 0.00 0.02 1.54 0.00 0.00 0.00 0.00 173.10 174.66 2jan h ALA 195 N -1.55 0.69 -0.00 3.20 0.00 -1.59 -2.77 119.26 117.24 2jan h ALA 195 Ca -0.50 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 53.97 2jan h ALA 195 Cb 1.33 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2jan h ALA 195 CO 0.60 0.67 -0.10 0.38 0.00 0.00 0.00 179.25 180.80 2jan h ASP 196 N 0.78 0.00 0.68 0.00 3.04 -1.93 -2.87 116.42 116.12 2jan h ASP 196 Ca 0.09 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.88 2jan h ASP 196 Cb 0.85 -0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.14 2jan h ASP 196 CO 0.07 0.10 0.00 0.00 -2.04 0.00 0.00 179.24 177.38 2jan n GLN 197 N -4.42 0.12 -0.31 4.15 1.13 -1.05 -4.16 117.38 112.83 2jan n GLN 197 Ca -0.03 0.09 0.02 0.00 -1.94 0.00 0.00 57.00 55.14 2jan n GLN 197 Cb 0.17 -1.50 0.09 0.00 0.11 0.00 0.00 30.24 29.12 2jan n GLN 197 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2jan h TRP 198 N 0.00 -0.59 -0.51 1.08 2.91 -1.60 -2.56 115.95 114.68 2jan h TRP 198 Ca 0.00 0.08 0.09 0.00 1.13 0.00 0.00 58.89 60.20 2jan h TRP 198 Cb 0.34 0.40 -0.10 0.00 -0.51 0.00 0.00 29.16 29.28 2jan h TRP 198 CO 0.00 -0.38 -0.34 0.78 -1.03 0.00 0.00 178.44 177.47 2jan h GLY 199 N -0.02 -0.20 1.25 2.65 0.00 -1.86 -1.06 103.07 103.85 2jan h GLY 199 Ca 0.40 0.44 0.00 0.00 0.00 0.00 0.00 47.33 48.16 2jan h GLY 199 CO -0.90 -0.20 -0.41 1.16 0.00 0.00 0.00 176.54 176.19 2jan n ASN 200 N -5.42 0.44 -0.08 0.19 2.04 -1.06 -2.64 115.26 108.72 2jan n ASN 200 Ca 0.03 -0.01 -0.13 0.00 -0.44 0.00 0.00 54.58 54.02 2jan n ASN 200 Cb 0.35 0.06 -0.05 0.00 -2.53 0.00 0.00 39.78 37.61 2jan n ASN 200 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 2jan h ILE 201 N 0.00 1.31 0.00 1.53 2.04 -0.84 -2.96 117.51 118.59 2jan h ILE 201 Ca 0.00 -1.37 -0.06 0.00 1.00 0.00 0.00 64.86 64.43 2jan h ILE 201 Cb 0.55 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 2jan h ILE 201 CO 0.00 0.43 -0.30 -0.29 0.00 0.00 0.00 178.15 177.99 2jan h ILE 202 N 0.31 0.85 -0.79 -0.67 6.09 -1.32 -2.03 117.51 119.95 2jan h ILE 202 Ca 0.04 -1.20 0.10 0.00 -1.37 0.00 0.00 64.86 62.43 2jan h ILE 202 Cb 0.77 1.73 -0.07 0.00 0.47 0.00 0.00 36.82 39.71 2jan h ILE 202 CO 0.06 0.29 0.43 0.00 -3.07 0.00 0.00 178.15 175.86 2jan h ALA 203 N 1.70 1.12 0.20 0.18 0.00 -1.41 0.09 119.26 121.14 2jan h ALA 203 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2jan h ALA 203 Cb 0.70 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2jan h ALA 203 CO 0.04 0.04 -0.10 0.78 0.00 0.00 0.00 179.25 180.01 2jan h GLY 204 N 0.72 -0.28 -0.69 0.00 0.00 -1.25 -1.71 103.07 99.84 2jan h GLY 204 Ca 0.39 0.10 0.12 0.00 0.00 0.00 0.00 47.33 47.94 2jan h GLY 204 CO -0.26 -0.10 -0.40 -2.08 0.00 0.00 0.00 176.54 173.70 2jan h VAL 205 N -0.71 0.07 0.02 4.60 2.07 -1.19 0.23 116.25 121.34 2jan h VAL 205 Ca -0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.52 2jan h VAL 205 Cb 0.49 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 2jan h VAL 205 CO 0.05 0.00 -0.20 -0.09 0.02 0.00 0.00 177.57 177.34 2jan h ARG 206 N -0.11 -0.32 -0.46 1.57 2.43 -0.98 -2.42 114.38 114.11 2jan h ARG 206 Ca 0.26 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2jan h ARG 206 Cb 0.56 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 2jan h ARG 206 CO -0.82 -0.21 0.29 1.25 -1.51 0.00 0.00 179.97 178.97 2jan h LEU 207 N -0.33 0.53 -1.27 3.80 5.85 -0.32 -1.34 115.31 122.23 2jan h LEU 207 Ca 0.05 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 2jan h LEU 207 Cb 0.40 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2jan h LEU 207 CO -0.17 0.40 -0.13 0.58 -0.34 0.00 0.00 178.44 178.77 2jan h VAL 208 N 0.62 1.20 0.17 1.05 2.07 -0.11 -0.63 116.25 120.63 2jan h VAL 208 Ca 0.17 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 2jan h VAL 208 Cb -0.05 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2jan h VAL 208 CO -0.03 0.28 -0.08 -0.09 0.02 0.00 0.00 177.57 177.67 2jan h ARG 209 N 0.32 -0.22 -0.07 1.57 2.43 -0.89 -0.44 114.38 117.08 2jan h ARG 209 Ca 0.06 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2jan h ARG 209 Cb 0.42 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 2jan h ARG 209 CO 0.02 0.20 -0.38 1.96 -1.51 0.00 0.00 179.97 180.27 2jan h GLN 210 N -0.87 -0.41 0.29 0.20 4.20 -1.36 0.52 115.11 117.68 2jan h GLN 210 Ca -0.02 0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2jan h GLN 210 Cb 0.52 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.39 2jan h GLN 210 CO 0.04 -0.27 -0.14 0.87 -0.67 0.00 0.00 178.83 178.65 2jan h LYS 211 N -0.43 -0.38 -0.00 1.46 1.57 -1.23 -3.36 116.57 114.20 2jan h LYS 211 Ca 0.02 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2jan h LYS 211 Cb 0.48 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2jan h LYS 211 CO -0.29 -0.13 -0.69 1.28 -0.57 0.00 0.00 179.45 179.05 2jan n LEU 212 N -5.18 0.94 0.00 2.94 4.32 -0.21 -5.00 117.00 114.81 2jan n LEU 212 Ca -0.10 -0.55 0.00 0.00 -0.02 0.00 0.00 56.01 55.34 2jan n LEU 212 Cb 0.23 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.03 2jan n LEU 212 CO 0.33 0.22 0.00 0.61 -1.22 0.00 0.00 177.39 177.33 2jan n GLY 213 N 1.35 2.66 3.77 -0.72 0.00 0.18 -4.95 105.19 107.48 2jan n GLY 213 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2jan n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jan s ALA 214 N -1.67 3.19 -0.24 4.61 0.00 -1.25 -4.87 121.76 121.54 2jan s ALA 214 Ca 0.00 0.71 -0.19 0.00 0.00 0.00 0.00 51.96 52.47 2jan s ALA 214 Cb 0.00 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 2jan s ALA 214 CO 0.00 -0.11 0.58 0.99 0.00 0.00 0.00 175.76 177.22 2jan s THR 215 N -1.52 5.03 0.48 0.00 2.01 -1.26 -3.54 115.64 116.84 2jan s THR 215 Ca 0.53 1.04 0.03 0.00 0.31 0.00 0.00 61.69 63.59 2jan s THR 215 Cb -0.24 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 2jan s THR 215 CO 0.30 0.07 0.02 0.68 -0.69 0.00 0.00 174.62 175.00 2jan s VAL 216 N 2.26 1.26 0.38 3.82 -7.23 -1.26 -5.10 120.40 114.53 2jan s VAL 216 Ca 0.25 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.47 2jan s VAL 216 Cb -0.16 -2.35 -0.07 0.00 0.56 0.00 0.00 36.38 34.37 2jan s VAL 216 CO 0.09 0.00 0.04 -1.00 -0.31 0.00 0.00 175.10 173.92 2jan s HIS 217 N -2.89 2.19 -0.06 2.82 3.76 -0.71 -4.97 115.29 115.43 2jan s HIS 217 Ca 0.14 -0.85 -0.06 0.00 -0.15 0.00 0.00 55.06 54.14 2jan s HIS 217 Cb 0.03 -1.51 0.02 0.00 1.11 0.00 0.00 32.58 32.23 2jan s HIS 217 CO 0.07 0.20 0.17 0.00 -0.85 0.00 0.00 174.74 174.33 2jan s ALA 218 N -3.02 -0.41 -0.13 -1.40 0.00 -1.26 -2.69 121.76 112.86 2jan s ALA 218 Ca 0.33 0.50 -0.04 0.00 0.00 0.00 0.00 51.96 52.75 2jan s ALA 218 Cb 0.09 -0.29 0.07 0.00 0.00 0.00 0.00 23.12 22.98 2jan s ALA 218 CO 0.16 -0.09 0.24 -1.17 0.00 0.00 0.00 175.76 174.90 2jan s LEU 219 N 0.19 -0.23 0.25 0.00 0.20 -0.88 -1.15 118.68 117.05 2jan s LEU 219 Ca -0.01 0.42 0.05 0.00 0.69 0.00 0.00 54.13 55.28 2jan s LEU 219 Cb -0.02 0.57 -0.03 0.00 -0.43 0.00 0.00 46.19 46.28 2jan s LEU 219 CO -0.00 -0.25 0.38 0.42 -0.29 0.00 0.00 176.35 176.60 2jan s THR 220 N 2.38 5.24 0.22 3.68 -4.23 0.78 -3.18 115.64 120.53 2jan s THR 220 Ca 0.03 -0.95 0.10 0.00 -1.18 0.00 0.00 61.69 59.69 2jan s THR 220 Cb -0.13 -3.86 -0.04 0.00 1.34 0.00 0.00 72.50 69.81 2jan s THR 220 CO -0.08 -0.35 -0.14 0.54 -0.54 0.00 0.00 174.62 174.05 2jan s VAL 221 N -2.01 2.88 0.49 2.29 0.11 0.43 -1.07 120.40 123.52 2jan s VAL 221 Ca 0.35 -1.94 -0.21 0.00 -2.93 0.00 0.00 61.98 57.25 2jan s VAL 221 Cb -0.09 -2.45 -0.07 0.00 -1.53 0.00 0.00 36.38 32.24 2jan s VAL 221 CO 0.30 -0.21 1.13 -2.84 -3.33 0.00 0.00 175.10 170.15 2jan s PRO 222 N -3.05 3.65 0.25 1.54 0.02 -1.25 -1.62 135.00 134.54 2jan s PRO 222 Ca 0.26 1.65 -0.30 0.00 0.02 0.00 0.00 61.00 62.63 2jan s PRO 222 Cb -0.07 -2.24 -0.09 0.00 0.02 0.00 0.00 34.50 32.11 2jan s PRO 222 CO 0.14 -0.61 1.02 -0.51 -0.33 0.00 0.00 177.00 176.72 2jan s LEU 223 N -3.31 4.60 -0.32 -5.54 1.02 -1.26 -4.73 118.68 109.13 2jan s LEU 223 Ca 0.67 2.10 -0.18 0.00 0.02 0.00 0.00 54.13 56.74 2jan s LEU 223 Cb -0.25 -3.62 -0.01 0.00 0.02 0.00 0.00 46.19 42.33 2jan s LEU 223 CO 0.30 0.00 0.54 -0.69 0.02 0.00 0.00 176.35 176.51 2jan s VAL 224 N -1.12 5.01 -0.05 -1.59 1.01 -1.26 -5.05 120.40 117.35 2jan s VAL 224 Ca 0.43 0.55 0.06 0.00 0.00 0.00 0.00 61.98 63.02 2jan s VAL 224 Cb -0.29 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 2jan s VAL 224 CO 0.36 -0.14 -0.23 -0.89 0.00 0.00 0.00 175.10 174.20 2jan s THR 225 N 2.43 1.90 0.80 3.92 2.01 -1.26 -2.45 115.64 122.99 2jan s THR 225 Ca 0.20 -0.98 -0.12 0.00 0.31 0.00 0.00 61.69 61.10 2jan s THR 225 Cb -0.15 -1.61 0.08 0.00 0.01 0.00 0.00 72.50 70.83 2jan s THR 225 CO 0.12 0.53 1.16 0.00 -0.69 0.00 0.00 174.62 175.74 2jan s ALA 226 N -0.16 1.92 0.48 7.40 0.00 0.30 -4.90 121.76 126.80 2jan s ALA 226 Ca -0.02 0.63 0.15 0.00 0.00 0.00 0.00 51.96 52.72 2jan s ALA 226 Cb -0.13 -3.42 1.11 0.00 0.00 0.00 0.00 23.12 20.69 2jan s ALA 226 CO 0.03 -2.16 2.06 0.00 0.00 0.00 0.00 175.76 175.69 2jan h ALA 227 N -1.04 1.81 0.00 0.00 0.00 -1.90 -1.36 119.26 116.78 2jan h ALA 227 Ca -0.45 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2jan h ALA 227 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2jan h ALA 227 CO 0.47 0.14 0.00 -0.40 0.00 0.00 0.00 179.25 179.46 2jan n ASP 228 N -4.40 0.14 0.00 0.00 5.75 -1.26 -4.87 116.55 111.91 2jan n ASP 228 Ca -0.03 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 2jan n ASP 228 Cb 0.18 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2jan n ASP 228 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jan n GLY 229 N 0.39 2.79 3.77 6.12 0.00 -0.51 -5.02 105.19 112.73 2jan n GLY 229 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2jan n GLY 229 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jan s THR 230 N -2.01 3.26 0.28 2.61 -4.23 -1.26 -4.70 115.64 109.59 2jan s THR 230 Ca 0.00 0.67 -0.29 0.00 -1.18 0.00 0.00 61.69 60.89 2jan s THR 230 Cb 0.00 -3.20 -0.09 0.00 1.34 0.00 0.00 72.50 70.55 2jan s THR 230 CO 0.00 -0.29 0.99 -0.75 -0.54 0.00 0.00 174.62 174.03 2jan s LYS 231 N -3.76 4.70 0.41 3.99 2.20 -1.26 -0.53 119.74 125.49 2jan s LYS 231 Ca 0.69 1.54 -0.22 0.00 -0.36 0.00 0.00 55.97 57.62 2jan s LYS 231 Cb -0.21 -3.11 -0.10 0.00 -1.51 0.00 0.00 37.83 32.89 2jan s LYS 231 CO 0.35 0.35 0.97 0.12 -0.36 0.00 0.00 175.35 176.78 2jan s PHE 232 N -1.30 3.35 -0.17 4.03 5.36 -1.02 -4.24 117.98 123.99 2jan s PHE 232 Ca 0.45 1.65 0.00 0.00 -0.96 0.00 0.00 56.93 58.07 2jan s PHE 232 Cb -0.26 -2.92 0.00 0.00 -0.34 0.00 0.00 43.02 39.50 2jan s PHE 232 CO 0.32 -0.18 0.00 0.41 -1.46 0.00 0.00 175.22 174.31 2jan n GLY 233 N -0.24 0.45 3.60 13.12 0.00 -1.26 -4.80 105.19 116.06 2jan n GLY 233 Ca 0.06 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 2jan n GLY 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jan s LYS 234 N -2.71 2.42 0.53 1.61 -0.14 -1.26 -3.42 119.74 116.77 2jan s LYS 234 Ca 0.00 -0.83 -0.20 0.00 -1.36 0.00 0.00 55.97 53.58 2jan s LYS 234 Cb 0.00 -2.45 -0.06 0.00 -1.68 0.00 0.00 37.83 33.64 2jan s LYS 234 CO 0.00 0.56 1.11 0.45 -0.76 0.00 0.00 175.35 176.71 2jan s SER 235 N -1.80 5.85 0.09 2.83 0.15 0.39 -4.90 113.70 116.31 2jan s SER 235 Ca 0.20 2.12 -0.01 0.00 0.70 0.00 0.00 55.95 58.97 2jan s SER 235 Cb -0.11 -2.58 0.19 0.00 -1.71 0.00 0.00 66.02 61.81 2jan s SER 235 CO 0.11 -1.13 0.47 0.35 1.20 0.00 0.00 173.24 174.24 2jan n THR 236 N -1.23 -0.13 -3.45 6.45 -2.24 -1.26 -2.81 114.28 109.60 2jan n THR 236 Ca 0.11 0.67 -0.13 0.00 -2.27 0.00 0.00 64.05 62.43 2jan n THR 236 Cb 0.51 -0.95 -0.11 0.00 -2.10 0.00 0.00 70.33 67.68 2jan n THR 236 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jan s GLY 237 N -3.95 -0.21 0.00 3.38 0.00 -1.26 -5.10 107.32 100.18 2jan s GLY 237 Ca -0.04 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2jan s GLY 237 CO 0.23 2.37 0.00 0.61 0.00 0.00 0.00 173.10 176.32 2jan n GLY 238 N 5.35 0.53 0.00 0.20 0.00 -1.12 -5.13 105.19 105.01 2jan n GLY 238 Ca -0.05 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2jan n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jan n GLY 239 N 0.00 5.25 3.80 -0.02 0.00 -1.26 -4.34 105.19 108.61 2jan n GLY 239 Ca 0.00 -1.53 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 2jan n GLY 239 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jan s SER 240 N 1.00 5.89 -0.33 1.61 0.01 -1.26 0.15 113.70 120.76 2jan s SER 240 Ca 0.00 1.85 -0.12 0.00 1.31 0.00 0.00 55.95 58.99 2jan s SER 240 Cb 0.00 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.67 2jan s SER 240 CO 0.00 -1.09 0.22 -0.76 0.41 0.00 0.00 173.24 172.02 2jan s LEU 241 N -4.28 4.42 0.17 2.44 1.02 -1.22 -4.72 118.68 116.52 2jan s LEU 241 Ca 0.65 -0.41 -0.06 0.00 0.02 0.00 0.00 54.13 54.33 2jan s LEU 241 Cb -0.16 -2.12 -0.06 0.00 0.02 0.00 0.00 46.19 43.87 2jan s LEU 241 CO 0.33 -0.21 0.43 0.26 0.02 0.00 0.00 176.35 177.17 2jan s TRP 242 N 1.71 3.46 -0.26 0.29 0.52 -1.26 -1.75 118.94 121.64 2jan s TRP 242 Ca 0.06 0.63 0.24 0.00 0.02 0.00 0.00 56.10 57.05 2jan s TRP 242 Cb -0.17 -2.06 0.54 0.00 -1.15 0.00 0.00 33.47 30.62 2jan s TRP 242 CO 0.10 0.38 1.67 -0.07 0.02 0.00 0.00 176.95 179.05 2jan h LEU 243 N 2.66 0.00 -9.29 2.99 3.38 -1.49 -3.40 115.31 110.16 2jan h LEU 243 Ca -0.46 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 56.95 2jan h LEU 243 Cb 1.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2jan h LEU 243 CO 0.71 0.08 0.69 -0.62 0.09 0.00 0.00 178.44 179.39 2jan s ASP 244 N -6.14 7.08 0.41 -0.43 2.15 -1.26 -4.95 116.67 113.53 2jan s ASP 244 Ca 0.05 1.75 0.08 0.00 0.43 0.00 0.00 52.55 54.86 2jan s ASP 244 Cb 0.06 -2.56 0.88 0.00 -0.30 0.00 0.00 42.92 41.00 2jan s ASP 244 CO 0.65 -0.57 2.04 1.55 -0.17 0.00 0.00 175.17 178.67 2jan h PRO 245 N 7.43 0.44 -0.02 4.34 0.13 -1.86 -0.88 132.00 141.58 2jan h PRO 245 Ca -0.33 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2jan h PRO 245 Cb 1.15 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2jan h PRO 245 CO 0.88 0.33 0.00 1.04 -0.23 0.00 0.00 178.00 180.03 2jan n GLN 246 N -4.45 1.40 -0.13 0.86 3.00 -1.26 -2.64 117.38 114.17 2jan n GLN 246 Ca 0.02 -0.59 -0.22 0.00 -0.01 0.00 0.00 57.00 56.20 2jan n GLN 246 Cb 0.10 -1.47 -0.10 0.00 0.00 0.00 0.00 30.24 28.77 2jan n GLN 246 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2jan n MET 247 N -0.27 0.58 -3.91 -1.09 2.81 -0.63 -4.92 117.12 109.68 2jan n MET 247 Ca 0.20 0.19 -0.28 0.00 -1.81 0.00 0.00 57.70 55.99 2jan n MET 247 Cb 0.25 -1.46 -0.16 0.00 -0.71 0.00 0.00 33.22 31.14 2jan n MET 247 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2jan s THR 248 N -2.48 1.19 0.68 2.03 2.01 -0.43 -4.89 115.64 113.75 2jan s THR 248 Ca -0.34 -0.63 -0.17 0.00 0.31 0.00 0.00 61.69 60.86 2jan s THR 248 Cb 0.11 -1.32 0.01 0.00 0.01 0.00 0.00 72.50 71.31 2jan s THR 248 CO 0.51 0.19 1.28 -1.54 -0.69 0.00 0.00 174.62 174.37 2jan n SER 249 N 4.85 1.89 -0.34 3.53 3.41 -1.08 -3.95 113.62 121.93 2jan n SER 249 Ca -0.13 0.78 0.17 0.00 -0.26 0.00 0.00 58.87 59.43 2jan n SER 249 Cb 0.48 -1.55 0.39 0.00 -0.26 0.00 0.00 64.21 63.27 2jan n SER 249 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2jan h PRO 250 N 0.24 0.60 -0.18 4.33 0.11 -1.93 -0.99 132.00 134.18 2jan h PRO 250 Ca -0.50 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.61 2jan h PRO 250 Cb 1.33 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 2jan h PRO 250 CO 0.52 0.40 -0.02 -0.92 -0.21 0.00 0.00 178.00 177.76 2jan h TYR 251 N 0.62 -0.05 -0.23 0.65 3.20 -1.92 0.74 116.97 119.98 2jan h TYR 251 Ca 0.60 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.43 2jan h TYR 251 Cb 1.13 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.44 2jan h TYR 251 CO -0.00 -0.05 -0.09 0.00 -1.64 0.00 0.00 178.16 176.38 2jan h ALA 252 N 1.17 1.43 0.65 1.82 0.00 -1.63 0.73 119.26 123.43 2jan h ALA 252 Ca 0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2jan h ALA 252 Cb 0.12 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.80 2jan h ALA 252 CO -0.16 0.40 -0.31 2.35 0.00 0.00 0.00 179.25 181.52 2jan h TRP 253 N 0.34 -0.80 -0.37 0.00 2.91 -0.59 -1.42 115.95 116.02 2jan h TRP 253 Ca 0.07 -0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.13 2jan h TRP 253 Cb 0.37 0.27 -0.09 0.00 -0.51 0.00 0.00 29.16 29.20 2jan h TRP 253 CO 0.01 -0.46 -0.45 -0.92 -1.03 0.00 0.00 178.44 175.59 2jan h TYR 254 N -1.13 -1.31 -0.18 2.65 5.03 -0.63 -2.31 116.97 119.10 2jan h TYR 254 Ca -0.09 0.07 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 2jan h TYR 254 Cb 0.70 0.62 -0.01 0.00 1.55 0.00 0.00 36.73 39.60 2jan h TYR 254 CO 0.00 -0.46 0.09 1.96 -1.32 0.00 0.00 178.16 178.43 2jan h GLN 255 N -0.36 0.25 -0.13 1.82 1.08 -0.88 0.22 115.11 117.11 2jan h GLN 255 Ca 0.12 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.31 2jan h GLN 255 Cb 0.59 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2jan h GLN 255 CO -0.55 0.20 0.06 -0.92 -0.95 0.00 0.00 178.83 176.67 2jan h TYR 256 N 0.25 0.12 0.00 2.96 3.20 -0.68 -2.33 116.97 120.49 2jan h TYR 256 Ca 0.07 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.78 2jan h TYR 256 Cb 0.03 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 2jan h TYR 256 CO 0.00 0.07 -0.78 0.74 -1.64 0.00 0.00 178.16 176.55 2jan h PHE 257 N 0.14 0.00 0.00 -3.82 0.04 -1.02 -2.99 116.94 109.28 2jan h PHE 257 Ca 0.05 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 2jan h PHE 257 Cb 0.01 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 2jan h PHE 257 CO -0.09 0.78 -0.08 -0.24 -0.60 0.00 0.00 178.31 178.09 2jan h VAL 258 N 0.00 0.28 -0.69 -0.55 3.04 -0.52 -2.79 116.25 115.01 2jan h VAL 258 Ca -0.01 -0.56 0.00 0.00 -1.01 0.00 0.00 66.70 65.13 2jan h VAL 258 Cb 1.44 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 32.15 2jan h VAL 258 CO 0.10 0.08 0.00 0.59 -1.01 0.00 0.00 177.57 177.33 2jan n ASN 259 N -3.31 3.83 -4.64 3.17 3.02 -0.89 -4.80 115.26 111.64 2jan n ASN 259 Ca -0.01 -2.04 -0.49 0.00 -0.03 0.00 0.00 54.58 52.01 2jan n ASN 259 Cb 0.27 -0.48 -0.05 0.00 -0.61 0.00 0.00 39.78 38.91 2jan n ASN 259 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2jan n THR 260 N 1.50 0.01 -1.58 3.41 -1.04 -1.05 -4.91 114.28 110.62 2jan n THR 260 Ca 0.24 -0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.87 2jan n THR 260 Cb 0.62 -1.23 0.06 0.00 -1.82 0.00 0.00 70.33 67.96 2jan n THR 260 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jan n ALA 261 N 3.10 0.12 -0.32 2.41 0.00 -1.26 -4.78 120.51 119.79 2jan n ALA 261 Ca 0.18 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.67 2jan n ALA 261 Cb 0.24 -2.12 0.31 0.00 0.00 0.00 0.00 19.45 17.89 2jan n ALA 261 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2jan h ASP 262 N 0.30 0.79 -0.10 0.00 3.32 -1.99 -2.27 116.42 116.47 2jan h ASP 262 Ca -0.48 0.05 0.03 0.00 0.02 0.00 0.00 57.03 56.64 2jan h ASP 262 Cb 1.36 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.79 2jan h ASP 262 CO 0.50 0.41 0.08 0.00 -1.72 0.00 0.00 179.24 178.50 2jan h ALA 263 N 1.57 2.06 0.00 3.45 0.00 -2.02 -3.10 119.26 121.22 2jan h ALA 263 Ca 0.48 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.24 2jan h ALA 263 Cb 0.61 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2jan h ALA 263 CO -0.24 -0.13 -2.03 -0.25 0.00 0.00 0.00 179.25 176.60 2jan n ASP 264 N -4.45 0.60 -0.29 0.00 8.00 -0.97 -4.76 116.55 114.68 2jan n ASP 264 Ca -0.00 0.00 0.10 0.00 0.71 0.00 0.00 54.79 55.60 2jan n ASP 264 Cb 0.19 1.48 0.34 0.00 -0.02 0.00 0.00 41.12 43.11 2jan n ASP 264 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 2jan h VAL 265 N 0.00 0.87 -0.19 2.53 3.04 -1.34 -0.57 116.25 120.58 2jan h VAL 265 Ca -0.21 -0.27 -0.21 0.00 -1.01 0.00 0.00 66.70 65.01 2jan h VAL 265 Cb 1.40 0.02 0.01 0.00 -2.01 0.00 0.00 31.29 30.71 2jan h VAL 265 CO 0.01 0.14 -0.70 0.40 -1.01 0.00 0.00 177.57 176.41 2jan h ILE 266 N 0.78 1.28 -0.27 3.17 1.08 -1.86 -0.94 117.51 120.75 2jan h ILE 266 Ca 0.46 -1.90 -0.02 0.00 -0.39 0.00 0.00 64.86 63.00 2jan h ILE 266 Cb 0.64 1.87 -0.01 0.00 -3.07 0.00 0.00 36.82 36.25 2jan h ILE 266 CO -0.22 0.61 0.09 -0.09 -0.69 0.00 0.00 178.15 177.85 2jan h ARG 267 N 0.56 0.42 -0.29 2.37 2.43 -1.47 0.91 114.38 119.31 2jan h ARG 267 Ca -0.03 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 2jan h ARG 267 Cb 1.32 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 2jan h ARG 267 CO 0.15 0.47 0.10 1.88 -1.51 0.00 0.00 179.97 181.06 2jan h TYR 268 N 0.28 0.46 -0.89 2.20 -1.99 -1.25 0.32 116.97 116.10 2jan h TYR 268 Ca 0.09 -0.04 0.15 0.00 2.00 0.00 0.00 58.73 60.93 2jan h TYR 268 Cb 0.22 -0.14 -0.10 0.00 2.00 0.00 0.00 36.73 38.72 2jan h TYR 268 CO 0.00 0.47 0.49 -0.07 -0.00 0.00 0.00 178.16 179.06 2jan h LEU 269 N 0.32 0.62 -0.84 3.88 3.38 -0.97 0.27 115.31 121.97 2jan h LEU 269 Ca 0.10 0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.06 2jan h LEU 269 Cb 0.22 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2jan h LEU 269 CO -0.00 0.26 -0.19 -0.09 0.09 0.00 0.00 178.44 178.50 2jan h ARG 270 N 0.69 0.65 0.03 1.13 2.43 0.02 -2.54 114.38 116.79 2jan h ARG 270 Ca 0.49 -0.24 -0.30 0.00 -0.81 0.00 0.00 59.98 59.13 2jan h ARG 270 Cb 0.68 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.15 2jan h ARG 270 CO -0.36 0.80 -1.67 -1.49 -1.51 0.00 0.00 179.97 175.75 2jan h TRP 271 N 0.58 0.10 -0.00 2.20 6.55 0.14 -3.39 115.95 122.13 2jan h TRP 271 Ca 0.09 -0.08 0.00 0.00 0.95 0.00 0.00 58.89 59.85 2jan h TRP 271 Cb 0.65 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.95 2jan h TRP 271 CO 0.03 1.14 -0.87 1.19 -1.05 0.00 0.00 178.44 178.88 2jan n PHE 272 N -3.17 0.00 -4.38 0.49 3.72 0.85 -4.87 117.46 110.10 2jan n PHE 272 Ca -0.17 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.02 2jan n PHE 272 Cb 1.04 -0.02 -0.09 0.00 -0.94 0.00 0.00 39.48 39.47 2jan n PHE 272 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2jan s THR 273 N -2.91 0.41 -1.20 4.37 -4.23 -0.96 -4.95 115.64 106.17 2jan s THR 273 Ca 0.10 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.77 2jan s THR 273 Cb 0.16 -2.49 0.48 0.00 1.34 0.00 0.00 72.50 72.00 2jan s THR 273 CO 0.81 0.00 1.40 0.49 -0.54 0.00 0.00 174.62 176.78 2jan n PHE 274 N -0.67 0.79 -1.65 3.99 3.01 -1.26 -4.80 117.46 116.87 2jan n PHE 274 Ca -0.00 -0.55 -0.43 0.00 1.01 0.00 0.00 57.45 57.49 2jan n PHE 274 Cb 0.65 -0.07 -0.00 0.00 -0.01 0.00 0.00 39.48 40.04 2jan n PHE 274 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2jan n LEU 275 N 0.85 2.90 -4.68 4.37 4.77 -1.26 -4.98 117.00 118.96 2jan n LEU 275 Ca 0.18 1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 57.02 2jan n LEU 275 Cb 0.58 -1.40 0.16 0.00 -2.33 0.00 0.00 43.42 40.44 2jan n LEU 275 CO 0.13 -0.99 0.65 -0.94 -1.33 0.00 0.00 177.39 174.91 2jan s SER 276 N -0.50 2.87 0.29 -1.43 1.04 -1.26 -4.83 113.70 109.88 2jan s SER 276 Ca 0.59 1.32 -0.02 0.00 0.48 0.00 0.00 55.95 58.31 2jan s SER 276 Cb -0.59 -1.99 0.42 0.00 0.10 0.00 0.00 66.02 63.96 2jan s SER 276 CO 0.60 -3.00 1.96 0.00 0.98 0.00 0.00 173.24 173.78 2jan h ALA 277 N -1.80 1.38 0.27 5.32 0.00 -1.99 -1.67 119.26 120.78 2jan h ALA 277 Ca -0.53 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2jan h ALA 277 Cb 1.31 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2jan h ALA 277 CO 0.56 0.56 -0.13 -0.44 0.00 0.00 0.00 179.25 179.80 2jan h ASP 278 N 1.12 -0.31 -0.96 0.00 3.32 -1.99 -1.14 116.42 116.46 2jan h ASP 278 Ca 0.30 -0.22 0.26 0.00 0.02 0.00 0.00 57.03 57.39 2jan h ASP 278 Cb -0.10 0.08 -0.13 0.00 0.22 0.00 0.00 39.33 39.39 2jan h ASP 278 CO -0.06 0.11 0.49 -0.33 -1.72 0.00 0.00 179.24 177.73 2jan h GLU 279 N -0.81 0.40 -0.00 3.56 5.08 -1.89 -0.14 114.58 120.78 2jan h GLU 279 Ca -0.04 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2jan h GLU 279 Cb 0.51 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 2jan h GLU 279 CO 0.06 0.26 0.00 -0.07 -1.00 0.00 0.00 179.01 178.26 2jan h LEU 280 N 0.41 0.00 -0.94 1.33 3.38 -1.26 -2.77 115.31 115.46 2jan h LEU 280 Ca 0.64 -0.29 0.24 0.00 0.09 0.00 0.00 57.88 58.56 2jan h LEU 280 Cb 1.31 -0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.94 2jan h LEU 280 CO -0.55 0.29 0.48 0.00 0.09 0.00 0.00 178.44 178.75 2jan h ALA 281 N 0.71 1.60 0.07 1.53 0.00 0.24 0.19 119.26 123.60 2jan h ALA 281 Ca 0.00 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2jan h ALA 281 Cb 0.29 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2jan h ALA 281 CO 0.00 -0.33 -0.03 0.93 0.00 0.00 0.00 179.25 179.82 2jan h GLU 282 N 0.47 -0.09 -0.16 0.00 5.08 -0.96 -2.12 114.58 116.78 2jan h GLU 282 Ca 0.60 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.89 2jan h GLU 282 Cb 1.16 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2jan h GLU 282 CO -0.51 0.04 -0.24 -0.07 -1.00 0.00 0.00 179.01 177.22 2jan h LEU 283 N -0.20 0.29 -0.09 1.33 3.38 -1.08 -0.98 115.31 117.95 2jan h LEU 283 Ca -0.01 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2jan h LEU 283 Cb 0.17 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2jan h LEU 283 CO 0.02 0.53 0.06 -0.08 0.09 0.00 0.00 178.44 179.06 2jan h GLU 284 N 0.26 0.13 -0.23 1.13 4.81 -0.46 0.29 114.58 120.51 2jan h GLU 284 Ca 0.04 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2jan h GLU 284 Cb 0.57 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 2jan h GLU 284 CO 0.04 0.12 0.14 0.37 -0.73 0.00 0.00 179.01 178.95 2jan h GLN 285 N 0.10 0.28 -0.60 1.92 4.15 -1.24 -1.28 115.11 118.45 2jan h GLN 285 Ca 0.03 -0.02 0.12 0.00 0.77 0.00 0.00 58.65 59.56 2jan h GLN 285 Cb 0.02 -0.06 -0.10 0.00 0.21 0.00 0.00 27.48 27.55 2jan h GLN 285 CO -0.01 0.19 -0.00 0.00 -1.93 0.00 0.00 178.83 177.08 2jan h ALA 286 N 1.09 0.58 -0.52 3.38 0.00 -0.80 0.39 119.26 123.38 2jan h ALA 286 Ca 0.09 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 2jan h ALA 286 Cb -0.02 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2jan h ALA 286 CO -0.03 -0.39 0.08 1.15 0.00 0.00 0.00 179.25 180.06 2jan h THR 287 N 0.11 1.25 0.02 0.00 2.02 -0.10 0.32 112.91 116.54 2jan h THR 287 Ca 0.31 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 2jan h THR 287 Cb 0.50 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2jan h THR 287 CO -0.52 0.34 -0.01 0.00 0.37 0.00 0.00 175.52 175.70 2jan h ALA 288 N 0.98 -0.02 -0.05 6.16 0.00 -0.63 -2.95 119.26 122.75 2jan h ALA 288 Ca 0.16 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 2jan h ALA 288 Cb 0.40 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2jan h ALA 288 CO 0.01 -0.45 -0.65 1.96 0.00 0.00 0.00 179.25 180.12 2jan h GLN 289 N -0.15 0.53 -2.12 0.00 4.20 -0.12 -3.39 115.11 114.06 2jan h GLN 289 Ca -0.00 -0.50 -0.53 0.00 0.06 0.00 0.00 58.65 57.68 2jan h GLN 289 Cb 0.15 0.13 -0.41 0.00 0.30 0.00 0.00 27.48 27.65 2jan h GLN 289 CO 0.00 1.14 -0.97 0.54 -0.67 0.00 0.00 178.83 178.87 2jan n ARG 290 N -4.14 1.87 0.08 1.46 1.74 0.11 -4.93 116.66 112.84 2jan n ARG 290 Ca -0.09 -3.97 0.15 0.00 -0.77 0.00 0.00 57.85 53.16 2jan n ARG 290 Cb 0.69 -1.91 0.65 0.00 -1.02 0.00 0.00 32.46 30.87 2jan n ARG 290 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2jan h PRO 291 N 3.06 0.05 0.00 5.56 0.13 -1.64 -1.15 132.00 138.00 2jan h PRO 291 Ca 0.11 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.18 2jan h PRO 291 Cb 0.78 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 2jan h PRO 291 CO 0.63 0.03 -0.27 -0.56 -0.23 0.00 0.00 178.00 177.60 2jan h GLN 292 N 0.05 0.00 0.00 0.86 -0.00 -1.92 -3.09 115.11 111.01 2jan h GLN 292 Ca 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.82 2jan h GLN 292 Cb 0.62 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.10 2jan h GLN 292 CO -0.01 0.27 -0.01 0.37 -0.00 0.00 0.00 178.83 179.46 2jan h GLN 293 N 0.00 0.00 -5.16 0.06 5.75 -1.59 -3.47 115.11 110.70 2jan h GLN 293 Ca -0.00 0.00 -0.40 0.00 -0.15 0.00 0.00 58.65 58.10 2jan h GLN 293 Cb 0.57 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 2jan h GLN 293 CO 0.04 0.01 -0.59 0.54 -2.65 0.00 0.00 178.83 176.17 2jan n ARG 294 N -3.10 -4.21 -0.14 1.69 1.74 -1.17 -4.89 116.66 106.58 2jan n ARG 294 Ca 0.04 0.65 -0.03 0.00 -0.77 0.00 0.00 57.85 57.74 2jan n ARG 294 Cb 0.53 -5.44 0.05 0.00 -1.02 0.00 0.00 32.46 26.58 2jan n ARG 294 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jan h ALA 295 N 0.98 0.49 -0.15 7.54 0.00 -1.89 -1.36 119.26 124.88 2jan h ALA 295 Ca -0.48 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2jan h ALA 295 Cb 1.33 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2jan h ALA 295 CO 0.56 -0.33 0.06 0.00 0.00 0.00 0.00 179.25 179.53 2jan h ALA 296 N 1.37 0.19 -0.49 0.00 0.00 -1.90 -1.86 119.26 116.57 2jan h ALA 296 Ca 0.23 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2jan h ALA 296 Cb 0.30 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2jan h ALA 296 CO -0.32 -0.21 0.09 1.96 0.00 0.00 0.00 179.25 180.78 2jan h GLN 297 N 0.08 0.75 -0.05 0.00 7.50 -1.86 -1.52 115.11 120.01 2jan h GLN 297 Ca 0.05 -0.15 -0.13 0.00 0.50 0.00 0.00 58.65 58.91 2jan h GLN 297 Cb 0.19 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.59 2jan h GLN 297 CO -0.00 0.70 -0.56 0.00 -1.50 0.00 0.00 178.83 177.46 2jan h ARG 298 N 0.72 0.16 -0.14 1.46 3.08 -1.03 -0.60 114.38 118.04 2jan h ARG 298 Ca 0.16 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 2jan h ARG 298 Cb 0.30 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 2jan h ARG 298 CO 0.00 0.68 -0.14 -0.09 -1.07 0.00 0.00 179.97 179.35 2jan h ARG 299 N 0.12 0.34 0.04 0.04 9.65 -0.97 -0.48 114.38 123.13 2jan h ARG 299 Ca -0.00 -0.18 0.03 0.00 -1.10 0.00 0.00 59.98 58.72 2jan h ARG 299 Cb 1.02 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.57 2jan h ARG 299 CO 0.08 0.74 -0.26 1.25 2.80 0.00 0.00 179.97 184.58 2jan h LEU 300 N -0.04 -0.76 -0.30 3.80 5.85 -1.19 0.46 115.31 123.13 2jan h LEU 300 Ca 0.02 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.88 2jan h LEU 300 Cb 0.68 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 2jan h LEU 300 CO 0.04 -0.34 0.06 0.00 -0.34 0.00 0.00 178.44 177.85 2jan h ALA 301 N 0.36 0.31 0.01 1.25 0.00 -1.12 -0.32 119.26 119.76 2jan h ALA 301 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jan h ALA 301 Cb 0.49 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2jan h ALA 301 CO -0.20 -0.35 -0.03 1.03 0.00 0.00 0.00 179.25 179.70 2jan h SER 302 N 0.17 -0.08 -0.52 0.00 0.87 -0.77 -0.52 113.55 112.70 2jan h SER 302 Ca 0.14 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 2jan h SER 302 Cb 0.15 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 2jan h SER 302 CO -0.19 -0.05 0.29 -0.33 -0.53 0.00 0.00 176.83 176.02 2jan h GLU 303 N -0.06 0.72 0.00 2.24 4.39 0.25 -2.13 114.58 119.98 2jan h GLU 303 Ca 0.01 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.50 2jan h GLU 303 Cb 0.07 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 2jan h GLU 303 CO -0.02 0.56 -0.58 -0.07 -1.16 0.00 0.00 179.01 177.73 2jan h LEU 304 N 0.69 0.00 -0.23 1.33 3.38 -1.02 -1.91 115.31 117.54 2jan h LEU 304 Ca 0.18 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.94 2jan h LEU 304 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2jan h LEU 304 CO -0.03 0.58 -0.91 0.74 0.09 0.00 0.00 178.44 178.92 2jan h THR 305 N 0.00 1.45 -0.15 0.22 2.02 -1.04 -2.83 112.91 112.59 2jan h THR 305 Ca -0.01 -2.53 -0.04 0.00 0.77 0.00 0.00 66.41 64.60 2jan h THR 305 Cb 1.43 2.44 -0.00 0.00 -1.74 0.00 0.00 68.15 70.27 2jan h THR 305 CO 0.08 0.75 -0.08 0.58 0.37 0.00 0.00 175.52 177.22 2jan h VAL 306 N 0.17 1.32 -0.58 3.16 2.07 -1.41 0.14 116.25 121.12 2jan h VAL 306 Ca -0.06 -1.13 0.12 0.00 0.82 0.00 0.00 66.70 66.45 2jan h VAL 306 Cb 1.54 1.75 -0.11 0.00 -1.52 0.00 0.00 31.29 32.95 2jan h VAL 306 CO 0.15 0.33 -0.09 0.25 0.02 0.00 0.00 177.57 178.23 2jan h LEU 307 N -0.03 -0.44 0.05 2.57 6.46 -1.38 -0.45 115.31 122.09 2jan h LEU 307 Ca 0.03 0.16 -0.27 0.00 -0.12 0.00 0.00 57.88 57.69 2jan h LEU 307 Cb 0.55 0.32 -0.02 0.00 -0.73 0.00 0.00 40.66 40.78 2jan h LEU 307 CO 0.02 -0.16 -1.44 0.58 -0.62 0.00 0.00 178.44 176.83 2jan h VAL 308 N 0.04 0.88 -0.02 1.05 2.07 -1.48 -3.41 116.25 115.37 2jan h VAL 308 Ca 0.29 -2.25 0.00 0.00 0.82 0.00 0.00 66.70 65.55 2jan h VAL 308 Cb 0.45 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2jan h VAL 308 CO -0.56 0.52 0.00 1.41 0.02 0.00 0.00 177.57 178.96 2jan n HIS 309 N -4.13 0.02 0.00 1.57 8.25 0.47 -5.01 115.22 116.39 2jan n HIS 309 Ca -0.31 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.13 2jan n HIS 309 Cb 0.80 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.91 2jan n HIS 309 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jan n GLY 310 N 0.56 -1.69 0.28 -1.41 0.00 -0.18 -4.22 105.19 98.53 2jan n GLY 310 Ca 0.06 -1.54 -0.05 0.00 0.00 0.00 0.00 46.02 44.49 2jan n GLY 310 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jan h GLU 311 N 0.00 0.93 0.24 1.61 4.39 -1.86 -2.85 114.58 117.04 2jan h GLU 311 Ca 0.00 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2jan h GLU 311 Cb 0.00 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.44 2jan h GLU 311 CO 0.00 0.62 -0.12 0.00 -1.16 0.00 0.00 179.01 178.35 2jan h ALA 312 N 1.27 -0.33 -0.16 3.43 0.00 -1.97 0.18 119.26 121.68 2jan h ALA 312 Ca 0.27 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2jan h ALA 312 Cb -0.10 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2jan h ALA 312 CO -0.06 -0.66 -0.04 0.00 0.00 0.00 0.00 179.25 178.49 2jan h ALA 313 N 0.38 1.65 -0.15 0.00 0.00 -1.72 -1.01 119.26 118.41 2jan h ALA 313 Ca -0.03 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2jan h ALA 313 Cb 0.28 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2jan h ALA 313 CO 0.05 0.26 -0.18 1.15 0.00 0.00 0.00 179.25 180.53 2jan h THR 314 N 0.23 1.35 -0.54 0.00 2.02 -1.20 -1.74 112.91 113.03 2jan h THR 314 Ca 0.05 -1.38 0.11 0.00 0.77 0.00 0.00 66.41 65.96 2jan h THR 314 Cb 0.22 1.91 -0.09 0.00 -1.74 0.00 0.00 68.15 68.44 2jan h THR 314 CO 0.01 0.41 -0.03 0.00 0.37 0.00 0.00 175.52 176.27 2jan h ALA 315 N 0.59 0.48 -0.23 6.16 0.00 -0.11 -1.44 119.26 124.72 2jan h ALA 315 Ca 0.02 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2jan h ALA 315 Cb 0.73 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2jan h ALA 315 CO 0.04 -0.40 0.15 0.00 0.00 0.00 0.00 179.25 179.04 2jan h ALA 316 N 1.50 0.29 -0.25 0.00 0.00 -1.14 -2.10 119.26 117.56 2jan h ALA 316 Ca 0.27 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 2jan h ALA 316 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2jan h ALA 316 CO -0.48 -0.24 -0.13 0.28 0.00 0.00 0.00 179.25 178.67 2jan h VAL 317 N 0.30 1.22 -0.14 0.00 2.07 -0.85 -0.30 116.25 118.55 2jan h VAL 317 Ca 0.09 -0.97 -0.11 0.00 0.82 0.00 0.00 66.70 66.53 2jan h VAL 317 Cb -0.03 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2jan h VAL 317 CO -0.02 0.31 -0.33 -0.33 0.02 0.00 0.00 177.57 177.22 2jan h GLU 318 N 0.39 0.47 -0.45 1.57 5.08 -1.20 -2.65 114.58 117.79 2jan h GLU 318 Ca 0.07 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 2jan h GLU 318 Cb 0.47 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2jan h GLU 318 CO 0.03 0.93 0.25 0.45 -1.00 0.00 0.00 179.01 179.67 2jan h HIS 319 N 0.08 0.62 0.24 4.33 3.86 -1.09 -2.08 115.15 121.11 2jan h HIS 319 Ca -0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2jan h HIS 319 Cb 0.94 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 29.19 2jan h HIS 319 CO 0.10 0.46 -0.23 0.00 0.86 0.00 0.00 177.93 179.13 2jan h ALA 320 N 1.10 -0.47 0.00 2.45 0.00 -1.11 0.25 119.26 121.48 2jan h ALA 320 Ca 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jan h ALA 320 Cb 0.05 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2jan h ALA 320 CO -0.03 -0.79 0.00 -1.13 0.00 0.00 0.00 179.25 177.30 2jan n SER 321 N -5.35 0.66 -0.09 0.00 3.41 -1.00 -0.21 113.62 111.04 2jan n SER 321 Ca -0.08 0.70 -0.18 0.00 -0.26 0.00 0.00 58.87 59.06 2jan n SER 321 Cb 0.26 -0.83 -0.11 0.00 -0.26 0.00 0.00 64.21 63.27 2jan n SER 321 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2jan h ARG 322 N 0.00 0.00 -0.43 4.33 3.08 -0.72 -3.39 114.38 117.25 2jan h ARG 322 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2jan h ARG 322 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2jan h ARG 322 CO 0.00 0.92 0.15 0.00 -1.07 0.00 0.00 179.97 179.97 2jan h ALA 323 N -0.35 1.46 0.00 0.04 0.00 -0.20 -1.51 119.26 118.70 2jan h ALA 323 Ca -0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2jan h ALA 323 Cb 1.12 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2jan h ALA 323 CO -0.12 0.41 -0.05 1.25 0.00 0.00 0.00 179.25 180.74 2jan h LEU 324 N 0.61 0.00 -4.27 0.00 5.85 -0.79 -2.39 115.31 114.32 2jan h LEU 324 Ca 0.15 0.00 -0.60 0.00 0.84 0.00 0.00 57.88 58.26 2jan h LEU 324 Cb 0.16 0.00 -0.40 0.00 0.37 0.00 0.00 40.66 40.80 2jan h LEU 324 CO -0.01 0.05 -0.43 0.49 -0.34 0.00 0.00 178.44 178.20 2jan n PHE 325 N -3.29 3.13 0.00 1.25 3.72 -1.16 -4.96 117.46 116.15 2jan n PHE 325 Ca -0.01 -2.72 0.00 0.00 -0.05 0.00 0.00 57.45 54.67 2jan n PHE 325 Cb 0.22 -0.40 0.00 0.00 -0.94 0.00 0.00 39.48 38.36 2jan n PHE 325 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jan n GLY 326 N -0.60 1.24 2.85 1.37 0.00 -0.90 -4.89 105.19 104.26 2jan n GLY 326 Ca 0.44 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 2jan n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jan n ARG 327 N 0.00 2.43 0.00 1.61 1.74 -0.58 -4.70 116.66 117.16 2jan n ARG 327 Ca 0.00 -2.36 0.00 0.00 -0.77 0.00 0.00 57.85 54.72 2jan n ARG 327 Cb 0.00 -3.17 0.00 0.00 -1.02 0.00 0.00 32.46 28.27 2jan n ARG 327 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jan n GLY 328 N 4.24 3.05 3.50 -0.13 0.00 -1.25 -3.30 105.19 111.29 2jan n GLY 328 Ca 0.51 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 44.33 2jan n GLY 328 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jan s GLU 329 N -1.97 3.46 0.00 1.61 8.01 -1.26 -4.46 118.70 124.09 2jan s GLU 329 Ca 0.00 -0.66 0.27 0.00 0.01 0.00 0.00 54.97 54.59 2jan s GLU 329 Cb 0.00 -3.72 1.30 0.00 -4.31 0.00 0.00 34.13 27.40 2jan s GLU 329 CO 0.00 -0.43 1.87 1.47 0.01 0.00 0.00 175.26 178.19 2jan n LEU 330 N 5.06 0.81 0.17 1.80 -0.00 -1.26 -3.12 117.00 120.45 2jan n LEU 330 Ca -0.13 -0.29 0.01 0.00 -0.00 0.00 0.00 56.01 55.60 2jan n LEU 330 Cb 0.50 -0.02 0.30 0.00 -0.00 0.00 0.00 43.42 44.20 2jan n LEU 330 CO 0.36 0.15 0.67 0.00 -0.00 0.00 0.00 177.39 178.56 2jan h ALA 331 N 4.07 1.27 0.00 1.47 0.00 -1.98 -3.19 119.26 120.90 2jan h ALA 331 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2jan h ALA 331 Cb 0.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2jan h ALA 331 CO 0.00 0.55 0.00 0.07 0.00 0.00 0.00 179.25 179.87 2jan h ARG 332 N 0.02 0.00 -6.96 0.00 -0.00 -1.99 -3.48 114.38 101.97 2jan h ARG 332 Ca -0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 59.98 59.46 2jan h ARG 332 Cb 0.77 0.00 0.08 0.00 -0.00 0.00 0.00 29.97 30.82 2jan h ARG 332 CO 0.06 0.00 0.57 -0.51 -0.00 0.00 0.00 179.97 180.08 2jan s LEU 333 N -6.16 4.15 0.13 0.08 1.43 -1.21 -4.98 118.68 112.12 2jan s LEU 333 Ca 0.04 2.54 -0.31 0.00 -1.03 0.00 0.00 54.13 55.37 2jan s LEU 333 Cb 0.07 -4.01 -0.09 0.00 0.03 0.00 0.00 46.19 42.19 2jan s LEU 333 CO 0.60 -0.88 1.60 -0.62 0.23 0.00 0.00 176.35 177.29 2jan s ASP 334 N -0.93 6.59 0.21 2.29 2.15 -1.26 -4.93 116.67 120.79 2jan s ASP 334 Ca 0.59 2.57 -0.09 0.00 0.43 0.00 0.00 52.55 56.05 2jan s ASP 334 Cb -0.35 -2.58 0.32 0.00 -0.30 0.00 0.00 42.92 40.00 2jan s ASP 334 CO 0.44 -0.85 1.72 1.05 -0.17 0.00 0.00 175.17 177.37 2jan h GLU 335 N 7.41 0.34 -0.67 4.34 4.11 -1.99 -1.04 114.58 127.08 2jan h GLU 335 Ca -0.43 -0.02 0.12 0.00 0.07 0.00 0.00 59.36 59.10 2jan h GLU 335 Cb 1.20 -0.08 -0.09 0.00 0.50 0.00 0.00 28.75 30.29 2jan h GLU 335 CO 0.92 0.22 0.22 0.00 0.07 0.00 0.00 179.01 180.44 2jan h ALA 336 N 1.47 0.87 0.02 1.06 0.00 -2.00 0.16 119.26 120.83 2jan h ALA 336 Ca 0.33 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 2jan h ALA 336 Cb 0.46 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2jan h ALA 336 CO -0.37 -0.24 -0.01 1.15 0.00 0.00 0.00 179.25 179.79 2jan h THR 337 N 0.37 1.29 -0.98 0.00 2.02 -1.76 -2.95 112.91 110.90 2jan h THR 337 Ca 0.35 -0.94 0.12 0.00 0.77 0.00 0.00 66.41 66.71 2jan h THR 337 Cb 0.51 1.92 -0.09 0.00 -1.74 0.00 0.00 68.15 68.76 2jan h THR 337 CO -0.38 0.24 0.60 0.25 0.37 0.00 0.00 175.52 176.60 2jan h LEU 338 N -0.43 0.87 0.60 2.58 6.46 -0.73 0.15 115.31 124.81 2jan h LEU 338 Ca -0.00 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.79 2jan h LEU 338 Cb 0.42 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.22 2jan h LEU 338 CO 0.00 0.45 -0.38 0.00 -0.62 0.00 0.00 178.44 177.90 2jan h ALA 339 N 1.54 -0.94 -0.28 1.25 0.00 -0.99 -1.20 119.26 118.64 2jan h ALA 339 Ca 0.49 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2jan h ALA 339 Cb 0.51 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 2jan h ALA 339 CO -0.28 -1.05 -0.21 0.00 0.00 0.00 0.00 179.25 177.72 2jan h ALA 340 N -0.60 -0.03 -0.60 0.00 0.00 -1.22 0.74 119.26 117.54 2jan h ALA 340 Ca -0.07 0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.06 2jan h ALA 340 Cb 0.75 0.46 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 2jan h ALA 340 CO 0.07 -0.62 -0.02 0.00 0.00 0.00 0.00 179.25 178.68 2jan h ALA 341 N 0.94 0.56 0.00 0.00 0.00 -0.55 -1.60 119.26 118.61 2jan h ALA 341 Ca 0.15 0.19 -0.15 0.00 0.00 0.00 0.00 54.91 55.11 2jan h ALA 341 Cb 0.42 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2jan h ALA 341 CO -0.39 -0.40 -0.69 -0.07 0.00 0.00 0.00 179.25 177.69 2jan h LEU 342 N 0.10 0.00 -1.16 0.00 3.38 -0.82 -3.21 115.31 113.59 2jan h LEU 342 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2jan h LEU 342 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2jan h LEU 342 CO -0.53 0.69 0.00 0.03 0.09 0.00 0.00 178.44 178.72 2jan h ARG 343 N 0.00 0.00 -0.05 1.13 3.08 0.13 -2.66 114.38 116.01 2jan h ARG 343 Ca -0.01 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 2jan h ARG 343 Cb 1.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.47 2jan h ARG 343 CO 0.09 0.00 -0.21 0.93 -1.07 0.00 0.00 179.97 179.71 2jan h GLU 344 N 0.00 0.22 0.00 0.04 4.39 -1.47 -3.46 114.58 114.30 2jan h GLU 344 Ca 0.00 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.50 2jan h GLU 344 Cb 0.38 0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.08 2jan h GLU 344 CO 0.00 0.82 0.01 0.25 -1.16 0.00 0.00 179.01 178.94 2jan n THR 345 N -4.55 0.00 -3.27 1.13 -2.24 -1.00 -5.01 114.28 99.33 2jan n THR 345 Ca -0.08 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 2jan n THR 345 Cb 0.44 -1.58 -0.08 0.00 -2.10 0.00 0.00 70.33 67.00 2jan n THR 345 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2jan s THR 346 N -1.12 5.04 -0.20 4.28 -1.32 -1.26 -4.98 115.64 116.07 2jan s THR 346 Ca 0.04 0.17 -0.05 0.00 -1.21 0.00 0.00 61.69 60.63 2jan s THR 346 Cb -0.00 -3.96 -0.03 0.00 -1.51 0.00 0.00 72.50 67.00 2jan s THR 346 CO 0.03 -0.25 0.01 0.54 -2.21 0.00 0.00 174.62 172.73 2jan s VAL 347 N 2.32 4.01 -0.25 5.08 0.11 -1.26 -3.24 120.40 127.16 2jan s VAL 347 Ca 0.17 -0.29 -0.15 0.00 -2.93 0.00 0.00 61.98 58.77 2jan s VAL 347 Cb -0.16 -2.82 -0.04 0.00 -1.53 0.00 0.00 36.38 31.84 2jan s VAL 347 CO 0.13 0.42 0.38 0.00 -3.33 0.00 0.00 175.10 172.70 2jan s ALA 348 N 1.00 3.57 -0.42 1.54 0.00 0.24 -4.95 121.76 122.75 2jan s ALA 348 Ca 0.02 -0.74 -0.22 0.00 0.00 0.00 0.00 51.96 51.02 2jan s ALA 348 Cb -0.14 -2.68 0.02 0.00 0.00 0.00 0.00 23.12 20.31 2jan s ALA 348 CO 0.02 -0.56 0.69 -1.21 0.00 0.00 0.00 175.76 174.71 2jan s GLU 349 N 1.86 3.44 -1.09 0.00 2.02 -1.26 -1.62 118.70 122.05 2jan s GLU 349 Ca 0.16 -0.15 -0.16 0.00 0.02 0.00 0.00 54.97 54.84 2jan s GLU 349 Cb -0.15 -3.91 0.16 0.00 0.10 0.00 0.00 34.13 30.33 2jan s GLU 349 CO 0.09 -0.97 1.30 -1.17 0.02 0.00 0.00 175.26 174.53 2jan s LEU 350 N 2.96 5.09 0.94 1.80 2.96 0.08 -4.91 118.68 127.59 2jan s LEU 350 Ca 0.26 -2.62 -0.10 0.00 -0.22 0.00 0.00 54.13 51.44 2jan s LEU 350 Cb -0.13 -2.40 0.16 0.00 0.50 0.00 0.00 46.19 44.31 2jan s LEU 350 CO 0.19 -0.86 1.12 2.29 -1.32 0.00 0.00 176.35 177.77 2jan n LYS 351 N 5.95 -0.59 -2.12 1.98 0.00 -1.26 -2.13 118.16 119.99 2jan n LYS 351 Ca 0.31 -0.11 -0.42 0.00 -0.00 0.00 0.00 58.31 58.10 2jan n LYS 351 Cb 0.45 -2.35 -0.03 0.00 -0.00 0.00 0.00 35.03 33.10 2jan n LYS 351 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2jan s PRO 352 N -4.60 4.32 0.00 -1.58 0.04 -1.26 -3.36 135.00 128.56 2jan s PRO 352 Ca 0.67 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.87 2jan s PRO 352 Cb -0.23 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.13 2jan s PRO 352 CO 0.59 -0.39 0.00 0.41 0.04 0.00 0.00 177.00 177.65 2jan n GLY 353 N 2.81 3.09 3.66 0.56 0.00 -1.26 -5.07 105.19 108.99 2jan n GLY 353 Ca 0.09 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 2jan n GLY 353 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jan n SER 354 N 1.01 0.51 -4.77 1.61 3.41 -1.21 -4.88 113.62 109.29 2jan n SER 354 Ca 0.00 0.50 -0.39 0.00 -0.26 0.00 0.00 58.87 58.72 2jan n SER 354 Cb 0.00 -1.47 -0.01 0.00 -0.26 0.00 0.00 64.21 62.47 2jan n SER 354 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 2jan s PRO 355 N -4.29 3.96 -0.17 4.33 0.02 -1.26 -4.96 135.00 132.62 2jan s PRO 355 Ca 0.69 2.08 -0.11 0.00 0.02 0.00 0.00 61.00 63.69 2jan s PRO 355 Cb -0.26 -2.72 -0.22 0.00 0.02 0.00 0.00 34.50 31.32 2jan s PRO 355 CO 0.55 -0.47 0.19 -0.25 -0.33 0.00 0.00 177.00 176.69 2jan n ASP 356 N 0.08 2.02 -3.95 2.53 8.00 -1.26 -4.73 116.55 119.24 2jan n ASP 356 Ca 0.04 0.24 -0.45 0.00 0.71 0.00 0.00 54.79 55.33 2jan n ASP 356 Cb 0.44 -0.84 -0.04 0.00 -0.02 0.00 0.00 41.12 40.66 2jan n ASP 356 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jan n GLY 357 N 1.80 -1.23 0.34 0.44 0.00 -1.26 -4.54 105.19 100.74 2jan n GLY 357 Ca -0.35 0.40 0.27 0.00 0.00 0.00 0.00 46.02 46.33 2jan n GLY 357 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2jan h ILE 358 N 1.35 0.23 -0.49 -0.61 6.09 -1.30 0.14 117.51 122.92 2jan h ILE 358 Ca -0.30 -0.08 -0.11 0.00 -1.37 0.00 0.00 64.86 62.99 2jan h ILE 358 Cb 1.28 -0.03 -0.02 0.00 0.47 0.00 0.00 36.82 38.52 2jan h ILE 358 CO 0.53 0.04 -0.14 0.58 -3.07 0.00 0.00 178.15 176.09 2jan h VAL 359 N 0.24 1.27 -0.57 2.19 2.07 -1.85 -1.85 116.25 117.74 2jan h VAL 359 Ca 0.76 -1.27 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 2jan h VAL 359 Cb 1.86 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.65 2jan h VAL 359 CO -0.62 0.44 0.21 0.44 0.02 0.00 0.00 177.57 178.06 2jan h ASP 360 N 0.82 0.81 -0.51 0.57 3.32 -1.04 -2.57 116.42 117.83 2jan h ASP 360 Ca 0.13 -0.19 -0.10 0.00 0.02 0.00 0.00 57.03 56.89 2jan h ASP 360 Cb 0.68 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 2jan h ASP 360 CO 0.05 0.78 -0.06 -0.07 -1.72 0.00 0.00 179.24 178.22 2jan h LEU 361 N 0.80 0.93 -0.27 1.55 3.38 -1.32 0.19 115.31 120.57 2jan h LEU 361 Ca 0.19 -0.34 0.06 0.00 0.09 0.00 0.00 57.88 57.88 2jan h LEU 361 Cb 0.24 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 2jan h LEU 361 CO -0.01 1.05 -0.14 -0.07 0.09 0.00 0.00 178.44 179.36 2jan h LEU 362 N 0.80 -0.45 -1.02 1.67 3.38 -1.25 0.16 115.31 118.59 2jan h LEU 362 Ca 0.14 0.11 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 2jan h LEU 362 Cb 0.61 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 2jan h LEU 362 CO 0.04 -0.17 -0.30 0.58 0.09 0.00 0.00 178.44 178.67 2jan h VAL 363 N -0.10 1.27 -0.45 1.22 2.07 -1.23 -2.47 116.25 116.55 2jan h VAL 363 Ca 0.14 -1.30 -0.11 0.00 0.82 0.00 0.00 66.70 66.26 2jan h VAL 363 Cb 0.32 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2jan h VAL 363 CO -0.34 0.40 -0.16 0.00 0.02 0.00 0.00 177.57 177.49 2jan h ALA 364 N 1.40 0.86 -0.01 1.67 0.00 -0.03 -3.27 119.26 119.88 2jan h ALA 364 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2jan h ALA 364 Cb 0.68 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2jan h ALA 364 CO 0.05 0.64 -0.20 -1.13 0.00 0.00 0.00 179.25 178.61 2jan n SER 365 N -4.13 1.33 0.00 0.00 3.41 0.50 -4.67 113.62 110.06 2jan n SER 365 Ca 0.01 -1.16 0.00 0.00 -0.26 0.00 0.00 58.87 57.46 2jan n SER 365 Cb 0.41 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2jan n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jan n GLY 366 N 1.30 1.43 0.23 5.00 0.00 -1.04 -4.76 105.19 107.36 2jan n GLY 366 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 2jan n GLY 366 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jan h LEU 367 N 0.00 0.42 -8.33 0.99 3.38 -1.76 -3.42 115.31 106.58 2jan h LEU 367 Ca 0.00 -0.14 -0.46 0.00 0.09 0.00 0.00 57.88 57.38 2jan h LEU 367 Cb 0.00 -0.11 -0.25 0.00 0.09 0.00 0.00 40.66 40.38 2jan h LEU 367 CO 0.00 0.67 -0.80 -0.44 0.09 0.00 0.00 178.44 177.97 2jan s SER 368 N -6.83 1.71 0.23 -0.43 0.01 -1.12 -5.03 113.70 102.25 2jan s SER 368 Ca -0.06 -0.44 0.14 0.00 1.31 0.00 0.00 55.95 56.90 2jan s SER 368 Cb 0.14 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2jan s SER 368 CO 0.78 0.06 1.33 0.00 0.41 0.00 0.00 173.24 175.82 2jan h ALA 369 N 5.02 0.64 -2.28 1.44 0.00 -1.88 -3.34 119.26 118.85 2jan h ALA 369 Ca -0.38 -0.56 -0.27 0.00 0.00 0.00 0.00 54.91 53.70 2jan h ALA 369 Cb 1.18 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.79 2jan h ALA 369 CO 0.44 0.74 -0.67 0.45 0.00 0.00 0.00 179.25 180.21 2jan s SER 370 N -6.38 1.18 0.44 0.00 0.15 -1.26 -5.02 113.70 102.80 2jan s SER 370 Ca 0.03 -1.13 0.23 0.00 0.70 0.00 0.00 55.95 55.77 2jan s SER 370 Cb 0.08 0.12 0.97 0.00 -1.71 0.00 0.00 66.02 65.47 2jan s SER 370 CO 0.76 -0.54 1.86 0.07 1.20 0.00 0.00 173.24 176.59 2jan h LYS 371 N 2.77 0.00 0.00 5.44 -0.00 -1.91 -1.85 116.57 121.02 2jan h LYS 371 Ca -0.36 0.00 -0.12 0.00 -0.00 0.00 0.00 60.65 60.17 2jan h LYS 371 Cb 1.19 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.41 2jan h LYS 371 CO 0.63 0.25 -0.76 0.78 -0.00 0.00 0.00 179.45 180.35 2jan h GLY 372 N 1.76 0.00 -0.22 0.07 0.00 -1.97 -3.19 103.07 99.52 2jan h GLY 372 Ca -0.00 0.00 0.27 0.00 0.00 0.00 0.00 47.33 47.60 2jan h GLY 372 CO 0.03 0.00 0.65 0.00 0.00 0.00 0.00 176.54 177.22 2jan h ALA 373 N -0.54 2.09 0.88 3.60 0.00 -1.96 0.36 119.26 123.68 2jan h ALA 373 Ca -0.18 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2jan h ALA 373 Cb 0.98 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.82 2jan h ALA 373 CO -0.11 -0.54 -0.42 0.00 0.00 0.00 0.00 179.25 178.17 2jan h ALA 374 N 1.67 -1.31 -0.94 0.00 0.00 -1.50 -1.61 119.26 115.56 2jan h ALA 374 Ca 0.64 -0.26 0.28 0.00 0.00 0.00 0.00 54.91 55.57 2jan h ALA 374 Cb 1.48 0.46 -0.15 0.00 0.00 0.00 0.00 17.79 19.58 2jan h ALA 374 CO -0.39 -1.22 0.38 0.00 0.00 0.00 0.00 179.25 178.02 2jan h ARG 375 N -1.19 0.23 0.43 0.00 -0.00 -0.47 -0.87 114.38 112.52 2jan h ARG 375 Ca -0.12 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.98 59.33 2jan h ARG 375 Cb 0.90 -0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.82 2jan h ARG 375 CO 0.20 0.15 -0.24 0.00 0.00 0.00 0.00 179.97 180.09 2jan h ARG 376 N 0.24 -0.59 -0.52 0.04 3.08 -0.48 -3.23 114.38 112.91 2jan h ARG 376 Ca 0.65 0.04 0.15 0.00 0.07 0.00 0.00 59.98 60.89 2jan h ARG 376 Cb 1.41 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.57 2jan h ARG 376 CO -0.65 -0.39 0.40 1.79 -1.07 0.00 0.00 179.97 180.04 2jan h THR 377 N -0.61 0.65 -0.93 2.04 1.35 -0.17 0.40 112.91 115.63 2jan h THR 377 Ca -0.06 0.00 0.20 0.00 -0.55 0.00 0.00 66.41 66.00 2jan h THR 377 Cb 0.48 0.71 -0.08 0.00 -1.73 0.00 0.00 68.15 67.54 2jan h THR 377 CO 0.08 0.00 0.60 0.40 -0.25 0.00 0.00 175.52 176.35 2jan h ILE 378 N 0.00 0.70 -3.70 6.82 2.04 -1.31 -2.87 117.51 119.20 2jan h ILE 378 Ca 0.25 -0.18 -0.50 0.00 1.00 0.00 0.00 64.86 65.43 2jan h ILE 378 Cb 1.05 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2jan h ILE 378 CO -0.00 0.09 0.08 -1.00 0.00 0.00 0.00 178.15 177.33 2jan s HIS 379 N -5.55 3.39 0.00 1.37 3.76 0.13 -3.44 115.29 114.95 2jan s HIS 379 Ca -0.09 1.16 0.00 0.00 -0.15 0.00 0.00 55.06 55.98 2jan s HIS 379 Cb 0.23 -2.50 0.00 0.00 1.11 0.00 0.00 32.58 31.43 2jan s HIS 379 CO 0.79 0.07 0.00 0.39 -0.85 0.00 0.00 174.74 175.14 2jan n GLU 380 N -0.52 0.00 0.00 1.40 1.02 -1.26 -3.79 120.64 117.49 2jan n GLU 380 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2jan n GLU 380 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.95 2jan n GLU 380 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jan n GLY 381 N 0.00 3.44 0.53 0.62 0.00 -1.26 -5.09 105.19 103.43 2jan n GLY 381 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2jan n GLY 381 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jan n GLY 382 N 0.00 -3.36 3.87 -0.02 0.00 -1.08 -4.96 105.19 99.64 2jan n GLY 382 Ca 0.00 -1.09 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 2jan n GLY 382 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jan s VAL 383 N -3.66 4.78 -0.05 1.61 -7.23 -1.26 -4.62 120.40 109.97 2jan s VAL 383 Ca 0.00 0.67 0.06 0.00 -1.81 0.00 0.00 61.98 60.91 2jan s VAL 383 Cb 0.00 -3.69 -0.01 0.00 0.56 0.00 0.00 36.38 33.24 2jan s VAL 383 CO 0.00 -0.38 -0.25 -0.44 -0.31 0.00 0.00 175.10 173.72 2jan s SER 384 N -2.84 3.09 -0.36 4.85 0.01 0.14 -1.49 113.70 117.10 2jan s SER 384 Ca 0.51 -0.50 -0.05 0.00 1.31 0.00 0.00 55.95 57.23 2jan s SER 384 Cb -0.10 -0.78 0.07 0.00 0.21 0.00 0.00 66.02 65.42 2jan s SER 384 CO 0.26 0.26 0.13 -0.69 0.41 0.00 0.00 173.24 173.61 2jan s VAL 385 N -0.23 3.50 -1.04 3.43 1.01 -0.56 -1.56 120.40 124.95 2jan s VAL 385 Ca -0.01 -1.49 -0.00 0.00 0.00 0.00 0.00 61.98 60.47 2jan s VAL 385 Cb -0.13 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2jan s VAL 385 CO 0.03 -0.35 0.87 0.59 0.00 0.00 0.00 175.10 176.24 2jan n ASN 386 N 4.72 -2.18 -1.94 3.32 3.02 0.57 -2.98 115.26 119.78 2jan n ASN 386 Ca -0.10 -0.53 -0.20 0.00 -0.03 0.00 0.00 54.58 53.72 2jan n ASN 386 Cb 0.43 -4.51 -0.05 0.00 -0.61 0.00 0.00 39.78 35.05 2jan n ASN 386 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2jan n ASN 387 N -2.83 -5.64 -4.17 6.41 3.02 -1.26 -4.99 115.26 105.81 2jan n ASN 387 Ca -0.24 0.25 -0.34 0.00 -0.03 0.00 0.00 54.58 54.22 2jan n ASN 387 Cb 0.64 -4.80 -0.15 0.00 -0.61 0.00 0.00 39.78 34.86 2jan n ASN 387 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2jan s ILE 388 N -2.89 2.50 -0.43 2.41 1.01 -1.16 -5.05 121.20 117.59 2jan s ILE 388 Ca 0.00 -0.96 -0.28 0.00 0.00 0.00 0.00 60.65 59.41 2jan s ILE 388 Cb 0.00 -2.17 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 2jan s ILE 388 CO 0.00 0.37 1.85 0.00 0.00 0.00 0.00 174.94 177.16 2jan s ARG 389 N 1.31 3.04 -0.20 2.79 1.04 -1.26 -1.50 118.95 124.17 2jan s ARG 389 Ca 0.02 1.16 -0.24 0.00 -1.04 0.00 0.00 55.73 55.63 2jan s ARG 389 Cb -0.15 -4.28 -0.01 0.00 -2.04 0.00 0.00 34.95 28.47 2jan s ARG 389 CO -0.08 -2.21 0.78 0.08 -0.04 0.00 0.00 175.30 173.82 2jan s VAL 390 N 7.87 4.90 -0.09 4.99 1.01 -0.56 -4.93 120.40 133.59 2jan s VAL 390 Ca 0.76 1.50 0.03 0.00 0.00 0.00 0.00 61.98 64.27 2jan s VAL 390 Cb -0.19 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2jan s VAL 390 CO 0.29 0.02 0.10 0.47 0.00 0.00 0.00 175.10 175.97 2jan n ASP 391 N 5.44 1.14 -4.88 3.32 8.00 -1.26 -4.35 116.55 123.96 2jan n ASP 391 Ca 0.03 -0.43 -0.35 0.00 0.71 0.00 0.00 54.79 54.76 2jan n ASP 391 Cb 0.49 1.03 -0.05 0.00 -0.02 0.00 0.00 41.12 42.56 2jan n ASP 391 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2jan s ASN 392 N -1.50 6.55 -0.06 -2.24 3.84 -1.26 -4.95 114.94 115.33 2jan s ASN 392 Ca 0.01 0.65 -0.21 0.00 0.21 0.00 0.00 52.86 53.52 2jan s ASN 392 Cb 0.02 -2.13 -0.30 0.00 -0.55 0.00 0.00 41.25 38.29 2jan s ASN 392 CO 0.11 0.24 0.82 -0.08 -2.79 0.00 0.00 177.10 175.39 2jan h GLU 393 N 3.98 0.29 -0.55 0.43 4.81 -1.97 -3.25 114.58 118.32 2jan h GLU 393 Ca -0.50 -0.49 0.00 0.00 -0.13 0.00 0.00 59.36 58.24 2jan h GLU 393 Cb 1.20 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2jan h GLU 393 CO 0.66 1.24 0.00 0.39 -0.73 0.00 0.00 179.01 180.56 2jan n GLU 394 N -4.08 1.43 -1.63 1.92 -0.58 -1.26 -4.46 120.64 111.98 2jan n GLU 394 Ca -0.16 -0.43 -0.57 0.00 -0.42 0.00 0.00 57.16 55.58 2jan n GLU 394 Cb 0.84 -1.37 -0.07 0.00 -0.57 0.00 0.00 31.44 30.28 2jan n GLU 394 CO 0.00 0.00 0.00 1.87 -0.48 0.00 0.00 177.13 178.52 2jan n TRP 395 N -0.03 1.52 -4.45 -0.32 -0.00 -1.23 -4.81 117.44 108.11 2jan n TRP 395 Ca 0.04 0.75 -0.30 0.00 -0.00 0.00 0.00 57.50 57.99 2jan n TRP 395 Cb 0.25 -2.31 -0.12 0.00 -0.00 0.00 0.00 31.31 29.13 2jan n TRP 395 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2jan s VAL 396 N 1.53 2.86 -0.23 5.87 0.11 -1.26 -1.00 120.40 128.28 2jan s VAL 396 Ca 0.92 -1.35 -0.29 0.00 -2.93 0.00 0.00 61.98 58.33 2jan s VAL 396 Cb -1.11 -2.27 -0.01 0.00 -1.53 0.00 0.00 36.38 31.46 2jan s VAL 396 CO 0.58 0.20 1.39 -2.16 -3.33 0.00 0.00 175.10 171.79 2jan s PRO 397 N -1.84 3.99 0.81 1.54 0.04 -1.26 -4.99 135.00 133.29 2jan s PRO 397 Ca 0.17 1.52 -0.10 0.00 0.04 0.00 0.00 61.00 62.62 2jan s PRO 397 Cb -0.11 -3.89 0.08 0.00 0.04 0.00 0.00 34.50 30.62 2jan s PRO 397 CO 0.08 -1.04 1.11 1.14 0.04 0.00 0.00 177.00 178.33 2jan s GLN 398 N 4.11 1.93 0.20 4.56 -2.07 -1.26 -4.96 119.66 122.17 2jan s GLN 398 Ca 0.61 1.28 -0.10 0.00 -1.82 0.00 0.00 55.36 55.33 2jan s GLN 398 Cb -0.21 -1.85 0.13 0.00 -1.09 0.00 0.00 33.01 29.99 2jan s GLN 398 CO 0.23 -1.90 1.80 1.03 -1.32 0.00 0.00 175.29 175.12 2jan h SER 399 N -1.30 0.93 0.41 12.60 0.87 -1.99 -2.90 113.55 122.15 2jan h SER 399 Ca -0.43 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 2jan h SER 399 Cb 1.24 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 2jan h SER 399 CO 0.49 0.79 0.00 -1.54 -0.53 0.00 0.00 176.83 176.03 2jan n SER 400 N -4.44 0.00 0.11 6.23 3.41 -1.26 -3.19 113.62 114.48 2jan n SER 400 Ca 0.06 0.13 -0.20 0.00 -0.26 0.00 0.00 58.87 58.60 2jan n SER 400 Cb 0.12 -0.33 -0.13 0.00 -0.26 0.00 0.00 64.21 63.60 2jan n SER 400 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2jan h ASP 401 N 0.00 0.66 -2.24 4.04 5.19 -1.89 -3.46 116.42 118.72 2jan h ASP 401 Ca 0.00 -0.67 -0.58 0.00 -0.62 0.00 0.00 57.03 55.17 2jan h ASP 401 Cb 0.20 -0.21 0.03 0.00 0.18 0.00 0.00 39.33 39.53 2jan h ASP 401 CO 0.00 1.50 1.05 0.49 -3.12 0.00 0.00 179.24 179.16 2jan n PHE 402 N -3.67 2.42 -2.36 4.55 3.01 -1.19 -4.91 117.46 115.31 2jan n PHE 402 Ca -0.12 -0.02 -0.42 0.00 1.01 0.00 0.00 57.45 57.90 2jan n PHE 402 Cb 1.02 -2.67 -0.03 0.00 -0.01 0.00 0.00 39.48 37.79 2jan n PHE 402 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2jan s LEU 403 N 3.04 4.36 -0.95 4.37 1.02 0.14 -2.31 118.68 128.35 2jan s LEU 403 Ca 0.86 2.08 -0.01 0.00 0.02 0.00 0.00 54.13 57.08 2jan s LEU 403 Cb -0.61 -3.58 0.01 0.00 0.02 0.00 0.00 46.19 42.04 2jan s LEU 403 CO 0.44 -0.53 0.06 1.41 0.02 0.00 0.00 176.35 177.75 2jan n HIS 404 N 4.07 -1.54 -3.53 0.29 8.25 -1.26 -0.94 115.22 120.56 2jan n HIS 404 Ca 0.10 0.06 -0.26 0.00 -0.26 0.00 0.00 57.72 57.36 2jan n HIS 404 Cb 0.45 -2.57 0.01 0.00 1.12 0.00 0.00 29.99 29.00 2jan n HIS 404 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jan n GLY 405 N -0.82 -0.49 0.07 -1.41 0.00 -0.98 -4.79 105.19 96.78 2jan n GLY 405 Ca -0.11 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jan n GLY 405 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jan n ARG 406 N -4.08 0.00 -5.08 1.61 1.74 -0.11 -4.94 116.66 105.80 2jan n ARG 406 Ca -0.00 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.75 2jan n ARG 406 Cb 0.54 -0.36 -0.15 0.00 -1.02 0.00 0.00 32.46 31.47 2jan n ARG 406 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2jan s TRP 407 N -1.03 2.58 -0.09 -1.55 0.52 -0.36 -2.52 118.94 116.49 2jan s TRP 407 Ca 0.00 -0.61 -0.00 0.00 0.02 0.00 0.00 56.10 55.51 2jan s TRP 407 Cb 0.00 -1.67 -0.03 0.00 -1.15 0.00 0.00 33.47 30.63 2jan s TRP 407 CO 0.00 -0.14 -0.08 -0.51 0.02 0.00 0.00 176.95 176.24 2jan s LEU 408 N -0.14 3.08 -0.50 2.99 1.02 -0.72 0.23 118.68 124.65 2jan s LEU 408 Ca -0.03 -0.10 -0.14 0.00 0.02 0.00 0.00 54.13 53.87 2jan s LEU 408 Cb -0.14 -1.69 0.11 0.00 0.02 0.00 0.00 46.19 44.49 2jan s LEU 408 CO 0.04 0.29 0.43 -0.69 0.02 0.00 0.00 176.35 176.44 2jan s VAL 409 N -0.39 4.98 -0.07 -1.59 1.01 -1.26 -2.05 120.40 121.03 2jan s VAL 409 Ca 0.05 -1.41 -0.17 0.00 0.00 0.00 0.00 61.98 60.45 2jan s VAL 409 Cb -0.12 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 2jan s VAL 409 CO 0.02 -0.74 0.47 -0.76 0.00 0.00 0.00 175.10 174.09 2jan s LEU 410 N 1.56 4.35 -0.01 3.92 1.43 -0.39 -0.32 118.68 129.22 2jan s LEU 410 Ca 0.04 0.90 0.01 0.00 -1.03 0.00 0.00 54.13 54.05 2jan s LEU 410 Cb -0.27 -2.69 0.01 0.00 0.03 0.00 0.00 46.19 43.27 2jan s LEU 410 CO 0.03 0.11 -0.03 -0.60 0.23 0.00 0.00 176.35 176.10 2jan s ARG 411 N -0.00 0.34 -0.00 1.70 3.52 -0.60 -0.50 118.95 123.40 2jan s ARG 411 Ca 0.26 -0.06 -0.00 0.00 -0.13 0.00 0.00 55.73 55.79 2jan s ARG 411 Cb -0.16 -0.39 -0.00 0.00 -1.56 0.00 0.00 34.95 32.84 2jan s ARG 411 CO 0.12 -0.00 -0.01 -2.13 -0.81 0.00 0.00 175.30 172.47 2jan n ARG 412 N 3.44 0.02 0.00 5.12 0.63 -0.70 -0.68 116.66 124.48 2jan n ARG 412 Ca -0.18 0.23 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 2jan n ARG 412 Cb 0.55 -0.75 0.00 0.00 0.45 0.00 0.00 32.46 32.71 2jan n ARG 412 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jan n GLY 413 N 1.71 0.77 1.45 5.14 0.00 -1.26 -4.38 105.19 108.63 2jan n GLY 413 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2jan n GLY 413 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jan n LYS 414 N 0.00 0.96 0.00 1.61 4.01 -1.26 -4.88 118.16 118.60 2jan n LYS 414 Ca 0.00 -2.74 0.00 0.00 -0.51 0.00 0.00 58.31 55.06 2jan n LYS 414 Cb 0.00 -0.85 0.00 0.00 -0.51 0.00 0.00 35.03 33.67 2jan n LYS 414 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2jan n ARG 415 N -0.21 0.00 -3.23 1.97 1.74 -1.26 -5.00 116.66 110.68 2jan n ARG 415 Ca 0.13 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.81 2jan n ARG 415 Cb 0.96 -0.15 -0.07 0.00 -1.02 0.00 0.00 32.46 32.18 2jan n ARG 415 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2jan s SER 416 N -2.12 6.49 0.07 0.55 1.04 -1.26 -5.05 113.70 113.43 2jan s SER 416 Ca 0.00 0.60 0.04 0.00 0.48 0.00 0.00 55.95 57.06 2jan s SER 416 Cb 0.00 -2.29 -0.03 0.00 0.10 0.00 0.00 66.02 63.80 2jan s SER 416 CO 0.00 -0.26 -0.10 0.27 0.98 0.00 0.00 173.24 174.13 2jan s ILE 417 N 2.08 0.85 0.12 -1.02 -0.00 -1.26 -1.72 121.20 120.24 2jan s ILE 417 Ca 0.23 -1.36 -0.04 0.00 -0.00 0.00 0.00 60.65 59.48 2jan s ILE 417 Cb -0.16 -1.03 -0.03 0.00 -0.00 0.00 0.00 42.46 41.25 2jan s ILE 417 CO 0.09 -0.41 0.11 0.00 -0.00 0.00 0.00 174.94 174.74 2jan s ALA 418 N -1.77 0.42 0.06 2.27 0.00 0.34 -4.52 121.76 118.57 2jan s ALA 418 Ca -0.02 -1.15 0.08 0.00 0.00 0.00 0.00 51.96 50.87 2jan s ALA 418 Cb -0.07 0.69 -0.03 0.00 0.00 0.00 0.00 23.12 23.70 2jan s ALA 418 CO 0.01 -0.51 -0.21 0.20 0.00 0.00 0.00 175.76 175.25 2jan s GLY 419 N -2.98 1.54 -0.18 0.00 0.00 -1.20 -1.26 107.32 103.24 2jan s GLY 419 Ca 0.16 -1.26 -0.02 0.00 0.00 0.00 0.00 44.72 43.60 2jan s GLY 419 CO -0.03 -1.17 -0.09 0.14 0.00 0.00 0.00 173.10 171.95 2jan s VAL 420 N -0.93 3.20 -0.28 1.40 1.01 -0.87 0.82 120.40 124.74 2jan s VAL 420 Ca 0.14 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2jan s VAL 420 Cb -0.10 -2.40 0.06 0.00 0.00 0.00 0.00 36.38 33.94 2jan s VAL 420 CO 0.05 0.48 -0.07 -0.70 0.00 0.00 0.00 175.10 174.86 2jan s GLU 421 N 0.96 2.17 -0.01 2.72 2.12 -0.64 -1.75 118.70 124.27 2jan s GLU 421 Ca -0.01 -1.41 -0.30 0.00 0.36 0.00 0.00 54.97 53.61 2jan s GLU 421 Cb -0.15 -2.98 -0.05 0.00 0.26 0.00 0.00 34.13 31.21 2jan s GLU 421 CO -0.00 -0.63 1.37 -0.98 -0.54 0.00 0.00 175.26 174.48 2jan s ARG 422 N 1.10 4.29 0.00 4.30 1.70 -1.05 -0.74 118.95 128.56 2jan s ARG 422 Ca -0.06 1.92 0.25 0.00 -0.47 0.00 0.00 55.73 57.37 2jan s ARG 422 Cb -0.20 -3.56 0.40 0.00 -0.57 0.00 0.00 34.95 31.02 2jan s ARG 422 CO -0.05 -0.55 1.38 -0.89 -1.08 0.00 0.00 175.30 174.11