#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jpm s LYS 2 N 0.00 1.37 -0.29 2.12 2.20 -1.26 -3.12 119.74 120.76 1jpm s LYS 2 Ca 0.00 -0.87 -0.29 0.00 -0.36 0.00 0.00 55.97 54.45 1jpm s LYS 2 Cb 0.00 -1.44 -0.00 0.00 -1.51 0.00 0.00 37.83 34.88 1jpm s LYS 2 CO 0.00 0.37 1.32 0.42 -0.36 0.00 0.00 175.35 177.10 1jpm s ILE 3 N -0.74 4.12 -0.13 5.43 1.01 -0.38 -1.22 121.20 129.30 1jpm s ILE 3 Ca 0.07 1.27 0.18 0.00 0.00 0.00 0.00 60.65 62.17 1jpm s ILE 3 Cb -0.08 -4.12 -0.26 0.00 0.01 0.00 0.00 42.46 38.00 1jpm s ILE 3 CO 0.01 -0.44 0.43 2.30 0.00 0.00 0.00 174.94 177.24 1jpm n ILE 4 N 6.17 0.00 -3.66 2.92 -5.35 -0.22 -1.54 119.36 117.68 1jpm n ILE 4 Ca 0.15 -0.36 -0.14 0.00 -0.27 0.00 0.00 62.75 62.13 1jpm n ILE 4 Cb 0.46 0.22 -0.08 0.00 -1.74 0.00 0.00 39.64 38.50 1jpm n ILE 4 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1jpm s ARG 5 N -3.14 0.75 -0.15 6.28 3.52 -1.11 -4.93 118.95 120.15 1jpm s ARG 5 Ca -0.05 0.81 -0.01 0.00 -0.13 0.00 0.00 55.73 56.35 1jpm s ARG 5 Cb 0.12 0.36 0.04 0.00 -1.56 0.00 0.00 34.95 33.91 1jpm s ARG 5 CO 0.73 -0.10 -0.02 0.42 -0.81 0.00 0.00 175.30 175.52 1jpm s ILE 6 N 0.21 0.83 0.15 4.11 1.01 -1.26 -0.86 121.20 125.39 1jpm s ILE 6 Ca -0.01 -0.47 0.07 0.00 0.00 0.00 0.00 60.65 60.24 1jpm s ILE 6 Cb -0.04 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.30 1jpm s ILE 6 CO 0.01 0.07 -0.15 -1.83 0.00 0.00 0.00 174.94 173.04 1jpm s GLU 7 N 1.75 1.15 0.06 2.79 -1.05 -0.13 -4.99 118.70 118.28 1jpm s GLU 7 Ca 0.01 -1.35 0.04 0.00 -0.15 0.00 0.00 54.97 53.53 1jpm s GLU 7 Cb -0.15 -1.06 -0.03 0.00 -0.44 0.00 0.00 34.13 32.45 1jpm s GLU 7 CO -0.07 0.20 -0.12 0.95 0.95 0.00 0.00 175.26 177.17 1jpm s THR 8 N -2.25 0.96 -0.00 1.83 -4.23 -1.26 -0.79 115.64 109.89 1jpm s THR 8 Ca 0.13 -1.17 -0.04 0.00 -1.18 0.00 0.00 61.69 59.44 1jpm s THR 8 Cb -0.04 -0.93 -0.00 0.00 1.34 0.00 0.00 72.50 72.86 1jpm s THR 8 CO 0.05 -0.21 0.07 -0.94 -0.54 0.00 0.00 174.62 173.05 1jpm s SER 9 N -1.55 0.06 -0.02 3.99 1.04 -0.21 -4.95 113.70 112.06 1jpm s SER 9 Ca -0.03 -0.18 -0.08 0.00 0.48 0.00 0.00 55.95 56.14 1jpm s SER 9 Cb -0.09 0.17 -0.05 0.00 0.10 0.00 0.00 66.02 66.15 1jpm s SER 9 CO 0.02 -0.24 0.26 -0.13 0.98 0.00 0.00 173.24 174.12 1jpm s ARG 10 N -0.96 3.60 0.07 4.02 0.52 -1.26 -0.33 118.95 124.60 1jpm s ARG 10 Ca -0.11 -0.02 0.02 0.00 -0.52 0.00 0.00 55.73 55.11 1jpm s ARG 10 Cb -0.06 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.25 1jpm s ARG 10 CO 0.00 0.69 -0.08 0.96 0.02 0.00 0.00 175.30 176.89 1jpm s ILE 11 N -1.20 0.67 -0.26 1.52 -4.36 -0.75 -4.98 121.20 111.84 1jpm s ILE 11 Ca 0.24 -1.48 -0.04 0.00 -0.26 0.00 0.00 60.65 59.11 1jpm s ILE 11 Cb -0.13 -1.12 0.09 0.00 1.25 0.00 0.00 42.46 42.55 1jpm s ILE 11 CO 0.13 -0.58 0.14 0.00 0.24 0.00 0.00 174.94 174.86 1jpm s ALA 12 N -2.35 0.44 -0.28 2.27 0.00 -1.26 -1.93 121.76 118.65 1jpm s ALA 12 Ca 0.00 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.06 1jpm s ALA 12 Cb -0.03 -1.35 -0.05 0.00 0.00 0.00 0.00 23.12 21.69 1jpm s ALA 12 CO -0.02 -1.53 0.22 0.08 0.00 0.00 0.00 175.76 174.51 1jpm s VAL 13 N 2.14 5.29 0.21 0.00 1.01 -0.31 -4.81 120.40 123.94 1jpm s VAL 13 Ca 0.07 0.23 -0.32 0.00 0.00 0.00 0.00 61.98 61.96 1jpm s VAL 13 Cb -0.16 -3.56 -0.13 0.00 0.00 0.00 0.00 36.38 32.53 1jpm s VAL 13 CO -0.30 0.23 1.58 -0.81 0.00 0.00 0.00 175.10 175.81 1jpm n PRO 14 N 5.10 2.35 -2.39 2.72 -0.04 -1.26 -0.02 135.00 141.47 1jpm n PRO 14 Ca -0.13 0.84 -0.32 0.00 -0.04 0.00 0.00 63.50 63.85 1jpm n PRO 14 Cb 0.52 -2.61 -0.03 0.00 -0.04 0.00 0.00 33.50 31.34 1jpm n PRO 14 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1jpm s LEU 15 N 0.62 3.64 0.18 1.53 1.43 -0.68 -1.36 118.68 124.05 1jpm s LEU 15 Ca 0.74 1.63 -0.00 0.00 -1.03 0.00 0.00 54.13 55.46 1jpm s LEU 15 Cb -0.61 -4.52 0.08 0.00 0.03 0.00 0.00 46.19 41.18 1jpm s LEU 15 CO 0.40 -0.66 1.45 0.71 0.23 0.00 0.00 176.35 178.48 1jpm h THR 16 N 0.95 1.39 -2.49 5.49 1.35 -1.55 -3.42 112.91 114.63 1jpm h THR 16 Ca -0.47 -2.14 -0.46 0.00 -0.55 0.00 0.00 66.41 62.79 1jpm h THR 16 Cb 1.19 2.11 -0.37 0.00 -1.73 0.00 0.00 68.15 69.35 1jpm h THR 16 CO 0.61 0.64 -0.74 -1.59 -0.25 0.00 0.00 175.52 174.19 1jpm s LYS 17 N -3.62 0.33 1.04 4.72 -2.85 -1.26 -5.04 119.74 113.05 1jpm s LYS 17 Ca -0.05 -0.57 -0.14 0.00 -1.00 0.00 0.00 55.97 54.21 1jpm s LYS 17 Cb 0.11 -0.99 0.13 0.00 -2.06 0.00 0.00 37.83 35.02 1jpm s LYS 17 CO 0.83 -1.07 0.59 -0.35 0.10 0.00 0.00 175.35 175.45 1jpm n PRO 18 N 4.99 -1.14 -4.06 1.78 -0.04 -1.26 -5.08 135.00 130.19 1jpm n PRO 18 Ca -0.00 -0.30 -0.09 0.00 -0.04 0.00 0.00 63.50 63.08 1jpm n PRO 18 Cb 0.43 -1.99 -0.09 0.00 -0.04 0.00 0.00 33.50 31.80 1jpm n PRO 18 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1jpm s PHE 19 N -2.41 0.57 -0.06 0.54 -0.12 -1.08 -5.00 117.98 110.42 1jpm s PHE 19 Ca 0.61 -1.01 0.00 0.00 -0.05 0.00 0.00 56.93 56.48 1jpm s PHE 19 Cb -0.20 -0.33 -0.03 0.00 -0.63 0.00 0.00 43.02 41.83 1jpm s PHE 19 CO 0.65 -0.50 -0.03 -1.59 -0.05 0.00 0.00 175.22 173.69 1jpm s LYS 20 N -3.96 2.82 0.00 1.99 0.00 -1.26 -0.32 119.74 119.01 1jpm s LYS 20 Ca 0.14 -0.52 0.00 0.00 0.00 0.00 0.00 55.97 55.59 1jpm s LYS 20 Cb 0.07 -2.66 0.00 0.00 0.00 0.00 0.00 37.83 35.23 1jpm s LYS 20 CO -0.05 0.67 0.00 0.25 0.00 0.00 0.00 175.35 176.22 1jpm n THR 21 N 2.02 0.00 0.42 3.79 -2.24 0.64 -4.97 114.28 113.94 1jpm n THR 21 Ca -0.17 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.73 1jpm n THR 21 Cb 0.53 -0.75 0.19 0.00 -2.10 0.00 0.00 70.33 68.20 1jpm n THR 21 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jpm h ALA 22 N -0.67 0.75 0.00 6.98 0.00 -2.05 -3.38 119.26 120.89 1jpm h ALA 22 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1jpm h ALA 22 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1jpm h ALA 22 CO 0.00 0.00 -1.37 1.28 0.00 0.00 0.00 179.25 179.16 1jpm n LEU 23 N -2.46 1.00 0.00 0.00 4.77 -1.26 -5.12 117.00 113.93 1jpm n LEU 23 Ca 0.03 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1jpm n LEU 23 Cb 0.48 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1jpm n LEU 23 CO 0.35 0.29 0.00 -2.11 -1.33 0.00 0.00 177.39 174.59 1jpm n ARG 24 N -2.36 0.00 -4.07 3.23 1.85 -1.26 -5.14 116.66 108.90 1jpm n ARG 24 Ca -0.10 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.42 1jpm n ARG 24 Cb 0.66 0.00 -0.15 0.00 -1.05 0.00 0.00 32.46 31.91 1jpm n ARG 24 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1jpm s THR 25 N -2.32 2.34 -0.27 8.89 2.01 -1.26 -0.26 115.64 124.78 1jpm s THR 25 Ca 0.00 -0.91 -0.25 0.00 0.31 0.00 0.00 61.69 60.84 1jpm s THR 25 Cb 0.00 -2.04 -0.00 0.00 0.01 0.00 0.00 72.50 70.47 1jpm s THR 25 CO 0.00 0.47 0.85 -0.69 -0.69 0.00 0.00 174.62 174.56 1jpm s VAL 26 N 1.31 4.79 -0.19 3.82 1.01 0.57 -4.90 120.40 126.80 1jpm s VAL 26 Ca 0.04 1.51 0.14 0.00 0.00 0.00 0.00 61.98 63.67 1jpm s VAL 26 Cb -0.14 -4.16 -0.20 0.00 0.00 0.00 0.00 36.38 31.88 1jpm s VAL 26 CO -0.10 -0.16 0.38 -1.22 0.00 0.00 0.00 175.10 174.00 1jpm n TYR 27 N 6.15 0.00 -4.20 5.22 4.02 -1.26 -2.62 117.16 124.47 1jpm n TYR 27 Ca 0.06 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.82 1jpm n TYR 27 Cb 0.48 -0.23 -0.10 0.00 -0.02 0.00 0.00 39.34 39.46 1jpm n TYR 27 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1jpm s THR 28 N -2.79 0.95 -0.33 -0.72 -4.23 -1.26 -1.68 115.64 105.58 1jpm s THR 28 Ca -0.02 -1.86 -0.10 0.00 -1.18 0.00 0.00 61.69 58.53 1jpm s THR 28 Cb 0.09 -1.61 0.00 0.00 1.34 0.00 0.00 72.50 72.33 1jpm s THR 28 CO 0.58 -0.71 0.16 0.00 -0.54 0.00 0.00 174.62 174.11 1jpm s ALA 29 N -3.06 3.25 0.28 3.99 0.00 0.98 -4.84 121.76 122.35 1jpm s ALA 29 Ca 0.11 -1.49 -0.03 0.00 0.00 0.00 0.00 51.96 50.55 1jpm s ALA 29 Cb 0.01 -2.41 -0.05 0.00 0.00 0.00 0.00 23.12 20.68 1jpm s ALA 29 CO -0.01 -1.04 0.52 -1.21 0.00 0.00 0.00 175.76 174.02 1jpm s GLU 30 N 1.58 3.58 0.03 0.00 2.02 -1.26 -1.16 118.70 123.50 1jpm s GLU 30 Ca 0.04 -0.13 -0.27 0.00 0.02 0.00 0.00 54.97 54.62 1jpm s GLU 30 Cb -0.18 -2.69 0.08 0.00 0.10 0.00 0.00 34.13 31.45 1jpm s GLU 30 CO 0.06 0.24 0.74 -1.12 0.02 0.00 0.00 175.26 175.20 1jpm s SER 31 N -3.33 -0.51 -0.24 -0.19 0.01 -0.81 -4.31 113.70 104.32 1jpm s SER 31 Ca 0.42 0.21 -0.07 0.00 1.31 0.00 0.00 55.95 57.82 1jpm s SER 31 Cb -0.11 0.50 -0.03 0.00 0.21 0.00 0.00 66.02 66.59 1jpm s SER 31 CO 0.31 -0.73 0.06 -0.69 0.41 0.00 0.00 173.24 172.60 1jpm s VAL 32 N -2.71 4.27 -0.17 3.43 1.01 -0.21 -1.81 120.40 124.21 1jpm s VAL 32 Ca -0.01 -0.19 -0.11 0.00 0.00 0.00 0.00 61.98 61.67 1jpm s VAL 32 Cb -0.01 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 1jpm s VAL 32 CO -0.05 0.36 0.20 -0.63 0.00 0.00 0.00 175.10 174.98 1jpm s ILE 33 N 1.49 5.37 -0.07 2.22 -1.09 0.55 -1.08 121.20 128.59 1jpm s ILE 33 Ca 0.06 0.35 0.02 0.00 -2.23 0.00 0.00 60.65 58.84 1jpm s ILE 33 Cb -0.15 -3.54 -0.03 0.00 -1.58 0.00 0.00 42.46 37.17 1jpm s ILE 33 CO 0.03 0.43 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.37 1jpm s VAL 34 N 0.28 3.31 -0.08 2.92 1.01 0.79 -1.04 120.40 127.58 1jpm s VAL 34 Ca 0.12 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1jpm s VAL 34 Cb -0.12 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 33.95 1jpm s VAL 34 CO 0.01 0.58 -0.10 -0.13 0.00 0.00 0.00 175.10 175.46 1jpm s ARG 35 N -0.61 1.59 -0.18 2.72 0.52 0.03 -1.04 118.95 121.97 1jpm s ARG 35 Ca 0.09 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 54.96 1jpm s ARG 35 Cb -0.11 -1.43 0.01 0.00 0.52 0.00 0.00 34.95 33.94 1jpm s ARG 35 CO 0.01 -0.08 -0.16 0.42 0.02 0.00 0.00 175.30 175.51 1jpm s ILE 36 N 1.03 2.39 -0.13 1.52 1.01 0.13 -0.95 121.20 126.20 1jpm s ILE 36 Ca -0.08 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 59.71 1jpm s ILE 36 Cb -0.15 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 1jpm s ILE 36 CO -0.01 0.51 -0.03 -0.89 0.00 0.00 0.00 174.94 174.53 1jpm s THR 37 N 1.24 4.04 0.14 2.92 2.01 -0.04 0.33 115.64 126.27 1jpm s THR 37 Ca 0.03 -0.32 0.07 0.00 0.31 0.00 0.00 61.69 61.78 1jpm s THR 37 Cb -0.14 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.60 1jpm s THR 37 CO -0.09 0.54 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.03 1jpm s TYR 38 N -0.13 2.83 -2.00 4.92 1.51 -0.36 -1.06 117.35 123.05 1jpm s TYR 38 Ca 0.03 -0.12 0.12 0.00 -1.01 0.00 0.00 57.07 56.09 1jpm s TYR 38 Cb -0.13 -1.42 0.74 0.00 -0.11 0.00 0.00 41.96 41.04 1jpm s TYR 38 CO 0.02 0.48 1.18 -0.40 -1.11 0.00 0.00 175.55 175.72 1jpm n ASP 39 N 0.29 0.00 -0.14 2.29 5.68 -0.36 -1.44 116.55 122.87 1jpm n ASP 39 Ca -0.11 -0.66 0.13 0.00 -0.50 0.00 0.00 54.79 53.64 1jpm n ASP 39 Cb 0.54 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 40.93 1jpm n ASP 39 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1jpm n SER 40 N -0.87 0.71 0.00 -1.12 3.41 -1.26 -4.91 113.62 109.59 1jpm n SER 40 Ca 0.09 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 1jpm n SER 40 Cb 0.04 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1jpm n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jpm n GLY 41 N 1.38 0.16 3.83 5.00 0.00 -0.52 -5.07 105.19 109.96 1jpm n GLY 41 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1jpm n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jpm s ALA 42 N -2.01 3.11 -0.13 4.61 0.00 -1.24 -4.91 121.76 121.19 1jpm s ALA 42 Ca 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 51.96 52.23 1jpm s ALA 42 Cb 0.00 -3.06 0.04 0.00 0.00 0.00 0.00 23.12 20.10 1jpm s ALA 42 CO 0.00 0.11 -0.02 0.08 0.00 0.00 0.00 175.76 175.93 1jpm s VAL 43 N -2.22 0.75 0.01 0.00 1.01 -1.26 -1.23 120.40 117.47 1jpm s VAL 43 Ca 0.60 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 1jpm s VAL 43 Cb -0.09 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.28 1jpm s VAL 43 CO 0.17 0.15 0.34 -0.83 0.00 0.00 0.00 175.10 174.93 1jpm s GLY 44 N 1.80 2.34 0.11 4.51 0.00 0.15 -4.77 107.32 111.46 1jpm s GLY 44 Ca 0.03 -0.41 0.09 0.00 0.00 0.00 0.00 44.72 44.42 1jpm s GLY 44 CO -0.07 -0.15 -0.18 -0.98 0.00 0.00 0.00 173.10 171.71 1jpm s TRP 45 N -1.23 2.53 0.07 1.90 0.52 -1.26 -0.69 118.94 120.77 1jpm s TRP 45 Ca 0.27 -0.27 -0.18 0.00 0.02 0.00 0.00 56.10 55.94 1jpm s TRP 45 Cb -0.14 -1.35 0.04 0.00 -1.15 0.00 0.00 33.47 30.86 1jpm s TRP 45 CO 0.14 0.37 0.41 0.20 0.02 0.00 0.00 176.95 178.10 1jpm s GLY 46 N -2.08 -0.28 -0.00 0.98 0.00 -0.21 -1.84 107.32 103.89 1jpm s GLY 46 Ca 0.18 0.21 0.01 0.00 0.00 0.00 0.00 44.72 45.11 1jpm s GLY 46 CO 0.10 -0.05 -0.03 1.85 0.00 0.00 0.00 173.10 174.97 1jpm s GLU 47 N -2.86 0.22 -0.21 2.90 2.12 -1.26 -0.15 118.70 119.46 1jpm s GLU 47 Ca -0.03 -0.12 -0.04 0.00 0.36 0.00 0.00 54.97 55.14 1jpm s GLU 47 Cb -0.00 -0.20 0.09 0.00 0.26 0.00 0.00 34.13 34.28 1jpm s GLU 47 CO -0.05 0.05 0.17 0.00 -0.54 0.00 0.00 175.26 174.89 1jpm s ALA 48 N -0.12 0.09 0.43 6.30 0.00 -0.24 -4.26 121.76 123.96 1jpm s ALA 48 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 51.96 51.72 1jpm s ALA 48 Cb -0.01 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 1jpm s ALA 48 CO -0.00 -1.32 0.70 -1.25 0.00 0.00 0.00 175.76 173.89 1jpm s PRO 49 N 2.23 3.52 0.30 0.00 0.04 -1.26 -1.05 135.00 138.77 1jpm s PRO 49 Ca 0.06 -0.01 -0.21 0.00 0.04 0.00 0.00 61.00 60.88 1jpm s PRO 49 Cb -0.16 -2.48 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 1jpm s PRO 49 CO -0.17 -0.07 0.83 -1.25 0.04 0.00 0.00 177.00 176.38 1jpm s PRO 50 N -4.58 4.33 -0.44 0.56 0.04 -1.26 -4.94 135.00 128.71 1jpm s PRO 50 Ca 0.45 1.03 0.05 0.00 0.04 0.00 0.00 61.00 62.57 1jpm s PRO 50 Cb -0.10 -2.69 0.19 0.00 0.04 0.00 0.00 34.50 31.94 1jpm s PRO 50 CO 0.42 0.26 0.49 0.25 0.04 0.00 0.00 177.00 178.46 1jpm n THR 51 N 0.33 -0.78 0.09 1.26 -2.24 -0.06 -4.96 114.28 107.92 1jpm n THR 51 Ca 0.01 -2.83 0.10 0.00 -2.27 0.00 0.00 64.05 59.06 1jpm n THR 51 Cb 0.51 -0.88 0.57 0.00 -2.10 0.00 0.00 70.33 68.43 1jpm n THR 51 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1jpm h LEU 52 N 5.12 0.19 0.12 3.22 3.38 -1.83 0.19 115.31 125.70 1jpm h LEU 52 Ca 0.16 -0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.81 1jpm h LEU 52 Cb 0.96 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1jpm h LEU 52 CO 0.30 0.13 -1.69 0.58 0.09 0.00 0.00 178.44 177.85 1jpm h VAL 53 N 0.22 0.97 0.00 1.22 2.07 -1.93 -3.29 116.25 115.51 1jpm h VAL 53 Ca 0.13 -2.64 0.00 0.00 0.82 0.00 0.00 66.70 65.01 1jpm h VAL 53 Cb 0.25 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 1jpm h VAL 53 CO -0.02 0.81 -0.22 0.40 0.02 0.00 0.00 177.57 178.56 1jpm h ILE 54 N 0.07 0.00 0.04 4.57 2.04 -1.93 -3.43 117.51 118.87 1jpm h ILE 54 Ca -0.30 -0.90 -0.36 0.00 1.00 0.00 0.00 64.86 64.30 1jpm h ILE 54 Cb 2.04 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 38.07 1jpm h ILE 54 CO 0.14 0.00 -2.14 0.35 0.00 0.00 0.00 178.15 176.50 1jpm n THR 55 N -4.44 1.60 0.00 -0.27 -2.24 -0.43 -4.99 114.28 103.50 1jpm n THR 55 Ca -0.03 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.05 1jpm n THR 55 Cb 0.11 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.07 1jpm n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jpm n GLY 56 N 1.93 0.43 3.76 3.38 0.00 0.55 -4.93 105.19 110.31 1jpm n GLY 56 Ca -0.33 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 1jpm n GLY 56 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jpm s ASP 57 N -2.12 7.60 0.46 1.61 1.01 -1.23 -4.72 116.67 119.28 1jpm s ASP 57 Ca 0.00 1.91 0.04 0.00 0.71 0.00 0.00 52.55 55.21 1jpm s ASP 57 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 1jpm s ASP 57 CO 0.00 0.15 0.06 -0.94 0.21 0.00 0.00 175.17 174.65 1jpm s SER 58 N -1.21 4.12 0.19 0.27 1.04 -1.26 -0.88 113.70 115.97 1jpm s SER 58 Ca 0.41 -1.44 -0.12 0.00 0.48 0.00 0.00 55.95 55.28 1jpm s SER 58 Cb -0.25 0.04 0.11 0.00 0.10 0.00 0.00 66.02 66.02 1jpm s SER 58 CO 0.31 -0.68 1.85 0.24 0.98 0.00 0.00 173.24 175.94 1jpm h MET 59 N 1.47 0.84 -0.15 4.02 2.86 -1.95 -1.10 114.93 120.92 1jpm h MET 59 Ca -0.43 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.13 1jpm h MET 59 Cb 1.28 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 1jpm h MET 59 CO 0.75 0.56 -0.01 -0.44 1.06 0.00 0.00 176.91 178.83 1jpm h ASP 60 N 0.86 0.27 -0.71 1.22 3.32 -1.99 -1.56 116.42 117.83 1jpm h ASP 60 Ca 0.23 -0.33 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 1jpm h ASP 60 Cb -0.09 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 1jpm h ASP 60 CO -0.05 0.54 0.28 0.77 -1.72 0.00 0.00 179.24 179.06 1jpm h SER 61 N -0.00 0.99 0.17 6.45 4.64 -1.93 0.43 113.55 124.29 1jpm h SER 61 Ca 0.04 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 1jpm h SER 61 Cb 0.41 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1jpm h SER 61 CO 0.01 0.89 -0.08 0.40 -0.87 0.00 0.00 176.83 177.18 1jpm h ILE 62 N 1.02 0.87 -0.39 0.95 2.04 -1.18 -0.46 117.51 120.36 1jpm h ILE 62 Ca 0.24 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 1jpm h ILE 62 Cb 0.22 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1jpm h ILE 62 CO -0.02 0.03 0.23 -0.08 0.00 0.00 0.00 178.15 178.31 1jpm h GLU 63 N -0.29 0.54 -0.71 2.37 4.81 -1.14 -2.06 114.58 118.10 1jpm h GLU 63 Ca -0.02 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1jpm h GLU 63 Cb 0.23 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1jpm h GLU 63 CO 0.04 0.42 0.38 1.03 -0.73 0.00 0.00 179.01 180.14 1jpm h SER 64 N 0.51 0.89 -0.57 1.04 0.87 -0.81 -0.27 113.55 115.20 1jpm h SER 64 Ca 0.14 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1jpm h SER 64 Cb 0.02 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 1jpm h SER 64 CO -0.02 0.73 0.35 0.00 -0.53 0.00 0.00 176.83 177.36 1jpm h ALA 65 N 1.19 0.73 -0.30 6.23 0.00 -0.82 0.76 119.26 127.06 1jpm h ALA 65 Ca 0.25 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1jpm h ALA 65 Cb 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1jpm h ALA 65 CO -0.04 0.21 -0.19 0.82 0.00 0.00 0.00 179.25 180.05 1jpm h ILE 66 N 0.77 1.30 -0.38 0.00 2.04 -1.11 -1.32 117.51 118.80 1jpm h ILE 66 Ca 0.21 -1.31 -0.16 0.00 1.00 0.00 0.00 64.86 64.60 1jpm h ILE 66 Cb -0.02 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1jpm h ILE 66 CO -0.04 0.42 -0.37 0.45 0.00 0.00 0.00 178.15 178.61 1jpm h HIS 67 N 0.40 1.11 0.00 1.37 3.86 -0.83 0.14 115.15 121.19 1jpm h HIS 67 Ca 0.06 -0.33 0.00 0.00 -1.16 0.00 0.00 60.37 58.94 1jpm h HIS 67 Cb 0.73 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1jpm h HIS 67 CO 0.06 1.15 -1.34 0.72 0.86 0.00 0.00 177.93 179.38 1jpm n HIS 68 N -4.08 0.00 0.05 2.45 8.25 0.24 -4.43 115.22 117.69 1jpm n HIS 68 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1jpm n HIS 68 Cb 0.53 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1jpm n HIS 68 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1jpm n VAL 69 N -1.76 0.64 -0.03 1.59 0.31 -0.58 -4.75 118.33 113.75 1jpm n VAL 69 Ca 0.01 0.21 -0.13 0.00 -0.01 0.00 0.00 64.34 64.42 1jpm n VAL 69 Cb 0.41 -1.33 -0.09 0.00 -0.91 0.00 0.00 33.84 31.92 1jpm n VAL 69 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1jpm h LEU 70 N 0.00 0.16 0.26 7.52 3.38 -1.40 -3.19 115.31 122.05 1jpm h LEU 70 Ca 0.00 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1jpm h LEU 70 Cb 0.27 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1jpm h LEU 70 CO 0.00 0.63 -0.47 0.50 0.09 0.00 0.00 178.44 179.18 1jpm h LYS 71 N -0.31 -0.77 0.00 1.13 3.64 -0.96 -1.93 116.57 117.37 1jpm h LYS 71 Ca 0.01 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1jpm h LYS 71 Cb 0.59 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1jpm h LYS 71 CO 0.02 -0.52 0.00 -1.00 -2.27 0.00 0.00 179.45 175.68 1jpm h PRO 72 N -0.80 0.00 0.00 1.90 0.13 -1.78 -0.69 132.00 130.76 1jpm h PRO 72 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1jpm h PRO 72 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1jpm h PRO 72 CO -0.19 0.00 -0.77 0.00 -0.23 0.00 0.00 178.00 176.81 1jpm h ALA 73 N 2.02 0.57 0.00 -0.56 0.00 -1.36 -3.39 119.26 116.54 1jpm h ALA 73 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 1jpm h ALA 73 Cb 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1jpm h ALA 73 CO 0.00 0.00 -2.01 1.28 0.00 0.00 0.00 179.25 178.52 1jpm n LEU 74 N -2.48 0.21 -4.67 0.00 4.77 -0.37 -4.86 117.00 109.59 1jpm n LEU 74 Ca 0.02 -0.01 -0.46 0.00 -0.03 0.00 0.00 56.01 55.53 1jpm n LEU 74 Cb 0.50 0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 41.84 1jpm n LEU 74 CO 0.38 0.39 1.54 0.18 -1.33 0.00 0.00 177.39 178.55 1jpm n LEU 75 N -2.57 3.74 0.00 2.23 4.77 -0.56 -1.20 117.00 123.41 1jpm n LEU 75 Ca -0.24 0.95 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 1jpm n LEU 75 Cb 0.97 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 1jpm n LEU 75 CO 0.30 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1jpm n GLY 76 N 4.46 1.92 3.83 -0.72 0.00 -0.59 -5.02 105.19 109.07 1jpm n GLY 76 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1jpm n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jpm s LYS 77 N -0.92 2.86 0.17 1.61 -0.14 -0.34 -4.74 119.74 118.24 1jpm s LYS 77 Ca 0.00 0.79 0.10 0.00 -1.36 0.00 0.00 55.97 55.50 1jpm s LYS 77 Cb 0.00 -1.99 -0.04 0.00 -1.68 0.00 0.00 37.83 34.11 1jpm s LYS 77 CO 0.00 -1.11 -0.22 -1.54 -0.76 0.00 0.00 175.35 171.72 1jpm s SER 78 N -3.96 3.06 -0.20 2.83 1.04 -1.26 -1.24 113.70 113.97 1jpm s SER 78 Ca 0.58 -0.84 0.01 0.00 0.48 0.00 0.00 55.95 56.19 1jpm s SER 78 Cb -0.13 -0.20 0.24 0.00 0.10 0.00 0.00 66.02 66.03 1jpm s SER 78 CO 0.54 0.06 1.53 0.18 0.98 0.00 0.00 173.24 176.54 1jpm n LEU 79 N 0.42 4.95 0.05 2.42 4.32 -1.18 -4.13 117.00 123.84 1jpm n LEU 79 Ca -0.14 -2.55 -0.13 0.00 -0.02 0.00 0.00 56.01 53.18 1jpm n LEU 79 Cb 0.56 -0.75 -0.03 0.00 -1.62 0.00 0.00 43.42 41.59 1jpm n LEU 79 CO 0.28 0.84 0.24 0.00 -1.22 0.00 0.00 177.39 177.53 1jpm h ALA 80 N 1.55 0.42 -3.15 -1.18 0.00 -1.96 -3.37 119.26 111.57 1jpm h ALA 80 Ca 0.25 -0.66 -0.66 0.00 0.00 0.00 0.00 54.91 53.84 1jpm h ALA 80 Cb 1.54 -0.03 -0.39 0.00 0.00 0.00 0.00 17.79 18.91 1jpm h ALA 80 CO 0.49 0.78 -0.46 0.20 0.00 0.00 0.00 179.25 180.26 1jpm s GLY 81 N -4.35 2.73 0.18 0.00 0.00 -1.26 -4.93 107.32 99.70 1jpm s GLY 81 Ca -0.06 -3.56 -0.09 0.00 0.00 0.00 0.00 44.72 41.01 1jpm s GLY 81 CO 0.86 1.08 1.65 -1.82 0.00 0.00 0.00 173.10 174.88 1jpm h TYR 82 N 6.17 1.16 -0.54 1.90 3.20 -1.89 -2.93 116.97 124.05 1jpm h TYR 82 Ca 0.05 -0.19 0.11 0.00 3.14 0.00 0.00 58.73 61.83 1jpm h TYR 82 Cb 0.85 -0.31 -0.09 0.00 1.54 0.00 0.00 36.73 38.72 1jpm h TYR 82 CO 0.65 1.02 0.00 1.49 -1.64 0.00 0.00 178.16 179.68 1jpm h GLU 83 N 0.98 0.11 -0.41 1.82 4.57 -1.96 -0.50 114.58 119.19 1jpm h GLU 83 Ca 0.18 -0.01 -0.15 0.00 -1.18 0.00 0.00 59.36 58.21 1jpm h GLU 83 Cb 0.54 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.09 1jpm h GLU 83 CO 0.03 0.08 -0.31 0.00 -1.18 0.00 0.00 179.01 177.62 1jpm h ALA 84 N 1.48 0.59 -0.15 2.92 0.00 -1.98 -1.96 119.26 120.17 1jpm h ALA 84 Ca 0.27 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1jpm h ALA 84 Cb 0.42 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1jpm h ALA 84 CO -0.45 0.65 0.05 0.82 0.00 0.00 0.00 179.25 180.31 1jpm h ILE 85 N 0.77 1.18 -0.67 0.00 2.04 -1.25 -0.44 117.51 119.13 1jpm h ILE 85 Ca 0.08 -0.54 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 1jpm h ILE 85 Cb 0.90 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 1jpm h ILE 85 CO 0.08 0.16 0.31 -0.07 0.00 0.00 0.00 178.15 178.63 1jpm h LEU 86 N 0.06 0.88 -0.06 1.44 3.38 -1.13 -0.97 115.31 118.92 1jpm h LEU 86 Ca 0.05 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1jpm h LEU 86 Cb 0.21 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1jpm h LEU 86 CO -0.00 0.78 0.04 -0.74 0.09 0.00 0.00 178.44 178.60 1jpm h HIS 87 N 0.93 0.07 -0.97 1.13 2.76 -1.19 -2.10 115.15 115.78 1jpm h HIS 87 Ca 0.23 0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.44 1jpm h HIS 87 Cb 0.14 -0.02 -0.06 0.00 1.55 0.00 0.00 27.41 29.02 1jpm h HIS 87 CO 0.01 0.07 0.63 -0.44 -1.30 0.00 0.00 177.93 176.90 1jpm h ASP 88 N 0.06 1.05 -0.77 3.26 3.32 -0.76 -1.48 116.42 121.10 1jpm h ASP 88 Ca 0.02 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1jpm h ASP 88 Cb 0.01 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 1jpm h ASP 88 CO -0.00 0.71 0.40 0.40 -1.72 0.00 0.00 179.24 179.03 1jpm h ILE 89 N 1.22 1.24 0.00 0.35 2.04 -0.90 -0.29 117.51 121.16 1jpm h ILE 89 Ca 0.39 -0.64 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 1jpm h ILE 89 Cb 0.03 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1jpm h ILE 89 CO -0.13 0.28 -0.31 1.56 0.00 0.00 0.00 178.15 179.54 1jpm h GLN 90 N 1.08 0.00 -0.02 2.37 1.08 -0.84 -3.34 115.11 115.44 1jpm h GLN 90 Ca 0.27 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.47 1jpm h GLN 90 Cb 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1jpm h GLN 90 CO -0.04 0.31 0.00 0.72 -0.95 0.00 0.00 178.83 178.88 1jpm n HIS 91 N -3.27 0.00 0.20 2.96 8.25 -0.61 -4.48 115.22 118.27 1jpm n HIS 91 Ca 0.02 -0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.54 1jpm n HIS 91 Cb 0.58 -0.00 0.40 0.00 1.12 0.00 0.00 29.99 32.09 1jpm n HIS 91 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1jpm h LEU 92 N 2.41 0.00 -7.35 2.41 3.38 -1.17 -3.45 115.31 111.53 1jpm h LEU 92 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1jpm h LEU 92 Cb 0.51 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.10 1jpm h LEU 92 CO 0.00 0.34 -0.08 -1.48 0.09 0.00 0.00 178.44 177.31 1jpm s LEU 93 N -7.33 0.32 0.35 1.67 2.34 -1.26 -5.10 118.68 109.67 1jpm s LEU 93 Ca -0.01 -0.03 -0.11 0.00 0.06 0.00 0.00 54.13 54.04 1jpm s LEU 93 Cb 0.12 1.82 -0.07 0.00 -0.56 0.00 0.00 46.19 47.50 1jpm s LEU 93 CO 0.68 -0.71 0.72 -0.89 -1.06 0.00 0.00 176.35 175.09 1jpm s THR 94 N -2.71 4.79 0.00 5.48 2.01 -1.26 -4.89 115.64 119.05 1jpm s THR 94 Ca -0.04 0.66 0.00 0.00 0.31 0.00 0.00 61.69 62.62 1jpm s THR 94 Cb -0.00 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.83 1jpm s THR 94 CO -0.04 -0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.15 1jpm n GLY 95 N -0.85 2.71 4.18 4.40 0.00 -1.26 -4.87 105.19 109.51 1jpm n GLY 95 Ca 0.02 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 1jpm n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jpm n ASN 96 N 0.70 -3.20 0.01 1.61 3.02 -1.26 -4.82 115.26 111.31 1jpm n ASN 96 Ca 0.00 -0.99 0.04 0.00 -0.03 0.00 0.00 54.58 53.59 1jpm n ASN 96 Cb 0.00 -2.86 0.42 0.00 -0.61 0.00 0.00 39.78 36.73 1jpm n ASN 96 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1jpm h MET 97 N -1.57 0.52 -0.47 3.52 2.86 -1.89 -2.36 114.93 115.54 1jpm h MET 97 Ca -0.59 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 56.95 1jpm h MET 97 Cb 1.38 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.91 1jpm h MET 97 CO 0.76 0.36 0.05 0.77 1.06 0.00 0.00 176.91 179.92 1jpm h SER 98 N 0.53 0.76 -0.27 1.22 0.02 -1.87 -0.24 113.55 113.70 1jpm h SER 98 Ca 0.14 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1jpm h SER 98 Cb -0.02 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1jpm h SER 98 CO -0.03 0.85 0.14 0.00 -1.14 0.00 0.00 176.83 176.65 1jpm h ALA 99 N 0.94 0.35 -0.91 3.77 0.00 -1.79 -2.02 119.26 119.60 1jpm h ALA 99 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1jpm h ALA 99 Cb 0.43 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1jpm h ALA 99 CO 0.01 -0.11 0.58 0.87 0.00 0.00 0.00 179.25 180.61 1jpm h LYS 100 N 0.31 1.22 -0.47 0.00 1.57 -1.29 -2.72 116.57 115.19 1jpm h LYS 100 Ca 0.09 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1jpm h LYS 100 Cb 0.10 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1jpm h LYS 100 CO -0.01 0.84 0.08 0.00 -0.57 0.00 0.00 179.45 179.78 1jpm h ALA 101 N 1.32 0.62 -0.71 3.86 0.00 -0.76 -0.62 119.26 122.97 1jpm h ALA 101 Ca 0.33 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1jpm h ALA 101 Cb -0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1jpm h ALA 101 CO -0.07 0.35 0.27 0.00 0.00 0.00 0.00 179.25 179.80 1jpm h ALA 102 N 0.96 1.13 -0.21 0.00 0.00 -1.24 0.10 119.26 120.01 1jpm h ALA 102 Ca 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1jpm h ALA 102 Cb 0.38 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1jpm h ALA 102 CO 0.01 0.62 -0.13 0.28 0.00 0.00 0.00 179.25 180.02 1jpm h VAL 103 N 1.04 1.31 -0.96 0.00 2.07 -1.35 -2.67 116.25 115.69 1jpm h VAL 103 Ca 0.24 -1.23 0.06 0.00 0.82 0.00 0.00 66.70 66.59 1jpm h VAL 103 Cb 0.22 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.58 1jpm h VAL 103 CO -0.02 0.37 0.61 -0.33 0.02 0.00 0.00 177.57 178.23 1jpm h GLU 104 N 0.16 1.10 0.04 1.57 5.08 -0.81 -0.40 114.58 121.32 1jpm h GLU 104 Ca 0.04 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1jpm h GLU 104 Cb 0.64 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1jpm h GLU 104 CO 0.04 0.73 -0.19 0.52 -1.00 0.00 0.00 179.01 179.10 1jpm h MET 105 N 1.13 -0.32 -0.13 2.33 2.86 -0.83 0.15 114.93 120.11 1jpm h MET 105 Ca 0.41 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 58.03 1jpm h MET 105 Cb 0.14 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1jpm h MET 105 CO -0.16 -0.21 -0.10 0.00 1.06 0.00 0.00 176.91 177.49 1jpm h ALA 106 N 0.54 1.58 -0.15 6.32 0.00 -0.87 -0.02 119.26 126.66 1jpm h ALA 106 Ca 0.05 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 1jpm h ALA 106 Cb 0.39 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1jpm h ALA 106 CO -0.16 0.30 -0.59 -0.07 0.00 0.00 0.00 179.25 178.73 1jpm h LEU 107 N 0.20 0.79 -0.78 0.00 3.38 -0.47 -1.58 115.31 116.84 1jpm h LEU 107 Ca 0.04 -0.61 -0.12 0.00 0.09 0.00 0.00 57.88 57.28 1jpm h LEU 107 Cb 0.31 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1jpm h LEU 107 CO 0.02 1.27 -0.38 1.88 0.09 0.00 0.00 178.44 181.32 1jpm h TYR 108 N 0.35 0.55 0.17 1.13 -1.99 -0.44 -0.34 116.97 116.41 1jpm h TYR 108 Ca -0.03 -0.15 -0.01 0.00 2.00 0.00 0.00 58.73 60.54 1jpm h TYR 108 Cb 1.22 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.83 1jpm h TYR 108 CO 0.10 0.78 -0.08 0.22 -0.00 0.00 0.00 178.16 179.18 1jpm h ASP 109 N 0.39 -0.19 -0.51 3.88 3.58 -0.95 -0.58 116.42 122.04 1jpm h ASP 109 Ca 0.04 -0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.45 1jpm h ASP 109 Cb 0.84 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.92 1jpm h ASP 109 CO 0.07 -0.08 0.33 1.23 -2.88 0.00 0.00 179.24 177.91 1jpm h GLY 110 N -0.29 0.72 0.79 -0.78 0.00 -1.13 -1.69 103.07 100.69 1jpm h GLY 110 Ca -0.02 -0.26 0.04 0.00 0.00 0.00 0.00 47.33 47.08 1jpm h GLY 110 CO 0.04 0.25 0.36 -0.25 0.00 0.00 0.00 176.54 176.94 1jpm h TRP 111 N 0.68 0.67 -0.13 5.60 7.01 -0.83 -0.40 115.95 128.56 1jpm h TRP 111 Ca 0.19 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.12 1jpm h TRP 111 Cb -0.07 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 26.77 1jpm h TRP 111 CO -0.04 0.36 -0.31 0.00 -2.79 0.00 0.00 178.44 175.65 1jpm h ALA 112 N 1.29 1.24 -0.35 2.65 0.00 -0.86 -2.18 119.26 121.06 1jpm h ALA 112 Ca 0.26 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1jpm h ALA 112 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1jpm h ALA 112 CO -0.13 0.51 -0.05 1.96 0.00 0.00 0.00 179.25 181.54 1jpm h GLN 113 N 0.22 0.65 -0.97 0.00 4.20 -0.38 -0.80 115.11 118.03 1jpm h GLN 113 Ca 0.03 -0.23 0.06 0.00 0.06 0.00 0.00 58.65 58.57 1jpm h GLN 113 Cb 0.66 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.33 1jpm h GLN 113 CO 0.05 0.80 0.62 1.98 -0.67 0.00 0.00 178.83 181.61 1jpm h MET 114 N 0.44 1.11 0.00 1.46 4.05 -0.81 0.25 114.93 121.43 1jpm h MET 114 Ca 0.09 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1jpm h MET 114 Cb 0.54 -0.25 0.00 0.00 -0.80 0.00 0.00 31.60 31.09 1jpm h MET 114 CO 0.03 0.74 0.00 0.00 0.23 0.00 0.00 176.91 177.90 1jpm n GLY 116 N 1.31 -0.01 3.10 0.00 0.00 0.07 -5.04 105.19 104.63 1jpm n GLY 116 Ca 0.08 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 1jpm n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jpm s LEU 117 N -3.24 2.31 0.50 0.99 1.43 -0.58 -4.79 118.68 115.30 1jpm s LEU 117 Ca 0.06 -0.66 -0.23 0.00 -1.03 0.00 0.00 54.13 52.27 1jpm s LEU 117 Cb -0.03 -0.21 -0.06 0.00 0.03 0.00 0.00 46.19 45.93 1jpm s LEU 117 CO 0.07 -0.24 1.35 -2.84 0.23 0.00 0.00 176.35 174.93 1jpm s PRO 118 N -2.08 3.39 0.27 1.29 0.02 -1.25 -0.46 135.00 136.18 1jpm s PRO 118 Ca -0.04 2.23 -0.00 0.00 0.02 0.00 0.00 61.00 63.21 1jpm s PRO 118 Cb -0.07 -2.41 0.53 0.00 0.02 0.00 0.00 34.50 32.57 1jpm s PRO 118 CO -0.00 -0.99 1.81 1.25 -0.33 0.00 0.00 177.00 178.74 1jpm h LEU 119 N 1.82 0.79 -1.73 -5.54 5.85 -0.98 -1.77 115.31 113.74 1jpm h LEU 119 Ca -0.51 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 1jpm h LEU 119 Cb 1.28 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1jpm h LEU 119 CO 0.59 0.40 -0.01 0.10 -0.34 0.00 0.00 178.44 179.18 1jpm h TYR 120 N 0.86 0.15 0.10 1.25 -0.00 -1.83 -1.89 116.97 115.61 1jpm h TYR 120 Ca 0.48 -0.00 -0.27 0.00 0.00 0.00 0.00 58.73 58.94 1jpm h TYR 120 Cb 0.52 -0.05 0.01 0.00 0.00 0.00 0.00 36.73 37.22 1jpm h TYR 120 CO -0.03 0.17 -1.16 1.96 -0.00 0.00 0.00 178.16 179.10 1jpm h GLN 121 N 0.15 0.36 0.00 0.10 4.20 -1.67 0.82 115.11 119.07 1jpm h GLN 121 Ca 0.04 -0.52 -0.02 0.00 0.06 0.00 0.00 58.65 58.21 1jpm h GLN 121 Cb 0.13 0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 1jpm h GLN 121 CO 0.00 1.21 -0.09 1.98 -0.67 0.00 0.00 178.83 181.27 1jpm h MET 122 N 0.14 0.00 -0.01 1.46 4.05 -0.92 -1.67 114.93 117.99 1jpm h MET 122 Ca -0.13 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.29 1jpm h MET 122 Cb 1.86 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.66 1jpm h MET 122 CO 0.20 0.09 -0.47 1.28 0.23 0.00 0.00 176.91 178.24 1jpm n LEU 123 N -3.94 0.98 0.00 3.39 4.77 -0.77 -4.93 117.00 116.50 1jpm n LEU 123 Ca -0.02 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1jpm n LEU 123 Cb 0.18 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1jpm n LEU 123 CO 0.31 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1jpm n GLY 124 N 1.43 1.54 4.06 -0.72 0.00 -0.63 -4.74 105.19 106.12 1jpm n GLY 124 Ca 0.08 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1jpm n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jpm n GLY 125 N 0.00 -0.44 0.35 -0.02 0.00 0.28 -4.88 105.19 100.48 1jpm n GLY 125 Ca 0.00 0.16 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 1jpm n GLY 125 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1jpm h TYR 126 N -1.78 1.14 -3.91 1.61 3.20 -1.35 -3.45 116.97 112.43 1jpm h TYR 126 Ca -0.59 -0.04 -0.16 0.00 3.14 0.00 0.00 58.73 61.08 1jpm h TYR 126 Cb 1.38 -0.36 -0.20 0.00 1.54 0.00 0.00 36.73 39.09 1jpm h TYR 126 CO 0.59 0.82 -0.64 -0.98 -1.64 0.00 0.00 178.16 176.31 1jpm s ARG 127 N -5.68 0.40 0.02 1.82 1.70 -0.44 -5.03 118.95 111.73 1jpm s ARG 127 Ca -0.12 -0.66 0.21 0.00 -0.47 0.00 0.00 55.73 54.69 1jpm s ARG 127 Cb 0.17 0.15 -0.21 0.00 -0.57 0.00 0.00 34.95 34.48 1jpm s ARG 127 CO 0.82 -0.08 0.62 -0.25 -1.08 0.00 0.00 175.30 175.33 1jpm n ASP 128 N 1.32 0.35 -4.19 -2.89 8.00 -1.26 -4.67 116.55 113.21 1jpm n ASP 128 Ca -0.22 0.14 -0.12 0.00 0.71 0.00 0.00 54.79 55.30 1jpm n ASP 128 Cb 0.56 1.17 -0.10 0.00 -0.02 0.00 0.00 41.12 42.73 1jpm n ASP 128 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1jpm s THR 129 N -3.24 0.82 -0.02 -3.53 -4.23 -1.26 -1.05 115.64 103.13 1jpm s THR 129 Ca -0.06 -1.92 -0.20 0.00 -1.18 0.00 0.00 61.69 58.33 1jpm s THR 129 Cb 0.11 -1.66 0.04 0.00 1.34 0.00 0.00 72.50 72.32 1jpm s THR 129 CO 0.85 -0.80 0.44 -1.48 -0.54 0.00 0.00 174.62 173.09 1jpm s LEU 130 N -2.98 0.33 -0.21 4.79 0.05 -0.55 -4.97 118.68 115.14 1jpm s LEU 130 Ca 0.12 0.29 -0.17 0.00 0.05 0.00 0.00 54.13 54.42 1jpm s LEU 130 Cb 0.04 1.71 -0.04 0.00 -2.05 0.00 0.00 46.19 45.85 1jpm s LEU 130 CO -0.03 -0.51 0.44 -0.70 -0.55 0.00 0.00 176.35 175.00 1jpm s GLU 131 N -1.34 4.17 0.09 1.48 2.12 -1.26 -0.77 118.70 123.17 1jpm s GLU 131 Ca -0.12 0.27 0.02 0.00 0.36 0.00 0.00 54.97 55.50 1jpm s GLU 131 Cb -0.03 -3.56 -0.04 0.00 0.26 0.00 0.00 34.13 30.76 1jpm s GLU 131 CO 0.06 -0.10 0.16 -0.08 -0.54 0.00 0.00 175.26 174.76 1jpm s THR 132 N 1.51 4.97 0.80 -1.70 -1.32 -0.25 -4.01 115.64 115.65 1jpm s THR 132 Ca 0.21 -0.63 -0.07 0.00 -1.21 0.00 0.00 61.69 59.99 1jpm s THR 132 Cb -0.15 -3.44 0.15 0.00 -1.51 0.00 0.00 72.50 67.54 1jpm s THR 132 CO 0.09 0.08 1.11 1.51 -2.21 0.00 0.00 174.62 175.20 1jpm s ASP 133 N -2.61 3.94 0.00 8.08 3.84 -1.02 -4.79 116.67 124.11 1jpm s ASP 133 Ca 0.32 -0.09 0.01 0.00 -0.00 0.00 0.00 52.55 52.79 1jpm s ASP 133 Cb -0.12 -0.19 -0.00 0.00 -1.38 0.00 0.00 42.92 41.22 1jpm s ASP 133 CO 0.25 -2.15 -0.03 -0.47 -0.00 0.00 0.00 175.17 172.77 1jpm s TYR 134 N -3.41 0.23 -0.04 2.11 5.04 -0.85 -4.35 117.35 116.08 1jpm s TYR 134 Ca 0.69 -0.09 -0.24 0.00 -2.44 0.00 0.00 57.07 54.98 1jpm s TYR 134 Cb -0.05 -0.15 -0.04 0.00 0.35 0.00 0.00 41.96 42.07 1jpm s TYR 134 CO 0.47 -0.02 0.73 0.99 -1.34 0.00 0.00 175.55 176.38 1jpm s THR 135 N -0.21 4.96 -0.39 4.34 2.01 -1.26 -0.47 115.64 124.62 1jpm s THR 135 Ca -0.01 1.51 -0.17 0.00 0.31 0.00 0.00 61.69 63.34 1jpm s THR 135 Cb -0.02 -4.07 0.01 0.00 0.01 0.00 0.00 72.50 68.43 1jpm s THR 135 CO -0.00 0.28 0.42 -0.69 -0.69 0.00 0.00 174.62 173.94 1jpm s VAL 136 N 0.58 5.10 0.38 3.82 1.01 -0.49 -4.91 120.40 125.89 1jpm s VAL 136 Ca 0.38 -0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.97 1jpm s VAL 136 Cb -0.19 -3.96 -0.11 0.00 0.00 0.00 0.00 36.38 32.13 1jpm s VAL 136 CO 0.20 -0.29 1.25 -1.20 0.00 0.00 0.00 175.10 175.06 1jpm n SER 137 N 5.55 2.49 -4.69 3.32 7.64 -1.26 -4.63 113.62 122.04 1jpm n SER 137 Ca -0.08 1.15 -0.42 0.00 1.01 0.00 0.00 58.87 60.53 1jpm n SER 137 Cb 0.48 -1.47 -0.03 0.00 -1.01 0.00 0.00 64.21 62.18 1jpm n SER 137 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1jpm s VAL 138 N -1.15 3.55 0.00 0.44 1.01 -1.26 -4.76 120.40 118.23 1jpm s VAL 138 Ca 0.58 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.53 1jpm s VAL 138 Cb -0.55 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1jpm s VAL 138 CO 0.60 0.00 0.00 0.59 0.00 0.00 0.00 175.10 176.29 1jpm n ASN 139 N 5.29 0.00 -4.77 3.32 3.02 -1.26 -5.07 115.26 115.78 1jpm n ASN 139 Ca 0.13 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.32 1jpm n ASN 139 Cb 0.43 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.59 1jpm n ASN 139 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1jpm s SER 140 N 2.00 6.22 0.51 6.41 1.04 -1.26 -4.77 113.70 123.85 1jpm s SER 140 Ca 0.00 2.24 0.27 0.00 0.48 0.00 0.00 55.95 58.94 1jpm s SER 140 Cb 0.00 -2.60 1.37 0.00 0.10 0.00 0.00 66.02 64.90 1jpm s SER 140 CO 0.00 -0.88 1.91 1.55 0.98 0.00 0.00 173.24 176.80 1jpm h PRO 141 N 2.02 0.09 -0.33 4.02 0.13 -1.89 0.16 132.00 136.20 1jpm h PRO 141 Ca -0.49 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 64.49 1jpm h PRO 141 Cb 1.24 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1jpm h PRO 141 CO 0.60 0.06 -0.34 1.49 -0.23 0.00 0.00 178.00 179.58 1jpm h GLU 142 N 0.09 0.81 -0.01 0.86 4.57 -1.93 -2.48 114.58 116.48 1jpm h GLU 142 Ca 0.39 -0.43 -0.20 0.00 -1.18 0.00 0.00 59.36 57.94 1jpm h GLU 142 Cb 1.43 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 30.03 1jpm h GLU 142 CO -0.04 1.06 -0.87 1.49 -1.18 0.00 0.00 179.01 179.47 1jpm h GLU 143 N 0.58 0.30 -0.36 1.92 4.81 -1.14 -2.81 114.58 117.88 1jpm h GLU 143 Ca 0.05 -0.31 -0.12 0.00 -0.13 0.00 0.00 59.36 58.86 1jpm h GLU 143 Cb 0.92 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 1jpm h GLU 143 CO 0.08 1.00 -0.23 0.52 -0.73 0.00 0.00 179.01 179.66 1jpm h MET 144 N 0.18 0.79 -0.67 1.92 2.86 -0.98 -1.92 114.93 117.10 1jpm h MET 144 Ca -0.05 -0.37 -0.01 0.00 -2.06 0.00 0.00 59.70 57.20 1jpm h MET 144 Cb 1.49 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 33.10 1jpm h MET 144 CO 0.14 1.00 0.36 0.00 1.06 0.00 0.00 176.91 179.47 1jpm h ALA 145 N 0.78 1.37 -0.27 6.32 0.00 -1.48 0.17 119.26 126.16 1jpm h ALA 145 Ca 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1jpm h ALA 145 Cb 0.79 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1jpm h ALA 145 CO 0.06 0.51 0.02 0.00 0.00 0.00 0.00 179.25 179.85 1jpm h ALA 146 N 1.46 0.36 -0.44 0.00 0.00 -1.28 -1.79 119.26 117.56 1jpm h ALA 146 Ca 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1jpm h ALA 146 Cb 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1jpm h ALA 146 CO -0.04 0.06 0.17 -0.44 0.00 0.00 0.00 179.25 179.00 1jpm h ASP 147 N 0.25 0.62 -0.14 0.00 3.32 -0.84 -2.30 116.42 117.33 1jpm h ASP 147 Ca 0.08 -0.18 0.04 0.00 0.02 0.00 0.00 57.03 56.99 1jpm h ASP 147 Cb 0.37 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1jpm h ASP 147 CO 0.01 0.63 -0.14 0.00 -1.72 0.00 0.00 179.24 178.02 1jpm h ALA 148 N 1.01 -0.04 -0.97 3.45 0.00 -0.55 -0.06 119.26 122.10 1jpm h ALA 148 Ca 0.15 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1jpm h ALA 148 Cb 0.21 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1jpm h ALA 148 CO -0.01 -0.58 0.64 1.49 0.00 0.00 0.00 179.25 180.78 1jpm h GLU 149 N -0.16 1.18 -0.84 0.00 4.81 -1.24 0.28 114.58 118.61 1jpm h GLU 149 Ca 0.09 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1jpm h GLU 149 Cb 0.30 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1jpm h GLU 149 CO -0.23 0.78 0.42 -0.97 -0.73 0.00 0.00 179.01 178.28 1jpm h ASN 150 N 1.22 1.08 0.26 1.04 -1.24 -0.73 -1.15 115.58 116.06 1jpm h ASN 150 Ca 0.39 -0.12 -0.16 0.00 0.71 0.00 0.00 56.30 57.12 1jpm h ASN 150 Cb 0.02 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 38.79 1jpm h ASN 150 CO -0.12 0.90 -0.64 1.88 -1.29 0.00 0.00 177.43 178.16 1jpm h TYR 151 N 1.19 0.47 -0.49 0.67 0.99 -0.08 -2.80 116.97 116.92 1jpm h TYR 151 Ca 0.29 -0.19 0.00 0.00 2.00 0.00 0.00 58.73 60.84 1jpm h TYR 151 Cb 0.09 -0.08 -0.02 0.00 1.00 0.00 0.00 36.73 37.72 1jpm h TYR 151 CO 0.01 0.90 0.31 1.25 -0.00 0.00 0.00 178.16 180.64 1jpm h LEU 152 N 0.26 0.58 -1.51 3.88 5.85 -0.40 -1.88 115.31 122.09 1jpm h LEU 152 Ca -0.01 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 1jpm h LEU 152 Cb 1.18 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1jpm h LEU 152 CO 0.11 0.44 -0.25 0.11 -0.34 0.00 0.00 178.44 178.51 1jpm h LYS 153 N 0.67 0.00 0.00 1.25 1.57 -1.12 -2.27 116.57 116.67 1jpm h LYS 153 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1jpm h LYS 153 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1jpm h LYS 153 CO -0.04 0.25 0.00 1.04 -0.57 0.00 0.00 179.45 180.13 1jpm n GLN 154 N -4.23 0.48 0.00 3.15 6.02 -0.82 -4.89 117.38 117.10 1jpm n GLN 154 Ca -0.02 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1jpm n GLN 154 Cb 0.30 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.06 1jpm n GLN 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jpm n GLY 155 N 1.05 0.92 3.58 1.08 0.00 -0.85 -4.58 105.19 106.38 1jpm n GLY 155 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1jpm n GLY 155 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jpm s PHE 156 N -2.00 3.17 -2.21 1.61 0.40 -0.77 -4.18 117.98 114.01 1jpm s PHE 156 Ca 0.00 0.38 0.24 0.00 -0.60 0.00 0.00 56.93 56.95 1jpm s PHE 156 Cb 0.00 -3.07 0.20 0.00 0.51 0.00 0.00 43.02 40.66 1jpm s PHE 156 CO 0.00 -0.57 1.23 1.04 0.70 0.00 0.00 175.22 177.61 1jpm n GLN 157 N 5.96 1.39 -4.33 0.44 1.13 -1.26 -4.02 117.38 116.68 1jpm n GLN 157 Ca -0.02 -1.10 -0.24 0.00 -1.94 0.00 0.00 57.00 53.70 1jpm n GLN 157 Cb 0.49 -1.48 -0.17 0.00 0.11 0.00 0.00 30.24 29.19 1jpm n GLN 157 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1jpm s THR 158 N -2.37 0.97 0.09 5.09 2.01 -1.26 -1.25 115.64 118.93 1jpm s THR 158 Ca 0.22 -0.35 0.08 0.00 0.31 0.00 0.00 61.69 61.95 1jpm s THR 158 Cb 0.19 -0.93 -0.03 0.00 0.01 0.00 0.00 72.50 71.74 1jpm s THR 158 CO 0.50 0.33 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.80 1jpm s LEU 159 N 0.97 2.28 -0.09 4.42 1.43 -0.25 -2.01 118.68 125.43 1jpm s LEU 159 Ca -0.09 -0.66 0.02 0.00 -1.03 0.00 0.00 54.13 52.37 1jpm s LEU 159 Cb -0.15 -0.86 -0.02 0.00 0.03 0.00 0.00 46.19 45.20 1jpm s LEU 159 CO 0.00 0.06 -0.16 -0.75 0.23 0.00 0.00 176.35 175.73 1jpm s LYS 160 N -1.81 2.95 -0.08 1.70 2.20 0.37 -0.24 119.74 124.84 1jpm s LYS 160 Ca 0.06 -0.73 0.03 0.00 -0.36 0.00 0.00 55.97 54.97 1jpm s LYS 160 Cb -0.10 -2.46 0.01 0.00 -1.51 0.00 0.00 37.83 33.77 1jpm s LYS 160 CO 0.04 0.38 -0.16 0.42 -0.36 0.00 0.00 175.35 175.67 1jpm s ILE 161 N -0.10 1.43 -0.05 5.43 1.01 0.79 -1.40 121.20 128.31 1jpm s ILE 161 Ca -0.02 -0.65 -0.27 0.00 0.00 0.00 0.00 60.65 59.71 1jpm s ILE 161 Cb -0.14 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1jpm s ILE 161 CO 0.04 0.42 0.85 -0.54 0.00 0.00 0.00 174.94 175.71 1jpm s LYS 162 N 0.56 4.48 0.39 2.79 1.02 -1.26 -1.81 119.74 125.90 1jpm s LYS 162 Ca -0.16 1.16 0.05 0.00 0.02 0.00 0.00 55.97 57.04 1jpm s LYS 162 Cb -0.17 -3.47 -0.02 0.00 -0.52 0.00 0.00 37.83 33.65 1jpm s LYS 162 CO 0.05 -0.05 0.19 0.14 -0.92 0.00 0.00 175.35 174.77 1jpm s VAL 163 N 1.09 0.32 0.00 3.17 -7.23 -0.63 -4.91 120.40 112.22 1jpm s VAL 163 Ca 0.44 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 1jpm s VAL 163 Cb -0.19 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.38 1jpm s VAL 163 CO 0.22 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.62 1jpm n GLY 164 N -0.82 0.74 0.11 2.32 0.00 -1.26 -4.09 105.19 102.19 1jpm n GLY 164 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1jpm n GLY 164 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1jpm n LYS 165 N -2.34 0.56 -0.24 1.61 2.85 -1.26 -4.46 118.16 114.88 1jpm n LYS 165 Ca 0.00 0.24 0.00 0.00 -1.05 0.00 0.00 58.31 57.50 1jpm n LYS 165 Cb 0.00 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 32.92 1jpm n LYS 165 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1jpm n ASP 166 N -4.36 0.00 -4.74 -5.58 8.00 -1.26 -5.03 116.55 103.58 1jpm n ASP 166 Ca -0.34 -0.81 -0.37 0.00 0.71 0.00 0.00 54.79 53.98 1jpm n ASP 166 Cb 0.70 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.86 1jpm n ASP 166 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1jpm s ASP 167 N -1.00 4.70 0.25 -2.24 1.11 -1.26 -4.86 116.67 113.37 1jpm s ASP 167 Ca 0.00 2.56 -0.05 0.00 0.18 0.00 0.00 52.55 55.24 1jpm s ASP 167 Cb 0.00 -2.61 0.29 0.00 1.07 0.00 0.00 42.92 41.67 1jpm s ASP 167 CO 0.00 -1.93 1.86 0.40 1.18 0.00 0.00 175.17 176.67 1jpm h ILE 168 N 0.57 1.24 -0.90 0.77 2.04 -1.99 -1.84 117.51 117.41 1jpm h ILE 168 Ca -0.51 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 1jpm h ILE 168 Cb 1.33 0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 1jpm h ILE 168 CO 0.53 0.29 0.55 0.00 0.00 0.00 0.00 178.15 179.52 1jpm h ALA 169 N 1.31 1.15 -0.62 1.87 0.00 -1.99 -0.39 119.26 120.59 1jpm h ALA 169 Ca 0.28 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1jpm h ALA 169 Cb 0.08 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1jpm h ALA 169 CO -0.04 0.60 0.10 1.15 0.00 0.00 0.00 179.25 181.06 1jpm h THR 170 N 1.24 1.26 0.00 0.00 2.02 -1.75 0.16 112.91 115.83 1jpm h THR 170 Ca 0.32 -1.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 1jpm h THR 170 Cb -0.06 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1jpm h THR 170 CO -0.06 0.37 -0.00 0.44 0.37 0.00 0.00 175.52 176.64 1jpm h ASP 171 N 0.96 -0.00 -0.66 4.18 3.32 -0.68 -1.86 116.42 121.66 1jpm h ASP 171 Ca 0.19 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 57.04 1jpm h ASP 171 Cb 0.41 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.93 1jpm h ASP 171 CO 0.01 0.21 0.43 0.40 -1.72 0.00 0.00 179.24 178.57 1jpm h ILE 172 N -0.22 1.15 -0.38 0.35 2.04 -0.86 0.54 117.51 120.13 1jpm h ILE 172 Ca -0.00 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1jpm h ILE 172 Cb 0.21 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 1jpm h ILE 172 CO 0.00 0.16 0.24 0.00 0.00 0.00 0.00 178.15 178.55 1jpm h ALA 173 N 1.25 0.48 -0.62 1.87 0.00 -0.61 0.27 119.26 121.89 1jpm h ALA 173 Ca 0.25 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1jpm h ALA 173 Cb -0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1jpm h ALA 173 CO -0.07 -0.05 0.08 0.00 0.00 0.00 0.00 179.25 179.21 1jpm h ARG 174 N 0.50 1.05 -0.21 0.00 3.08 -0.92 -2.06 114.38 115.82 1jpm h ARG 174 Ca 0.14 -0.29 -0.15 0.00 0.07 0.00 0.00 59.98 59.74 1jpm h ARG 174 Cb -0.04 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.90 1jpm h ARG 174 CO -0.03 0.99 -0.46 0.82 -1.07 0.00 0.00 179.97 180.22 1jpm h ILE 175 N 0.96 1.32 -0.71 2.04 2.04 -0.61 -2.83 117.51 119.71 1jpm h ILE 175 Ca 0.19 -1.68 -0.04 0.00 1.00 0.00 0.00 64.86 64.32 1jpm h ILE 175 Cb 0.46 1.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.36 1jpm h ILE 175 CO 0.02 0.53 0.29 -0.61 0.00 0.00 0.00 178.15 178.37 1jpm h GLN 176 N 0.38 1.04 -0.33 2.37 4.15 -0.45 0.11 115.11 122.38 1jpm h GLN 176 Ca 0.00 -0.17 -0.05 0.00 0.77 0.00 0.00 58.65 59.20 1jpm h GLN 176 Cb 1.07 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.56 1jpm h GLN 176 CO 0.10 0.84 -0.01 1.49 -1.93 0.00 0.00 178.83 179.32 1jpm h GLU 177 N 1.03 0.52 -0.01 1.69 4.57 -1.38 -1.80 114.58 119.21 1jpm h GLU 177 Ca 0.24 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.28 1jpm h GLU 177 Cb 0.18 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1jpm h GLU 177 CO -0.02 0.56 -0.08 0.82 -1.18 0.00 0.00 179.01 179.11 1jpm h ILE 178 N 0.50 1.56 -0.31 2.32 2.04 -1.06 -2.68 117.51 119.87 1jpm h ILE 178 Ca 0.11 -1.74 0.03 0.00 1.00 0.00 0.00 64.86 64.26 1jpm h ILE 178 Cb 0.35 2.70 -0.03 0.00 -0.74 0.00 0.00 36.82 39.09 1jpm h ILE 178 CO 0.01 0.46 0.11 -0.09 0.00 0.00 0.00 178.15 178.65 1jpm h ARG 179 N -0.62 0.24 -0.39 2.37 9.65 -0.74 -0.06 114.38 124.84 1jpm h ARG 179 Ca -0.01 -0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 58.82 1jpm h ARG 179 Cb 0.80 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.30 1jpm h ARG 179 CO 0.02 0.16 0.07 0.87 2.80 0.00 0.00 179.97 183.89 1jpm h LYS 180 N 0.25 0.58 -0.01 0.20 1.79 -1.44 -1.37 116.57 116.58 1jpm h LYS 180 Ca 0.14 -0.11 -0.25 0.00 -2.18 0.00 0.00 60.65 58.26 1jpm h LYS 180 Cb 0.10 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1jpm h LYS 180 CO -0.14 0.55 -0.98 -0.09 -1.08 0.00 0.00 179.45 177.71 1jpm h ARG 181 N 0.56 0.58 0.00 3.15 9.65 -0.98 -3.35 114.38 123.99 1jpm h ARG 181 Ca 0.13 -0.62 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 1jpm h ARG 181 Cb 0.25 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1jpm h ARG 181 CO 0.00 1.23 -1.50 1.33 2.80 0.00 0.00 179.97 183.83 1jpm n VAL 182 N -3.81 0.21 0.00 0.20 0.24 -0.11 -4.98 118.33 110.07 1jpm n VAL 182 Ca -0.09 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 1jpm n VAL 182 Cb 0.85 -0.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.20 1jpm n VAL 182 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jpm n GLY 183 N 1.27 2.45 0.20 7.63 0.00 -0.52 -4.74 105.19 111.47 1jpm n GLY 183 Ca -0.01 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.21 1jpm n GLY 183 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jpm h SER 184 N 0.00 0.00 -0.15 1.61 4.64 -1.94 -3.31 113.55 114.40 1jpm h SER 184 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1jpm h SER 184 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1jpm h SER 184 CO 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 175.95 1jpm h ALA 185 N 2.13 0.21 -2.45 5.18 0.00 -1.95 -3.44 119.26 118.93 1jpm h ALA 185 Ca 0.00 -0.21 -0.58 0.00 0.00 0.00 0.00 54.91 54.12 1jpm h ALA 185 Cb 0.80 -0.06 0.17 0.00 0.00 0.00 0.00 17.79 18.70 1jpm h ALA 185 CO 0.00 -0.07 -0.40 0.28 0.00 0.00 0.00 179.25 179.06 1jpm n VAL 186 N -4.73 2.17 -3.96 0.00 0.31 -1.25 -4.95 118.33 105.92 1jpm n VAL 186 Ca -0.05 -0.50 -0.35 0.00 -0.01 0.00 0.00 64.34 63.43 1jpm n VAL 186 Cb 0.23 -0.66 -0.10 0.00 -0.91 0.00 0.00 33.84 32.39 1jpm n VAL 186 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1jpm s LYS 187 N -2.01 3.91 -0.21 5.55 1.02 -0.38 -4.99 119.74 122.63 1jpm s LYS 187 Ca 0.68 -0.37 -0.03 0.00 0.02 0.00 0.00 55.97 56.26 1jpm s LYS 187 Cb -0.46 -3.25 -0.01 0.00 -0.52 0.00 0.00 37.83 33.59 1jpm s LYS 187 CO 0.55 0.17 -0.05 -0.51 -0.92 0.00 0.00 175.35 174.59 1jpm s LEU 188 N 0.66 2.89 -0.15 3.17 1.43 -1.26 -1.09 118.68 124.32 1jpm s LEU 188 Ca 0.03 -0.38 -0.05 0.00 -1.03 0.00 0.00 54.13 52.71 1jpm s LEU 188 Cb -0.13 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1jpm s LEU 188 CO 0.02 0.01 0.02 -0.13 0.23 0.00 0.00 176.35 176.49 1jpm s ARG 189 N 1.32 3.66 0.01 1.70 0.52 0.67 -0.92 118.95 125.91 1jpm s ARG 189 Ca 0.04 -0.41 0.04 0.00 -0.52 0.00 0.00 55.73 54.88 1jpm s ARG 189 Cb -0.14 -3.02 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 1jpm s ARG 189 CO -0.02 0.36 -0.10 -0.51 0.02 0.00 0.00 175.30 175.05 1jpm s LEU 190 N 0.08 3.03 -0.25 2.53 1.43 -0.42 -0.15 118.68 124.93 1jpm s LEU 190 Ca 0.03 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1jpm s LEU 190 Cb -0.13 -1.74 0.07 0.00 0.03 0.00 0.00 46.19 44.42 1jpm s LEU 190 CO 0.02 0.28 -0.01 -0.62 0.23 0.00 0.00 176.35 176.24 1jpm s ASP 191 N -1.41 3.82 0.00 2.29 -1.08 -0.75 0.25 116.67 119.79 1jpm s ASP 191 Ca 0.16 -1.27 0.31 0.00 -0.52 0.00 0.00 52.55 51.23 1jpm s ASP 191 Cb -0.11 -1.09 1.64 0.00 -1.46 0.00 0.00 42.92 41.90 1jpm s ASP 191 CO 0.07 -0.28 2.09 0.00 0.52 0.00 0.00 175.17 177.57 1jpm n ALA 192 N 4.72 2.63 -3.86 3.66 0.00 -0.68 -1.60 120.51 125.37 1jpm n ALA 192 Ca -0.09 -0.21 -0.26 0.00 0.00 0.00 0.00 53.44 52.89 1jpm n ALA 192 Cb 0.44 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.38 1jpm n ALA 192 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jpm n ASN 193 N -1.00 -0.24 -1.44 0.00 3.02 -1.24 0.09 115.26 114.45 1jpm n ASN 193 Ca 0.19 -0.93 -0.18 0.00 -0.03 0.00 0.00 54.58 53.63 1jpm n ASN 193 Cb 0.19 -1.15 -0.08 0.00 -0.61 0.00 0.00 39.78 38.13 1jpm n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jpm n GLN 194 N -3.69 -1.49 0.00 3.52 6.02 -0.45 -4.88 117.38 116.40 1jpm n GLN 194 Ca -0.20 1.12 0.14 0.00 -0.01 0.00 0.00 57.00 58.05 1jpm n GLN 194 Cb 0.48 -5.49 0.69 0.00 1.02 0.00 0.00 30.24 26.94 1jpm n GLN 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jpm n GLY 195 N -0.25 -1.34 3.50 1.08 0.00 0.11 -4.16 105.19 104.14 1jpm n GLY 195 Ca -0.18 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 1jpm n GLY 195 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jpm s TRP 196 N -2.74 2.43 0.34 1.61 0.51 -0.60 -4.85 118.94 115.65 1jpm s TRP 196 Ca 0.22 -0.30 -0.08 0.00 -2.12 0.00 0.00 56.10 53.83 1jpm s TRP 196 Cb 0.19 -1.13 -0.06 0.00 -0.81 0.00 0.00 33.47 31.67 1jpm s TRP 196 CO 0.47 0.60 0.65 1.03 -0.51 0.00 0.00 176.95 179.19 1jpm s ARG 197 N -3.15 3.72 0.19 4.98 0.52 -1.26 -4.07 118.95 119.87 1jpm s ARG 197 Ca 0.26 0.24 -0.19 0.00 -0.52 0.00 0.00 55.73 55.52 1jpm s ARG 197 Cb -0.07 -2.53 0.14 0.00 0.52 0.00 0.00 34.95 33.01 1jpm s ARG 197 CO 0.14 0.11 1.61 -1.00 0.02 0.00 0.00 175.30 176.18 1jpm h PRO 198 N 1.56 -0.13 -0.75 3.54 0.13 -1.91 0.16 132.00 134.59 1jpm h PRO 198 Ca -0.47 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 1jpm h PRO 198 Cb 1.19 0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1jpm h PRO 198 CO 0.65 -0.09 0.25 -0.22 -0.23 0.00 0.00 178.00 178.36 1jpm h LYS 199 N -0.13 1.16 -0.66 0.86 3.64 -1.94 -1.84 116.57 117.66 1jpm h LYS 199 Ca 0.23 -0.24 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1jpm h LYS 199 Cb 0.50 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1jpm h LYS 199 CO -0.60 0.98 0.40 1.49 -2.27 0.00 0.00 179.45 179.45 1jpm h GLU 200 N 1.12 0.89 -0.21 1.90 4.81 -1.67 -1.95 114.58 119.46 1jpm h GLU 200 Ca 0.24 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 1jpm h GLU 200 Cb 0.29 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 1jpm h GLU 200 CO -0.01 0.62 -0.33 0.00 -0.73 0.00 0.00 179.01 178.56 1jpm h ALA 201 N 1.53 0.33 -0.89 2.92 0.00 -0.28 -2.16 119.26 120.71 1jpm h ALA 201 Ca 0.24 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1jpm h ALA 201 Cb -0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1jpm h ALA 201 CO -0.04 0.37 0.54 0.28 0.00 0.00 0.00 179.25 180.40 1jpm h VAL 202 N 0.29 1.24 0.20 0.00 2.07 -1.10 0.55 116.25 119.51 1jpm h VAL 202 Ca 0.02 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 1jpm h VAL 202 Cb 0.92 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1jpm h VAL 202 CO 0.08 0.25 -0.10 0.74 0.02 0.00 0.00 177.57 178.56 1jpm h THR 203 N 1.23 0.85 0.18 2.57 2.02 -1.33 -0.60 112.91 117.82 1jpm h THR 203 Ca 0.32 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.25 1jpm h THR 203 Cb -0.06 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1jpm h THR 203 CO -0.06 0.06 -0.11 0.00 0.37 0.00 0.00 175.52 175.77 1jpm h ALA 204 N 0.37 -0.27 -0.59 6.16 0.00 -1.12 -0.03 119.26 123.79 1jpm h ALA 204 Ca -0.03 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1jpm h ALA 204 Cb 0.31 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1jpm h ALA 204 CO 0.05 -0.66 0.39 0.82 0.00 0.00 0.00 179.25 179.85 1jpm h ILE 205 N -0.28 1.09 -0.09 0.00 2.04 -0.90 -1.24 117.51 118.12 1jpm h ILE 205 Ca -0.01 -0.24 -0.15 0.00 1.00 0.00 0.00 64.86 65.45 1jpm h ILE 205 Cb 0.24 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1jpm h ILE 205 CO 0.01 0.13 -0.60 0.03 0.00 0.00 0.00 178.15 177.72 1jpm h ARG 206 N 0.71 0.31 -0.59 2.37 3.08 -0.70 -2.56 114.38 117.00 1jpm h ARG 206 Ca 0.24 -0.21 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 1jpm h ARG 206 Cb 0.06 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 1jpm h ARG 206 CO -0.06 0.82 0.08 0.87 -1.07 0.00 0.00 179.97 180.61 1jpm h LYS 207 N 0.23 0.97 0.00 0.04 1.57 0.15 -0.57 116.57 118.96 1jpm h LYS 207 Ca -0.01 -0.25 -0.09 0.00 -1.87 0.00 0.00 60.65 58.43 1jpm h LYS 207 Cb 1.12 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1jpm h LYS 207 CO 0.10 0.91 -0.45 0.52 -0.57 0.00 0.00 179.45 179.95 1jpm h MET 208 N 0.91 0.00 -0.12 3.15 2.86 -1.30 -1.86 114.93 118.57 1jpm h MET 208 Ca 0.18 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.79 1jpm h MET 208 Cb 0.42 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.08 1jpm h MET 208 CO 0.01 0.45 -0.06 1.49 1.06 0.00 0.00 176.91 179.86 1jpm h GLU 209 N 0.00 0.26 0.00 1.72 4.81 -0.96 -1.20 114.58 119.21 1jpm h GLU 209 Ca -0.00 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.09 1jpm h GLU 209 Cb 0.91 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 1jpm h GLU 209 CO 0.06 0.60 -0.13 -0.44 -0.73 0.00 0.00 179.01 178.37 1jpm h ASP 210 N -0.08 0.00 -0.07 1.04 3.32 -0.93 0.89 116.42 120.58 1jpm h ASP 210 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1jpm h ASP 210 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1jpm h ASP 210 CO 0.02 0.13 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1jpm n ALA 211 N -2.50 2.57 -3.84 3.45 0.00 -0.72 -4.92 120.51 114.55 1jpm n ALA 211 Ca -0.03 -0.31 -0.25 0.00 0.00 0.00 0.00 53.44 52.85 1jpm n ALA 211 Cb 0.20 -1.21 0.01 0.00 0.00 0.00 0.00 19.45 18.45 1jpm n ALA 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jpm n GLY 212 N 0.97 -0.30 0.01 0.00 0.00 0.30 -4.88 105.19 101.29 1jpm n GLY 212 Ca 0.16 0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.45 1jpm n GLY 212 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jpm n LEU 213 N -4.38 0.14 -3.71 0.99 4.77 -0.50 -4.97 117.00 109.34 1jpm n LEU 213 Ca -0.24 0.35 -0.22 0.00 -0.03 0.00 0.00 56.01 55.87 1jpm n LEU 213 Cb 0.65 -0.42 0.03 0.00 -2.33 0.00 0.00 43.42 41.36 1jpm n LEU 213 CO 0.73 0.03 -0.03 0.61 -1.33 0.00 0.00 177.39 177.39 1jpm n GLY 214 N 1.48 -0.32 3.69 -0.72 0.00 -1.26 -4.92 105.19 103.14 1jpm n GLY 214 Ca 0.07 0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1jpm n GLY 214 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jpm s ILE 215 N -3.61 3.16 0.08 -0.61 -1.09 -1.26 -4.53 121.20 113.34 1jpm s ILE 215 Ca 0.09 0.65 -0.20 0.00 -2.23 0.00 0.00 60.65 58.97 1jpm s ILE 215 Cb -0.05 -3.42 -0.10 0.00 -1.58 0.00 0.00 42.46 37.32 1jpm s ILE 215 CO 0.81 0.01 1.55 -0.08 -1.23 0.00 0.00 174.94 175.99 1jpm h GLU 216 N 7.94 0.34 -2.36 2.79 4.81 -1.38 -3.45 114.58 123.26 1jpm h GLU 216 Ca -0.41 -0.09 0.08 0.00 -0.13 0.00 0.00 59.36 58.81 1jpm h GLU 216 Cb 1.20 -0.04 -0.15 0.00 0.63 0.00 0.00 28.75 30.39 1jpm h GLU 216 CO 0.92 0.49 0.44 -0.48 -0.73 0.00 0.00 179.01 179.65 1jpm s LEU 217 N -9.61 -0.41 -0.17 1.64 0.05 -1.25 -4.23 118.68 104.71 1jpm s LEU 217 Ca -0.14 0.04 0.01 0.00 0.05 0.00 0.00 54.13 54.09 1jpm s LEU 217 Cb 0.07 2.13 0.02 0.00 -2.05 0.00 0.00 46.19 46.36 1jpm s LEU 217 CO 0.72 -0.67 -0.17 -0.69 -0.55 0.00 0.00 176.35 174.99 1jpm s VAL 218 N -3.09 1.86 -0.02 1.48 1.01 -0.58 -1.30 120.40 119.76 1jpm s VAL 218 Ca 0.04 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 60.94 1jpm s VAL 218 Cb -0.01 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.61 1jpm s VAL 218 CO -0.09 0.48 0.70 -0.70 0.00 0.00 0.00 175.10 175.50 1jpm s GLU 219 N 1.37 4.43 -0.45 2.72 2.12 0.14 -0.61 118.70 128.41 1jpm s GLU 219 Ca 0.04 0.92 -0.01 0.00 0.36 0.00 0.00 54.97 56.28 1jpm s GLU 219 Cb -0.13 -3.40 0.00 0.00 0.26 0.00 0.00 34.13 30.86 1jpm s GLU 219 CO -0.12 0.19 0.33 0.94 -0.54 0.00 0.00 175.26 176.07 1jpm n GLN 220 N 3.26 -0.87 0.21 4.30 -0.06 0.17 -1.69 117.38 122.71 1jpm n GLN 220 Ca -0.03 0.42 0.05 0.00 -2.00 0.00 0.00 57.00 55.45 1jpm n GLN 220 Cb 0.51 -1.22 0.47 0.00 -4.06 0.00 0.00 30.24 25.94 1jpm n GLN 220 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 1jpm h PRO 221 N 0.31 0.00 -5.59 3.69 0.13 -1.85 -1.20 132.00 127.50 1jpm h PRO 221 Ca -0.36 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.15 1jpm h PRO 221 Cb 0.78 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.81 1jpm h PRO 221 CO 0.20 0.25 -0.49 0.14 -0.23 0.00 0.00 178.00 177.87 1jpm s VAL 222 N -4.42 1.69 0.26 1.56 -7.23 -1.26 -1.55 120.40 109.44 1jpm s VAL 222 Ca -0.03 -1.83 -0.30 0.00 -1.81 0.00 0.00 61.98 58.01 1jpm s VAL 222 Cb 0.15 -2.51 -0.14 0.00 0.56 0.00 0.00 36.38 34.44 1jpm s VAL 222 CO 0.70 0.00 1.31 1.57 -0.31 0.00 0.00 175.10 178.36 1jpm n HIS 223 N -1.30 1.97 -0.07 2.82 -0.00 -1.26 -4.22 115.22 113.16 1jpm n HIS 223 Ca -0.09 0.52 0.25 0.00 -0.00 0.00 0.00 57.72 58.40 1jpm n HIS 223 Cb 0.66 -2.40 0.72 0.00 -0.00 0.00 0.00 29.99 28.96 1jpm n HIS 223 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 1jpm h LYS 224 N 3.51 0.00 -0.00 1.57 2.10 -1.92 -0.71 116.57 121.12 1jpm h LYS 224 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1jpm h LYS 224 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1jpm h LYS 224 CO 0.71 0.00 -0.41 -0.25 -2.00 0.00 0.00 179.45 177.49 1jpm n ASP 225 N -4.18 0.50 -3.81 7.07 9.92 -1.26 -4.34 116.55 120.45 1jpm n ASP 225 Ca 0.14 -0.25 -0.42 0.00 -0.53 0.00 0.00 54.79 53.73 1jpm n ASP 225 Cb 0.80 0.15 0.00 0.00 -0.64 0.00 0.00 41.12 41.43 1jpm n ASP 225 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1jpm n ASP 226 N -1.39 5.51 -0.27 -2.24 4.64 -0.27 -4.78 116.55 117.73 1jpm n ASP 226 Ca 0.07 -3.12 -0.05 0.00 -1.38 0.00 0.00 54.79 50.31 1jpm n ASP 226 Cb 0.33 -1.46 0.10 0.00 -1.04 0.00 0.00 41.12 39.05 1jpm n ASP 226 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1jpm h LEU 227 N 7.52 1.05 -0.96 -2.67 3.38 -1.81 0.49 115.31 122.30 1jpm h LEU 227 Ca 0.44 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1jpm h LEU 227 Cb 0.58 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1jpm h LEU 227 CO 1.61 0.92 0.58 0.00 0.09 0.00 0.00 178.44 181.64 1jpm h ALA 228 N 1.24 1.23 -0.27 1.53 0.00 -1.98 0.87 119.26 121.88 1jpm h ALA 228 Ca 0.26 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 1jpm h ALA 228 Cb 0.18 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1jpm h ALA 228 CO -0.03 0.67 -0.55 0.78 0.00 0.00 0.00 179.25 180.12 1jpm h GLY 229 N 1.32 0.91 0.98 0.00 0.00 -1.81 -1.22 103.07 103.25 1jpm h GLY 229 Ca 0.34 -1.07 -0.01 0.00 0.00 0.00 0.00 47.33 46.59 1jpm h GLY 229 CO -0.07 0.96 0.27 -2.00 0.00 0.00 0.00 176.54 175.71 1jpm h LEU 230 N 0.64 0.63 -1.13 3.11 5.85 -0.49 -2.02 115.31 121.90 1jpm h LEU 230 Ca 0.01 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1jpm h LEU 230 Cb 1.15 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1jpm h LEU 230 CO 0.12 0.54 0.25 0.50 -0.34 0.00 0.00 178.44 179.52 1jpm h LYS 231 N 0.66 0.87 -0.54 1.25 3.64 -0.70 -1.89 116.57 119.86 1jpm h LYS 231 Ca 0.18 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1jpm h LYS 231 Cb 0.06 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 1jpm h LYS 231 CO -0.03 0.70 0.29 -0.22 -2.27 0.00 0.00 179.45 177.92 1jpm h LYS 232 N 0.86 0.77 -0.66 1.90 3.64 -0.66 -0.50 116.57 121.92 1jpm h LYS 232 Ca 0.21 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.43 1jpm h LYS 232 Cb 0.15 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 1jpm h LYS 232 CO -0.02 0.60 0.15 0.28 -2.27 0.00 0.00 179.45 178.19 1jpm h VAL 233 N 0.73 1.25 -0.46 2.00 2.07 -1.02 -1.72 116.25 119.10 1jpm h VAL 233 Ca 0.19 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.74 1jpm h VAL 233 Cb 0.06 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1jpm h VAL 233 CO -0.03 0.36 0.19 0.74 0.02 0.00 0.00 177.57 178.85 1jpm h THR 234 N 1.00 1.20 -0.00 2.57 2.02 -0.88 -2.86 112.91 115.96 1jpm h THR 234 Ca 0.21 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.76 1jpm h THR 234 Cb 0.36 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1jpm h THR 234 CO 0.00 0.24 -0.05 0.47 0.37 0.00 0.00 175.52 176.54 1jpm n ASP 235 N -4.59 0.33 -0.00 4.18 8.00 -0.24 -3.88 116.55 120.35 1jpm n ASP 235 Ca 0.01 -0.61 0.06 0.00 0.71 0.00 0.00 54.79 54.96 1jpm n ASP 235 Cb 0.15 -0.11 -0.08 0.00 -0.02 0.00 0.00 41.12 41.07 1jpm n ASP 235 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jpm n ALA 236 N -0.97 3.68 -2.65 2.24 0.00 -0.66 -5.02 120.51 117.12 1jpm n ALA 236 Ca 0.17 -0.38 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 1jpm n ALA 236 Cb 0.24 -0.48 -0.09 0.00 0.00 0.00 0.00 19.45 19.11 1jpm n ALA 236 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1jpm s THR 237 N -2.29 1.70 -0.70 0.00 -4.23 -1.10 -5.03 115.64 103.99 1jpm s THR 237 Ca 0.05 -1.96 0.17 0.00 -1.18 0.00 0.00 61.69 58.77 1jpm s THR 237 Cb 0.10 -2.66 -0.20 0.00 1.34 0.00 0.00 72.50 71.08 1jpm s THR 237 CO 0.55 0.00 0.68 0.47 -0.54 0.00 0.00 174.62 175.78 1jpm n ASP 238 N -1.12 0.83 -4.75 3.99 8.00 -1.26 -4.94 116.55 117.30 1jpm n ASP 238 Ca -0.10 -0.78 -0.40 0.00 0.71 0.00 0.00 54.79 54.22 1jpm n ASP 238 Cb 0.67 1.12 -0.05 0.00 -0.02 0.00 0.00 41.12 42.83 1jpm n ASP 238 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1jpm s THR 239 N -2.72 4.44 0.35 -3.53 2.01 -1.26 -5.02 115.64 109.92 1jpm s THR 239 Ca 0.05 1.90 -0.27 0.00 0.31 0.00 0.00 61.69 63.67 1jpm s THR 239 Cb 0.13 -4.24 -0.09 0.00 0.01 0.00 0.00 72.50 68.31 1jpm s THR 239 CO 0.71 0.41 1.24 -2.16 -0.69 0.00 0.00 174.62 174.13 1jpm s PRO 240 N -0.48 4.25 -0.19 4.92 0.04 -1.26 -4.89 135.00 137.40 1jpm s PRO 240 Ca 0.41 2.05 -0.05 0.00 0.04 0.00 0.00 61.00 63.45 1jpm s PRO 240 Cb -0.23 -2.93 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 1jpm s PRO 240 CO 0.28 -0.22 0.01 0.42 0.04 0.00 0.00 177.00 177.53 1jpm s ILE 241 N -1.23 4.12 -0.20 0.56 -1.09 -1.26 -1.53 121.20 120.56 1jpm s ILE 241 Ca 0.52 -0.26 -0.05 0.00 -2.23 0.00 0.00 60.65 58.62 1jpm s ILE 241 Cb -0.36 -2.86 -0.03 0.00 -1.58 0.00 0.00 42.46 37.64 1jpm s ILE 241 CO 0.47 0.44 0.01 -0.32 -1.23 0.00 0.00 174.94 174.31 1jpm s MET 242 N 0.80 3.64 0.08 2.79 -2.45 0.22 -0.24 119.30 124.15 1jpm s MET 242 Ca 0.01 -0.51 -0.30 0.00 -1.25 0.00 0.00 55.69 53.64 1jpm s MET 242 Cb -0.14 -3.10 -0.05 0.00 1.25 0.00 0.00 34.83 32.79 1jpm s MET 242 CO 0.02 0.02 0.97 0.00 1.05 0.00 0.00 175.02 177.08 1jpm s ALA 243 N 1.00 3.22 0.00 4.11 0.00 0.06 0.44 121.76 130.60 1jpm s ALA 243 Ca 0.02 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1jpm s ALA 243 Cb -0.14 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1jpm s ALA 243 CO 0.02 -0.09 0.00 -3.47 0.00 0.00 0.00 175.76 172.22 1jpm n ASP 244 N 3.09 0.00 0.29 0.00 -0.08 -1.26 0.06 116.55 118.66 1jpm n ASP 244 Ca 0.03 0.00 0.18 0.00 -1.51 0.00 0.00 54.79 53.49 1jpm n ASP 244 Cb 0.50 0.00 0.92 0.00 2.34 0.00 0.00 41.12 44.87 1jpm n ASP 244 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1jpm h GLU 245 N 0.00 0.00 0.00 -0.67 3.07 -1.92 0.30 114.58 115.36 1jpm h GLU 245 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1jpm h GLU 245 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1jpm h GLU 245 CO 0.00 0.00 0.00 0.43 -1.40 0.00 0.00 179.01 178.04 1jpm n SER 246 N -3.16 0.55 -3.77 1.42 7.64 -1.26 -4.48 113.62 110.55 1jpm n SER 246 Ca -0.01 0.61 -0.29 0.00 1.01 0.00 0.00 58.87 60.19 1jpm n SER 246 Cb 0.31 -0.74 -0.16 0.00 -1.01 0.00 0.00 64.21 62.62 1jpm n SER 246 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1jpm s VAL 247 N -3.21 0.89 -0.19 0.44 1.01 0.11 -4.81 120.40 114.64 1jpm s VAL 247 Ca 0.06 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 1jpm s VAL 247 Cb 0.10 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.90 1jpm s VAL 247 CO 0.41 -0.43 -0.28 0.49 0.00 0.00 0.00 175.10 175.30 1jpm n PHE 248 N 4.87 0.00 -3.56 5.22 3.01 -1.26 -4.84 117.46 120.89 1jpm n PHE 248 Ca -0.06 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.20 1jpm n PHE 248 Cb 0.44 -0.69 -0.03 0.00 -0.01 0.00 0.00 39.48 39.20 1jpm n PHE 248 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1jpm s THR 249 N -2.47 3.00 0.40 4.37 -4.23 -1.26 -3.20 115.64 112.25 1jpm s THR 249 Ca -0.28 -1.30 0.14 0.00 -1.18 0.00 0.00 61.69 59.07 1jpm s THR 249 Cb 0.10 -3.07 0.14 0.00 1.34 0.00 0.00 72.50 71.01 1jpm s THR 249 CO 0.37 -0.05 1.91 1.55 -0.54 0.00 0.00 174.62 177.85 1jpm h PRO 250 N 1.04 0.00 -0.33 3.99 0.13 -1.94 0.00 132.00 134.88 1jpm h PRO 250 Ca -0.42 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.65 1jpm h PRO 250 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1jpm h PRO 250 CO 0.56 0.28 0.00 -0.09 -0.23 0.00 0.00 178.00 178.52 1jpm h ARG 251 N 0.00 0.59 -0.43 0.86 2.43 -1.98 0.22 114.38 116.06 1jpm h ARG 251 Ca -0.00 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 58.89 1jpm h ARG 251 Cb 0.50 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1jpm h ARG 251 CO 0.04 0.71 -0.11 1.96 -1.51 0.00 0.00 179.97 181.06 1jpm h GLN 252 N 0.39 0.78 -0.83 0.20 4.20 -1.83 -1.54 115.11 116.49 1jpm h GLN 252 Ca 0.10 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 1jpm h GLN 252 Cb 0.44 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 1jpm h GLN 252 CO 0.02 0.85 0.41 0.00 -0.67 0.00 0.00 178.83 179.44 1jpm h ALA 253 N 1.18 1.16 -0.68 3.87 0.00 -0.56 -1.26 119.26 122.97 1jpm h ALA 253 Ca 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1jpm h ALA 253 Cb 0.58 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1jpm h ALA 253 CO 0.04 0.64 0.31 0.35 0.00 0.00 0.00 179.25 180.60 1jpm h PHE 254 N 1.18 0.99 -0.24 0.00 3.57 0.11 -1.24 116.94 121.31 1jpm h PHE 254 Ca 0.29 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1jpm h PHE 254 Cb 0.10 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 1jpm h PHE 254 CO 0.01 0.75 0.11 1.49 -2.23 0.00 0.00 178.31 178.44 1jpm h GLU 255 N 0.95 0.35 -0.58 1.11 4.57 -0.63 0.16 114.58 120.51 1jpm h GLU 255 Ca 0.23 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.30 1jpm h GLU 255 Cb 0.14 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1jpm h GLU 255 CO -0.03 0.36 0.11 0.28 -1.18 0.00 0.00 179.01 178.56 1jpm h VAL 256 N 0.25 1.24 -0.09 0.32 2.07 -1.13 -2.38 116.25 116.53 1jpm h VAL 256 Ca 0.08 -0.91 -0.24 0.00 0.82 0.00 0.00 66.70 66.45 1jpm h VAL 256 Cb 0.14 0.68 0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1jpm h VAL 256 CO -0.01 0.34 -0.88 -0.07 0.02 0.00 0.00 177.57 176.97 1jpm h LEU 257 N 0.87 0.92 -0.92 2.57 3.38 -1.03 -1.43 115.31 119.67 1jpm h LEU 257 Ca 0.18 -0.66 -0.11 0.00 0.09 0.00 0.00 57.88 57.39 1jpm h LEU 257 Cb 0.36 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1jpm h LEU 257 CO 0.00 1.46 -0.42 0.06 0.09 0.00 0.00 178.44 179.64 1jpm h GLN 258 N 0.48 0.26 -0.00 1.13 3.07 -0.93 -2.78 115.11 116.34 1jpm h GLN 258 Ca -0.08 -0.13 0.00 0.00 0.09 0.00 0.00 58.65 58.53 1jpm h GLN 258 Cb 1.52 -0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.08 1jpm h GLN 258 CO 0.18 0.64 -0.40 0.25 0.09 0.00 0.00 178.83 179.58 1jpm n THR 259 N -4.02 0.00 -3.74 1.86 -2.24 -0.90 -4.96 114.28 100.28 1jpm n THR 259 Ca -0.02 -0.07 -0.25 0.00 -2.27 0.00 0.00 64.05 61.44 1jpm n THR 259 Cb 0.48 0.39 0.04 0.00 -2.10 0.00 0.00 70.33 69.15 1jpm n THR 259 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1jpm n ARG 260 N -1.04 -5.89 0.00 -0.78 1.74 -0.61 -4.89 116.66 105.18 1jpm n ARG 260 Ca 0.09 0.67 0.14 0.00 -0.77 0.00 0.00 57.85 57.98 1jpm n ARG 260 Cb 0.35 -5.50 0.67 0.00 -1.02 0.00 0.00 32.46 26.96 1jpm n ARG 260 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1jpm n SER 261 N -2.97 0.31 -3.60 0.55 7.64 -0.76 -4.89 113.62 109.91 1jpm n SER 261 Ca -0.11 -0.47 -0.13 0.00 1.01 0.00 0.00 58.87 59.18 1jpm n SER 261 Cb 0.59 -0.13 -0.05 0.00 -1.01 0.00 0.00 64.21 63.61 1jpm n SER 261 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jpm s ALA 262 N -2.48 -1.18 0.00 -0.43 0.00 -1.26 -2.97 121.76 113.45 1jpm s ALA 262 Ca 0.30 0.37 0.11 0.00 0.00 0.00 0.00 51.96 52.73 1jpm s ALA 262 Cb 0.20 0.48 -0.23 0.00 0.00 0.00 0.00 23.12 23.58 1jpm s ALA 262 CO 0.47 -0.54 0.83 -0.44 0.00 0.00 0.00 175.76 176.07 1jpm h ASP 263 N 2.69 0.01 -5.44 0.00 5.19 -0.96 -3.49 116.42 114.42 1jpm h ASP 263 Ca -0.32 -0.01 -0.22 0.00 -0.62 0.00 0.00 57.03 55.86 1jpm h ASP 263 Cb 1.23 -0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.59 1jpm h ASP 263 CO 0.43 1.01 -0.64 -0.76 -3.12 0.00 0.00 179.24 176.16 1jpm s LEU 264 N -6.27 1.51 -0.04 1.55 1.43 -0.68 -4.47 118.68 111.70 1jpm s LEU 264 Ca -0.03 -1.29 0.01 0.00 -1.03 0.00 0.00 54.13 51.79 1jpm s LEU 264 Cb 0.08 0.31 0.02 0.00 0.03 0.00 0.00 46.19 46.64 1jpm s LEU 264 CO 0.82 -0.77 -0.06 -0.63 0.23 0.00 0.00 176.35 175.95 1jpm s ILE 265 N -4.07 0.60 -0.23 -0.59 1.01 -1.19 -0.76 121.20 115.97 1jpm s ILE 265 Ca 0.31 -0.17 -0.14 0.00 0.00 0.00 0.00 60.65 60.65 1jpm s ILE 265 Cb 0.07 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.89 1jpm s ILE 265 CO 0.07 0.23 0.31 0.21 0.00 0.00 0.00 174.94 175.76 1jpm s ASN 266 N 0.81 6.28 -0.11 3.58 3.04 0.11 -1.42 114.94 127.23 1jpm s ASN 266 Ca -0.12 0.31 -0.04 0.00 0.04 0.00 0.00 52.86 53.05 1jpm s ASN 266 Cb -0.14 -2.18 -0.04 0.00 -1.54 0.00 0.00 41.25 37.35 1jpm s ASN 266 CO 0.01 -0.06 0.06 -0.63 -3.04 0.00 0.00 177.10 173.43 1jpm s ILE 267 N 1.46 4.82 -0.02 -5.21 1.01 0.19 -4.66 121.20 118.80 1jpm s ILE 267 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.74 1jpm s ILE 267 Cb -0.15 -3.07 0.02 0.00 0.01 0.00 0.00 42.46 39.27 1jpm s ILE 267 CO 0.08 0.60 0.02 -0.54 0.00 0.00 0.00 174.94 175.09 1jpm s LYS 268 N -0.84 0.07 0.24 2.79 1.02 -1.26 -0.84 119.74 120.92 1jpm s LYS 268 Ca 0.13 0.12 -0.06 0.00 0.02 0.00 0.00 55.97 56.19 1jpm s LYS 268 Cb -0.12 -0.28 0.33 0.00 -0.52 0.00 0.00 37.83 37.24 1jpm s LYS 268 CO 0.03 -0.13 1.85 -0.07 -0.92 0.00 0.00 175.35 176.11 1jpm h LEU 269 N 7.10 0.82 -0.92 3.17 3.38 -1.84 -1.85 115.31 125.18 1jpm h LEU 269 Ca -0.42 0.02 0.07 0.00 0.09 0.00 0.00 57.88 57.64 1jpm h LEU 269 Cb 1.14 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.67 1jpm h LEU 269 CO 0.48 0.53 0.57 0.24 0.09 0.00 0.00 178.44 180.35 1jpm h MET 270 N 0.96 0.99 -0.29 1.13 2.86 -1.89 -0.51 114.93 118.17 1jpm h MET 270 Ca 0.37 -0.06 -0.16 0.00 -2.06 0.00 0.00 59.70 57.80 1jpm h MET 270 Cb 0.17 -0.22 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 1jpm h MET 270 CO -0.17 0.66 -0.43 0.87 1.06 0.00 0.00 176.91 178.89 1jpm h LYS 271 N 1.02 0.81 -0.00 1.72 1.57 -1.69 -3.19 116.57 116.81 1jpm h LYS 271 Ca 0.41 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1jpm h LYS 271 Cb 0.22 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1jpm h LYS 271 CO -0.19 1.11 -0.04 0.00 -0.57 0.00 0.00 179.45 179.76 1jpm n ALA 272 N -2.54 2.63 -1.15 3.86 0.00 -0.76 -4.48 120.51 118.07 1jpm n ALA 272 Ca -0.04 -0.21 -0.05 0.00 0.00 0.00 0.00 53.44 53.14 1jpm n ALA 272 Cb 0.56 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.56 1jpm n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jpm n GLY 273 N 1.22 0.78 0.00 0.00 0.00 -0.34 -4.43 105.19 102.42 1jpm n GLY 273 Ca 0.17 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1jpm n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jpm n GLY 274 N -2.32 0.76 0.08 -0.02 0.00 -0.37 -2.68 105.19 100.64 1jpm n GLY 274 Ca -0.05 -2.05 -0.10 0.00 0.00 0.00 0.00 46.02 43.81 1jpm n GLY 274 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jpm h ILE 275 N 0.00 1.43 -0.05 -0.61 2.04 -1.87 -3.17 117.51 115.28 1jpm h ILE 275 Ca 0.00 -3.13 -0.00 0.00 1.00 0.00 0.00 64.86 62.73 1jpm h ILE 275 Cb 0.00 2.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.85 1jpm h ILE 275 CO 0.00 0.85 0.03 0.77 0.00 0.00 0.00 178.15 179.80 1jpm h SER 276 N 0.02 0.06 -0.40 1.72 4.64 -1.91 0.10 113.55 117.78 1jpm h SER 276 Ca -0.12 -0.09 -0.05 0.00 -0.47 0.00 0.00 61.79 61.06 1jpm h SER 276 Cb 1.89 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.95 1jpm h SER 276 CO 0.14 0.13 0.05 1.23 -0.87 0.00 0.00 176.83 177.50 1jpm h GLY 277 N -0.01 0.72 0.55 -0.77 0.00 -1.77 -2.04 103.07 99.75 1jpm h GLY 277 Ca 0.02 -0.50 0.09 0.00 0.00 0.00 0.00 47.33 46.94 1jpm h GLY 277 CO -0.00 0.46 0.52 0.00 0.00 0.00 0.00 176.54 177.51 1jpm h ALA 278 N 0.91 1.24 -0.40 3.60 0.00 -1.49 -0.05 119.26 123.07 1jpm h ALA 278 Ca 0.12 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1jpm h ALA 278 Cb 0.40 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1jpm h ALA 278 CO 0.01 0.16 -0.06 1.49 0.00 0.00 0.00 179.25 180.85 1jpm h GLU 279 N 0.87 0.67 -0.18 0.00 4.81 -0.75 -2.23 114.58 117.77 1jpm h GLU 279 Ca 0.41 -0.19 -0.18 0.00 -0.13 0.00 0.00 59.36 59.27 1jpm h GLU 279 Cb 0.35 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1jpm h GLU 279 CO -0.24 0.73 -0.62 0.87 -0.73 0.00 0.00 179.01 179.03 1jpm h LYS 280 N 0.63 0.64 0.04 1.92 1.57 -0.42 -2.26 116.57 118.69 1jpm h LYS 280 Ca 0.12 -0.44 -0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1jpm h LYS 280 Cb 0.48 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1jpm h LYS 280 CO 0.03 1.06 -0.02 0.82 -0.57 0.00 0.00 179.45 180.77 1jpm h ILE 281 N 0.48 1.00 -0.75 1.86 2.04 -0.83 -1.51 117.51 119.81 1jpm h ILE 281 Ca -0.01 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1jpm h ILE 281 Cb 1.20 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 1jpm h ILE 281 CO 0.12 0.04 0.46 -1.13 0.00 0.00 0.00 178.15 177.64 1jpm h ASN 282 N -0.12 0.89 -0.46 1.72 -1.24 -1.43 -0.91 115.58 114.03 1jpm h ASN 282 Ca -0.01 -0.05 -0.00 0.00 0.71 0.00 0.00 56.30 56.95 1jpm h ASN 282 Cb 0.10 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 38.91 1jpm h ASN 282 CO 0.01 0.68 0.28 0.00 -1.29 0.00 0.00 177.43 177.10 1jpm h ALA 283 N 1.25 0.58 0.15 1.57 0.00 -1.24 0.08 119.26 121.65 1jpm h ALA 283 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1jpm h ALA 283 Cb -0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1jpm h ALA 283 CO -0.05 0.07 -0.14 0.52 0.00 0.00 0.00 179.25 179.64 1jpm h MET 284 N 0.61 -0.30 -0.07 0.00 2.86 -0.90 -1.99 114.93 115.13 1jpm h MET 284 Ca 0.16 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.85 1jpm h MET 284 Cb -0.01 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1jpm h MET 284 CO -0.03 -0.20 -0.10 0.00 1.06 0.00 0.00 176.91 177.63 1jpm h ALA 285 N 0.51 -0.05 -0.61 6.32 0.00 -0.97 -2.44 119.26 122.02 1jpm h ALA 285 Ca 0.00 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.05 1jpm h ALA 285 Cb 0.30 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 1jpm h ALA 285 CO -0.04 -0.57 0.18 1.49 0.00 0.00 0.00 179.25 180.32 1jpm h GLU 286 N -0.14 0.32 0.00 0.00 4.81 -0.89 0.41 114.58 119.09 1jpm h GLU 286 Ca 0.06 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1jpm h GLU 286 Cb 0.23 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 1jpm h GLU 286 CO -0.16 0.21 -0.01 0.00 -0.73 0.00 0.00 179.01 178.33 1jpm h ALA 287 N 1.46 1.46 -0.74 2.92 0.00 -0.92 0.45 119.26 123.89 1jpm h ALA 287 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1jpm h ALA 287 Cb 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1jpm h ALA 287 CO -0.36 0.01 0.00 0.00 0.00 0.00 0.00 179.25 178.90 1jpm n GLY 289 N 1.65 1.23 3.46 0.00 0.00 0.15 -4.99 105.19 106.68 1jpm n GLY 289 Ca 0.25 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 1jpm n GLY 289 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jpm s VAL 290 N -2.40 4.59 0.58 1.61 1.01 0.29 -4.97 120.40 121.10 1jpm s VAL 290 Ca 0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.59 1jpm s VAL 290 Cb 0.00 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 1jpm s VAL 290 CO 0.00 0.20 1.03 -1.61 0.00 0.00 0.00 175.10 174.71 1jpm s GLU 291 N 1.63 3.56 0.27 2.72 2.02 -1.26 -3.27 118.70 124.37 1jpm s GLU 291 Ca 0.06 1.03 0.07 0.00 0.02 0.00 0.00 54.97 56.15 1jpm s GLU 291 Cb -0.16 -2.07 -0.06 0.00 0.10 0.00 0.00 34.13 31.94 1jpm s GLU 291 CO 0.06 -0.60 -0.09 0.00 0.02 0.00 0.00 175.26 174.65 1jpm s MET 293 N -3.69 1.09 -0.11 0.00 1.75 -0.51 -2.14 119.30 115.70 1jpm s MET 293 Ca 0.28 -1.17 0.03 0.00 -1.25 0.00 0.00 55.69 53.58 1jpm s MET 293 Cb 0.02 -1.25 -0.00 0.00 2.84 0.00 0.00 34.83 36.44 1jpm s MET 293 CO 0.12 0.28 -0.22 0.08 -0.65 0.00 0.00 175.02 174.63 1jpm s VAL 294 N -1.39 2.25 0.00 10.11 1.01 -0.96 0.57 120.40 131.99 1jpm s VAL 294 Ca 0.07 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1jpm s VAL 294 Cb -0.09 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1jpm s VAL 294 CO 0.04 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.30 1jpm n GLY 295 N 3.62 5.14 3.35 4.51 0.00 -0.02 -1.67 105.19 120.13 1jpm n GLY 295 Ca -0.19 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.16 1jpm n GLY 295 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jpm n SER 296 N 0.00 -1.25 -2.20 1.61 3.41 -1.26 -4.69 113.62 109.25 1jpm n SER 296 Ca 0.00 -1.48 -0.02 0.00 -0.26 0.00 0.00 58.87 57.11 1jpm n SER 296 Cb 0.00 1.99 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 1jpm n SER 296 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1jpm n MET 297 N -0.71 1.19 -2.21 4.33 2.81 -1.26 -4.98 117.12 116.29 1jpm n MET 297 Ca 0.01 -0.22 -0.39 0.00 -1.81 0.00 0.00 57.70 55.28 1jpm n MET 297 Cb 0.50 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.98 1jpm n MET 297 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1jpm s ILE 298 N 0.33 3.48 0.09 2.02 1.01 -1.26 -4.89 121.20 121.99 1jpm s ILE 298 Ca 0.03 0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.99 1jpm s ILE 298 Cb -0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1jpm s ILE 298 CO 0.02 -1.20 -0.07 -1.61 0.00 0.00 0.00 174.94 172.07 1jpm s GLU 299 N 6.57 0.81 0.35 2.79 2.02 -1.26 -4.77 118.70 125.21 1jpm s GLU 299 Ca 0.57 -1.25 -0.06 0.00 0.02 0.00 0.00 54.97 54.25 1jpm s GLU 299 Cb -0.11 -0.28 0.08 0.00 0.10 0.00 0.00 34.13 33.92 1jpm s GLU 299 CO 0.19 0.01 0.43 0.25 0.02 0.00 0.00 175.26 176.16 1jpm n THR 300 N 0.19 0.00 0.30 3.63 -2.24 -1.26 -3.47 114.28 111.44 1jpm n THR 300 Ca -0.14 -0.29 0.18 0.00 -2.27 0.00 0.00 64.05 61.53 1jpm n THR 300 Cb 0.60 -1.65 0.86 0.00 -2.10 0.00 0.00 70.33 68.04 1jpm n THR 300 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1jpm h LYS 301 N 0.00 0.00 0.64 -0.78 3.64 -1.96 -2.83 116.57 115.28 1jpm h LYS 301 Ca -0.14 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 1jpm h LYS 301 Cb 0.40 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1jpm h LYS 301 CO 0.10 0.00 -0.31 1.25 -2.27 0.00 0.00 179.45 178.22 1jpm h LEU 302 N 0.00 -0.72 -1.24 5.20 5.85 -1.96 0.83 115.31 123.27 1jpm h LEU 302 Ca 0.00 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.78 1jpm h LEU 302 Cb 0.22 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1jpm h LEU 302 CO 0.00 -0.35 0.54 1.23 -0.34 0.00 0.00 178.44 179.53 1jpm h GLY 303 N -1.17 1.17 1.39 3.75 0.00 -1.87 -1.27 103.07 105.07 1jpm h GLY 303 Ca -0.09 -0.37 -0.12 0.00 0.00 0.00 0.00 47.33 46.75 1jpm h GLY 303 CO 0.14 0.27 -0.30 -2.22 0.00 0.00 0.00 176.54 174.44 1jpm h ILE 304 N 0.92 1.28 -0.55 2.60 1.08 -1.48 -2.05 117.51 119.31 1jpm h ILE 304 Ca 0.36 -1.42 -0.02 0.00 -0.39 0.00 0.00 64.86 63.38 1jpm h ILE 304 Cb 0.22 1.35 -0.03 0.00 -3.07 0.00 0.00 36.82 35.29 1jpm h ILE 304 CO -0.13 0.46 0.25 0.74 -0.69 0.00 0.00 178.15 178.79 1jpm h THR 305 N 0.59 1.21 -0.15 -0.27 2.02 0.33 0.39 112.91 117.03 1jpm h THR 305 Ca 0.07 -0.61 -0.01 0.00 0.77 0.00 0.00 66.41 66.63 1jpm h THR 305 Cb 0.80 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1jpm h THR 305 CO 0.07 0.24 0.06 0.00 0.37 0.00 0.00 175.52 176.26 1jpm h ALA 306 N 1.09 0.19 -0.77 6.16 0.00 -1.32 -0.05 119.26 124.56 1jpm h ALA 306 Ca 0.19 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1jpm h ALA 306 Cb 0.15 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1jpm h ALA 306 CO -0.02 -0.24 0.47 0.00 0.00 0.00 0.00 179.25 179.46 1jpm h ALA 307 N 0.92 1.04 -0.40 0.00 0.00 -1.04 -1.69 119.26 118.10 1jpm h ALA 307 Ca 0.05 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1jpm h ALA 307 Cb 0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1jpm h ALA 307 CO -0.01 0.21 -0.20 0.00 0.00 0.00 0.00 179.25 179.25 1jpm h ALA 308 N 1.36 0.89 -0.48 0.00 0.00 0.11 0.70 119.26 121.84 1jpm h ALA 308 Ca 0.33 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1jpm h ALA 308 Cb 0.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1jpm h ALA 308 CO -0.16 0.63 0.18 0.45 0.00 0.00 0.00 179.25 180.35 1jpm h HIS 309 N 0.68 0.74 0.09 0.00 3.86 -0.52 0.26 115.15 120.27 1jpm h HIS 309 Ca 0.10 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1jpm h HIS 309 Cb 0.71 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1jpm h HIS 309 CO 0.04 0.63 -0.04 0.35 0.86 0.00 0.00 177.93 179.77 1jpm h PHE 310 N 0.64 -0.11 -0.70 2.45 3.57 -1.10 -2.90 116.94 118.79 1jpm h PHE 310 Ca 0.16 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.71 1jpm h PHE 310 Cb 0.21 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1jpm h PHE 310 CO 0.01 0.11 0.40 0.00 -2.23 0.00 0.00 178.31 176.59 1jpm h ALA 311 N 0.58 0.94 0.00 2.41 0.00 -0.62 -2.51 119.26 120.06 1jpm h ALA 311 Ca -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1jpm h ALA 311 Cb 0.26 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1jpm h ALA 311 CO 0.02 0.09 -0.16 0.00 0.00 0.00 0.00 179.25 179.20 1jpm h ALA 312 N 1.35 1.18 0.00 0.00 0.00 -0.48 -3.20 119.26 118.10 1jpm h ALA 312 Ca 0.31 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1jpm h ALA 312 Cb 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1jpm h ALA 312 CO -0.17 0.20 -0.36 0.66 0.00 0.00 0.00 179.25 179.58 1jpm h SER 313 N 0.00 0.00 -3.17 0.00 4.64 -1.23 -1.14 113.55 112.65 1jpm h SER 313 Ca -0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 1jpm h SER 313 Cb 0.49 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.44 1jpm h SER 313 CO 0.02 0.36 -0.56 -0.54 -0.87 0.00 0.00 176.83 175.24 1jpm s LYS 314 N -3.15 3.62 0.25 4.77 -0.14 -1.21 -2.78 119.74 121.09 1jpm s LYS 314 Ca 0.04 -0.32 -0.02 0.00 -1.36 0.00 0.00 55.97 54.31 1jpm s LYS 314 Cb 0.08 -3.10 0.31 0.00 -1.68 0.00 0.00 37.83 33.44 1jpm s LYS 314 CO 0.71 0.48 1.71 -0.09 -0.76 0.00 0.00 175.35 177.40 1jpm h ARG 315 N 5.97 0.71 0.00 1.68 2.43 -1.88 -2.89 114.38 120.40 1jpm h ARG 315 Ca -0.44 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.49 1jpm h ARG 315 Cb 1.19 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1jpm h ARG 315 CO 0.64 0.81 0.00 -1.71 -1.51 0.00 0.00 179.97 178.20 1jpm n ASN 316 N -4.16 0.00 -4.48 -3.80 5.15 -1.26 -4.49 115.26 102.22 1jpm n ASN 316 Ca 0.01 0.08 -0.43 0.00 -0.60 0.00 0.00 54.58 53.64 1jpm n ASN 316 Cb 0.37 -0.32 -0.09 0.00 -0.53 0.00 0.00 39.78 39.21 1jpm n ASN 316 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1jpm s ILE 317 N -2.64 5.11 -0.75 -1.44 1.01 -1.09 -2.14 121.20 119.26 1jpm s ILE 317 Ca 0.18 -0.42 0.06 0.00 0.00 0.00 0.00 60.65 60.47 1jpm s ILE 317 Cb 0.14 -4.03 0.04 0.00 0.01 0.00 0.00 42.46 38.62 1jpm s ILE 317 CO 0.32 -0.42 0.67 0.35 0.00 0.00 0.00 174.94 175.87 1jpm n THR 318 N 5.39 0.00 -4.09 2.92 -2.24 -0.91 -4.90 114.28 110.45 1jpm n THR 318 Ca -0.08 -0.49 -0.14 0.00 -2.27 0.00 0.00 64.05 61.07 1jpm n THR 318 Cb 0.47 1.12 -0.12 0.00 -2.10 0.00 0.00 70.33 69.70 1jpm n THR 318 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1jpm s ARG 319 N -0.56 0.50 -0.02 -0.78 0.52 -1.23 -5.04 118.95 112.34 1jpm s ARG 319 Ca 0.07 -0.59 0.01 0.00 -0.52 0.00 0.00 55.73 54.70 1jpm s ARG 319 Cb 0.05 -0.34 0.01 0.00 0.52 0.00 0.00 34.95 35.19 1jpm s ARG 319 CO 0.08 0.07 -0.03 -0.06 0.02 0.00 0.00 175.30 175.39 1jpm s PHE 320 N -1.00 0.38 -0.55 -0.53 0.40 -1.26 -2.27 117.98 113.15 1jpm s PHE 320 Ca -0.06 -0.06 0.04 0.00 -0.60 0.00 0.00 56.93 56.25 1jpm s PHE 320 Cb -0.08 -0.33 0.15 0.00 0.51 0.00 0.00 43.02 43.28 1jpm s PHE 320 CO 0.00 -0.06 0.36 0.34 0.70 0.00 0.00 175.22 176.56 1jpm s ASP 321 N 0.36 3.76 -0.39 1.36 3.68 -0.67 -2.45 116.67 122.33 1jpm s ASP 321 Ca -0.04 -3.25 0.10 0.00 2.13 0.00 0.00 52.55 51.49 1jpm s ASP 321 Cb -0.07 -1.23 0.44 0.00 -1.45 0.00 0.00 42.92 40.61 1jpm s ASP 321 CO -0.01 -0.17 1.06 0.49 0.13 0.00 0.00 175.17 176.68 1jpm n PHE 322 N 2.72 2.58 1.11 -5.34 0.99 -1.26 -4.00 117.46 114.26 1jpm n PHE 322 Ca 0.17 -2.94 0.12 0.00 -0.00 0.00 0.00 57.45 54.80 1jpm n PHE 322 Cb 0.37 -0.20 0.16 0.00 -1.00 0.00 0.00 39.48 38.82 1jpm n PHE 322 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 1jpm n ASP 323 N -0.36 1.50 -0.24 4.37 3.85 -1.26 -4.54 116.55 119.87 1jpm n ASP 323 Ca 0.29 -1.18 0.03 0.00 -0.71 0.00 0.00 54.79 53.22 1jpm n ASP 323 Cb 0.73 0.35 0.13 0.00 -1.35 0.00 0.00 41.12 40.98 1jpm n ASP 323 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jpm h ALA 324 N 3.73 0.70 0.00 2.12 0.00 -1.88 0.47 119.26 124.40 1jpm h ALA 324 Ca 0.00 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1jpm h ALA 324 Cb 0.63 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1jpm h ALA 324 CO 0.00 -0.42 -0.08 -1.35 0.00 0.00 0.00 179.25 177.40 1jpm h PRO 325 N 0.09 0.00 0.00 0.00 0.11 -1.79 -0.66 132.00 129.75 1jpm h PRO 325 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1jpm h PRO 325 Cb 0.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1jpm h PRO 325 CO -0.64 0.08 0.00 1.28 -0.21 0.00 0.00 178.00 178.51 1jpm n LEU 326 N -4.19 0.00 -1.16 2.35 4.77 0.15 -2.38 117.00 116.54 1jpm n LEU 326 Ca -0.03 0.36 0.12 0.00 -0.03 0.00 0.00 56.01 56.43 1jpm n LEU 326 Cb 0.17 -0.36 0.25 0.00 -2.33 0.00 0.00 43.42 41.14 1jpm n LEU 326 CO 0.33 -0.12 0.72 0.23 -1.33 0.00 0.00 177.39 177.22 1jpm n MET 327 N -1.36 2.50 -4.12 3.23 2.81 -0.26 -4.91 117.12 115.01 1jpm n MET 327 Ca 0.08 -2.28 -0.36 0.00 -1.81 0.00 0.00 57.70 53.33 1jpm n MET 327 Cb 0.18 -1.52 -0.08 0.00 -0.71 0.00 0.00 33.22 31.10 1jpm n MET 327 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1jpm s LEU 328 N -1.39 3.99 0.60 4.03 1.43 -1.00 -1.44 118.68 124.89 1jpm s LEU 328 Ca 0.40 0.30 0.40 0.00 -1.03 0.00 0.00 54.13 54.20 1jpm s LEU 328 Cb 0.23 -1.96 2.00 0.00 0.03 0.00 0.00 46.19 46.49 1jpm s LEU 328 CO 0.32 0.39 2.20 0.11 0.23 0.00 0.00 176.35 179.59 1jpm h LYS 329 N 5.03 0.00 -2.68 1.70 1.57 -1.48 -3.44 116.57 117.27 1jpm h LYS 329 Ca -0.53 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.17 1jpm h LYS 329 Cb 1.21 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.34 1jpm h LYS 329 CO 0.56 0.00 -0.05 -0.08 -0.57 0.00 0.00 179.45 179.32 1jpm s THR 330 N -3.94 0.03 -0.37 -0.16 -1.32 -1.26 -5.07 115.64 103.55 1jpm s THR 330 Ca -0.03 -0.29 -0.16 0.00 -1.21 0.00 0.00 61.69 60.01 1jpm s THR 330 Cb 0.11 -0.86 -0.00 0.00 -1.51 0.00 0.00 72.50 70.24 1jpm s THR 330 CO 0.44 -0.16 0.37 -0.62 -2.21 0.00 0.00 174.62 172.44 1jpm s ASP 331 N -1.53 6.17 0.00 8.08 2.15 -1.26 -4.96 116.67 125.32 1jpm s ASP 331 Ca -0.10 -0.41 0.25 0.00 0.43 0.00 0.00 52.55 52.72 1jpm s ASP 331 Cb -0.02 -2.20 0.85 0.00 -0.30 0.00 0.00 42.92 41.25 1jpm s ASP 331 CO 0.04 -0.41 1.62 1.33 -0.17 0.00 0.00 175.17 177.58 1jpm n VAL 332 N 5.28 0.08 -4.83 1.11 0.24 -1.26 -4.71 118.33 114.24 1jpm n VAL 332 Ca -0.09 -0.33 -0.31 0.00 -2.04 0.00 0.00 64.34 61.57 1jpm n VAL 332 Cb 0.49 0.59 -0.13 0.00 -1.47 0.00 0.00 33.84 33.31 1jpm n VAL 332 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1jpm s PHE 333 N -1.92 2.53 -0.26 6.34 0.40 -1.26 -0.50 117.98 123.31 1jpm s PHE 333 Ca 0.35 -0.28 -0.09 0.00 -0.60 0.00 0.00 56.93 56.31 1jpm s PHE 333 Cb 0.20 -1.50 -0.04 0.00 0.51 0.00 0.00 43.02 42.19 1jpm s PHE 333 CO 0.31 0.18 0.13 1.21 0.70 0.00 0.00 175.22 177.75 1jpm s ASN 334 N -1.14 5.58 0.00 1.36 2.47 0.10 -4.59 114.94 118.72 1jpm s ASN 334 Ca 0.13 -0.10 0.00 0.00 0.42 0.00 0.00 52.86 53.31 1jpm s ASN 334 Cb -0.10 -2.02 0.00 0.00 -1.45 0.00 0.00 41.25 37.68 1jpm s ASN 334 CO 0.03 -0.03 0.00 0.61 -3.72 0.00 0.00 177.10 173.98 1jpm n GLY 335 N 4.94 -0.98 7.00 1.21 0.00 -1.26 -0.19 105.19 115.92 1jpm n GLY 335 Ca -0.15 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.78 1jpm n GLY 335 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jpm n GLY 336 N 0.00 -1.73 3.72 -0.02 0.00 -0.16 -4.86 105.19 102.13 1jpm n GLY 336 Ca 0.00 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.37 1jpm n GLY 336 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1jpm s ILE 337 N 0.00 2.76 0.10 -0.61 -5.25 -1.26 -4.47 121.20 112.46 1jpm s ILE 337 Ca 0.00 0.25 0.08 0.00 -0.99 0.00 0.00 60.65 59.99 1jpm s ILE 337 Cb 0.00 -2.68 -0.03 0.00 2.95 0.00 0.00 42.46 42.70 1jpm s ILE 337 CO 0.00 -0.32 -0.21 0.42 -1.79 0.00 0.00 174.94 173.03 1jpm s THR 338 N -2.88 1.76 -0.07 8.37 -4.23 -0.94 -4.96 115.64 112.69 1jpm s THR 338 Ca 0.63 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 59.61 1jpm s THR 338 Cb -0.18 -1.59 -0.03 0.00 1.34 0.00 0.00 72.50 72.04 1jpm s THR 338 CO 0.57 -0.02 -0.02 -0.31 -0.54 0.00 0.00 174.62 174.30 1jpm s TYR 339 N -1.12 3.09 -0.42 3.99 1.51 -1.26 -1.22 117.35 121.93 1jpm s TYR 339 Ca 0.07 0.13 0.04 0.00 -1.01 0.00 0.00 57.07 56.30 1jpm s TYR 339 Cb -0.10 -1.75 0.17 0.00 -0.11 0.00 0.00 41.96 40.17 1jpm s TYR 339 CO 0.04 0.43 0.39 0.45 -1.11 0.00 0.00 175.55 175.75 1jpm s SER 340 N -0.95 1.13 1.18 2.29 0.15 -0.29 -5.02 113.70 112.20 1jpm s SER 340 Ca 0.14 -2.64 0.00 0.00 0.70 0.00 0.00 55.95 54.14 1jpm s SER 340 Cb -0.11 0.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.20 1jpm s SER 340 CO 0.03 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1jpm n GLY 341 N 3.12 1.27 0.19 9.45 0.00 -1.26 -2.29 105.19 115.66 1jpm n GLY 341 Ca 0.25 -0.54 0.13 0.00 0.00 0.00 0.00 46.02 45.85 1jpm n GLY 341 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jpm n SER 342 N 7.15 0.92 -4.67 1.61 3.41 -1.26 -4.87 113.62 115.91 1jpm n SER 342 Ca 0.00 -0.75 -0.41 0.00 -0.26 0.00 0.00 58.87 57.45 1jpm n SER 342 Cb 0.00 0.18 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 1jpm n SER 342 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1jpm s THR 343 N -2.63 4.92 -0.17 6.66 2.01 -0.97 -1.09 115.64 124.38 1jpm s THR 343 Ca 0.21 1.55 -0.06 0.00 0.31 0.00 0.00 61.69 63.70 1jpm s THR 343 Cb 0.19 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 1jpm s THR 343 CO 0.57 0.07 0.02 -0.63 -0.69 0.00 0.00 174.62 173.96 1jpm s ILE 344 N 1.94 4.41 -0.07 1.82 1.01 0.05 -1.13 121.20 129.22 1jpm s ILE 344 Ca 0.37 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.86 1jpm s ILE 344 Cb -0.17 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 1jpm s ILE 344 CO 0.13 0.48 -0.10 -0.44 0.00 0.00 0.00 174.94 175.01 1jpm s SER 345 N 0.29 4.35 0.26 3.58 0.01 -0.36 -1.48 113.70 120.35 1jpm s SER 345 Ca 0.01 -0.13 -0.29 0.00 1.31 0.00 0.00 55.95 56.85 1jpm s SER 345 Cb -0.13 -1.12 -0.09 0.00 0.21 0.00 0.00 66.02 64.89 1jpm s SER 345 CO 0.01 0.33 0.98 -0.04 0.41 0.00 0.00 173.24 174.93 1jpm s MET 346 N -0.60 4.77 0.81 12.44 -1.94 -0.22 -2.21 119.30 132.35 1jpm s MET 346 Ca 0.09 1.55 -0.12 0.00 -1.71 0.00 0.00 55.69 55.50 1jpm s MET 346 Cb -0.11 -3.20 0.08 0.00 2.01 0.00 0.00 34.83 33.60 1jpm s MET 346 CO 0.02 0.41 1.14 -1.25 -0.01 0.00 0.00 175.02 175.33 1jpm s PRO 347 N -1.35 2.01 -0.00 2.03 0.04 -1.26 -4.96 135.00 131.51 1jpm s PRO 347 Ca 0.43 0.31 0.22 0.00 0.04 0.00 0.00 61.00 62.00 1jpm s PRO 347 Cb -0.27 -1.94 -0.20 0.00 0.04 0.00 0.00 34.50 32.13 1jpm s PRO 347 CO 0.33 -1.60 0.79 0.41 0.04 0.00 0.00 177.00 176.97 1jpm n GLY 348 N -2.82 -1.04 3.80 0.56 0.00 -1.26 -4.92 105.19 99.51 1jpm n GLY 348 Ca 0.07 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 1jpm n GLY 348 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jpm s LYS 349 N -3.21 3.02 0.76 1.61 1.02 -1.26 -4.64 119.74 117.05 1jpm s LYS 349 Ca 0.02 1.16 -0.15 0.00 0.02 0.00 0.00 55.97 57.02 1jpm s LYS 349 Cb 0.15 -1.99 0.03 0.00 -0.52 0.00 0.00 37.83 35.50 1jpm s LYS 349 CO 0.87 -1.04 1.04 -2.30 -0.92 0.00 0.00 175.35 173.00 1jpm n PRO 350 N -2.55 0.38 0.00 -1.68 -0.02 -1.26 -3.95 135.00 125.92 1jpm n PRO 350 Ca 0.09 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1jpm n PRO 350 Cb 0.53 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1jpm n PRO 350 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jpm n GLY 351 N 0.91 1.16 0.17 -1.23 0.00 0.40 -3.33 105.19 103.26 1jpm n GLY 351 Ca 0.13 -0.71 0.04 0.00 0.00 0.00 0.00 46.02 45.48 1jpm n GLY 351 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jpm h LEU 352 N 0.00 0.00 0.00 0.99 3.38 -1.84 0.14 115.31 117.98 1jpm h LEU 352 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1jpm h LEU 352 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1jpm h LEU 352 CO 0.00 0.43 0.00 0.61 0.09 0.00 0.00 178.44 179.57 1jpm n GLY 353 N 0.42 0.71 3.65 0.83 0.00 -1.21 -4.34 105.19 105.25 1jpm n GLY 353 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1jpm n GLY 353 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jpm s ILE 354 N -2.00 4.78 -0.08 -0.61 -1.09 -1.26 -0.99 121.20 119.94 1jpm s ILE 354 Ca 0.00 1.76 -0.15 0.00 -2.23 0.00 0.00 60.65 60.03 1jpm s ILE 354 Cb 0.00 -4.20 -0.28 0.00 -1.58 0.00 0.00 42.46 36.40 1jpm s ILE 354 CO 0.00 -0.10 0.61 0.40 -1.23 0.00 0.00 174.94 174.62 1jpm h ILE 355 N 5.40 1.04 0.00 2.92 2.04 -0.92 -3.48 117.51 124.52 1jpm h ILE 355 Ca -0.22 -2.44 0.00 0.00 1.00 0.00 0.00 64.86 63.20 1jpm h ILE 355 Cb 1.09 2.76 0.00 0.00 -0.74 0.00 0.00 36.82 39.93 1jpm h ILE 355 CO 0.91 0.74 0.00 0.61 0.00 0.00 0.00 178.15 180.41 1jpm n GLY 356 N 1.77 -0.51 3.78 5.37 0.00 -1.14 -5.00 105.19 109.46 1jpm n GLY 356 Ca -0.24 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.61 1jpm n GLY 356 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jpm s ALA 357 N -1.00 2.58 -2.00 4.61 0.00 -1.26 0.03 121.76 124.72 1jpm s ALA 357 Ca 0.00 0.47 0.20 0.00 0.00 0.00 0.00 51.96 52.63 1jpm s ALA 357 Cb 0.00 -3.28 1.19 0.00 0.00 0.00 0.00 23.12 21.03 1jpm s ALA 357 CO 0.00 -1.09 1.58 0.00 0.00 0.00 0.00 175.76 176.25