#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jah h ALA 4 N 0.00 1.42 -0.18 7.33 0.00 -1.90 -2.52 119.26 123.41 2jah h ALA 4 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2jah h ALA 4 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2jah h ALA 4 CO 0.00 0.01 -0.02 1.28 0.00 0.00 0.00 179.25 180.52 2jah n LEU 5 N -3.71 3.39 -4.68 0.00 4.77 -0.04 -5.03 117.00 111.71 2jah n LEU 5 Ca -0.03 -3.13 -0.45 0.00 -0.03 0.00 0.00 56.01 52.37 2jah n LEU 5 Cb 0.09 -0.52 -0.04 0.00 -2.33 0.00 0.00 43.42 40.63 2jah n LEU 5 CO 0.26 0.75 1.27 0.00 -1.33 0.00 0.00 177.39 178.34 2jah n GLN 6 N -0.88 2.33 -0.12 3.23 1.13 -0.95 -1.17 117.38 120.96 2jah n GLN 6 Ca 0.21 0.84 0.00 0.00 -1.94 0.00 0.00 57.00 56.11 2jah n GLN 6 Cb 0.82 -2.64 0.00 0.00 0.11 0.00 0.00 30.24 28.53 2jah n GLN 6 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jah n GLY 7 N 3.64 2.37 3.88 1.08 0.00 -1.23 -4.98 105.19 109.95 2jah n GLY 7 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2jah n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jah s LYS 8 N -0.13 3.67 -0.15 1.61 -0.14 -0.31 -4.92 119.74 119.36 2jah s LYS 8 Ca 0.00 0.46 0.02 0.00 -1.36 0.00 0.00 55.97 55.09 2jah s LYS 8 Cb 0.00 -2.30 0.01 0.00 -1.68 0.00 0.00 37.83 33.86 2jah s LYS 8 CO 0.00 -0.23 -0.20 0.08 -0.76 0.00 0.00 175.35 174.24 2jah s VAL 9 N -2.69 1.96 -0.07 3.17 1.01 -1.26 -1.03 120.40 121.48 2jah s VAL 9 Ca 0.51 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2jah s VAL 9 Cb -0.10 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2jah s VAL 9 CO 0.41 0.53 -0.12 0.00 0.00 0.00 0.00 175.10 175.91 2jah s ALA 10 N 1.01 2.73 -0.23 5.51 0.00 0.72 -0.86 121.76 130.63 2jah s ALA 10 Ca -0.03 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 50.96 2jah s ALA 10 Cb -0.15 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 21.90 2jah s ALA 10 CO -0.05 0.49 -0.06 -1.17 0.00 0.00 0.00 175.76 174.97 2jah s LEU 11 N -0.51 2.98 -0.21 0.00 2.96 0.64 0.02 118.68 124.56 2jah s LEU 11 Ca 0.07 -0.63 -0.03 0.00 -0.22 0.00 0.00 54.13 53.32 2jah s LEU 11 Cb -0.12 -1.69 -0.00 0.00 0.50 0.00 0.00 46.19 44.89 2jah s LEU 11 CO 0.02 -0.07 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.26 2jah s ILE 12 N 1.40 3.03 0.32 6.68 1.09 0.18 -0.26 121.20 133.63 2jah s ILE 12 Ca 0.03 -0.61 -0.07 0.00 -1.10 0.00 0.00 60.65 58.91 2jah s ILE 12 Cb -0.15 -2.36 -0.06 0.00 -1.06 0.00 0.00 42.46 38.84 2jah s ILE 12 CO -0.05 0.45 0.62 0.42 -0.10 0.00 0.00 174.94 176.29 2jah s THR 13 N 1.42 4.95 -1.16 2.92 -4.23 -0.39 -0.88 115.64 118.27 2jah s THR 13 Ca 0.05 0.22 -0.04 0.00 -1.18 0.00 0.00 61.69 60.75 2jah s THR 13 Cb -0.14 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 69.97 2jah s THR 13 CO -0.06 -0.38 0.99 0.61 -0.54 0.00 0.00 174.62 175.24 2jah n GLY 14 N -1.04 -0.34 0.41 3.99 0.00 0.92 -2.88 105.19 106.24 2jah n GLY 14 Ca -0.01 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.25 2jah n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jah n ALA 15 N -4.28 2.94 0.26 4.61 0.00 -0.75 -3.66 120.51 119.63 2jah n ALA 15 Ca -0.14 -0.47 0.13 0.00 0.00 0.00 0.00 53.44 52.96 2jah n ALA 15 Cb 0.61 -1.07 0.32 0.00 0.00 0.00 0.00 19.45 19.31 2jah n ALA 15 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jah h SER 16 N 2.01 0.00 -5.21 0.00 4.64 -1.91 -3.20 113.55 109.88 2jah h SER 16 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2jah h SER 16 Cb 0.58 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.64 2jah h SER 16 CO 0.00 0.00 0.08 -0.94 -0.87 0.00 0.00 176.83 175.10 2jah s SER 17 N -5.97 0.34 1.16 4.97 1.04 -1.26 -4.79 113.70 109.18 2jah s SER 17 Ca 0.06 -1.25 0.00 0.00 0.48 0.00 0.00 55.95 55.24 2jah s SER 17 Cb 0.06 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.95 2jah s SER 17 CO 0.63 -1.51 0.00 0.61 0.98 0.00 0.00 173.24 173.95 2jah n GLY 18 N -0.54 3.07 0.20 7.32 0.00 -1.26 -2.35 105.19 111.63 2jah n GLY 18 Ca -0.04 -0.33 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 2jah n GLY 18 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jah h ILE 19 N 0.00 1.14 -0.64 -0.61 2.04 -1.88 -2.69 117.51 114.88 2jah h ILE 19 Ca 0.00 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.57 2jah h ILE 19 Cb 0.00 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.58 2jah h ILE 19 CO 0.00 0.15 0.38 1.23 0.00 0.00 0.00 178.15 179.90 2jah h GLY 20 N 0.60 0.92 0.97 5.37 0.00 -1.62 0.67 103.07 109.98 2jah h GLY 20 Ca 0.16 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 2jah h GLY 20 CO -0.03 0.21 0.13 -2.09 0.00 0.00 0.00 176.54 174.76 2jah h GLU 21 N 0.72 0.30 -0.78 4.80 4.81 -1.38 -0.24 114.58 122.82 2jah h GLU 21 Ca 0.27 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 2jah h GLU 21 Cb 0.09 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 2jah h GLU 21 CO -0.14 0.24 0.39 0.00 -0.73 0.00 0.00 179.01 178.78 2jah h ALA 22 N 1.04 1.22 -0.32 2.92 0.00 -1.15 -2.22 119.26 120.74 2jah h ALA 22 Ca 0.08 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2jah h ALA 22 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2jah h ALA 22 CO -0.01 0.61 0.00 1.15 0.00 0.00 0.00 179.25 180.99 2jah h THR 23 N 1.10 1.26 -0.49 0.00 2.02 -0.62 -0.79 112.91 115.39 2jah h THR 23 Ca 0.27 -0.95 0.06 0.00 0.77 0.00 0.00 66.41 66.56 2jah h THR 23 Cb 0.08 1.25 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 2jah h THR 23 CO -0.04 0.31 0.20 0.00 0.37 0.00 0.00 175.52 176.36 2jah h ALA 24 N 0.85 0.61 -0.53 6.16 0.00 -0.96 -0.35 119.26 125.04 2jah h ALA 24 Ca 0.09 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2jah h ALA 24 Cb 0.44 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2jah h ALA 24 CO 0.02 -0.18 0.32 0.00 0.00 0.00 0.00 179.25 179.41 2jah h ARG 25 N 0.40 0.62 -0.51 0.00 3.08 -1.24 -0.64 114.38 116.10 2jah h ARG 25 Ca 0.23 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.15 2jah h ARG 25 Cb 0.20 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2jah h ARG 25 CO -0.20 0.41 -0.03 0.00 -1.07 0.00 0.00 179.97 179.07 2jah h ALA 26 N 1.23 0.69 -0.18 0.04 0.00 -0.77 -1.16 119.26 119.11 2jah h ALA 26 Ca 0.21 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2jah h ALA 26 Cb 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2jah h ALA 26 CO -0.09 0.52 -0.28 -0.07 0.00 0.00 0.00 179.25 179.33 2jah h LEU 27 N 0.78 0.56 -0.92 0.00 3.38 -0.95 -2.74 115.31 115.43 2jah h LEU 27 Ca 0.14 -0.53 0.12 0.00 0.09 0.00 0.00 57.88 57.70 2jah h LEU 27 Cb 0.56 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.07 2jah h LEU 27 CO 0.03 0.98 0.55 0.00 0.09 0.00 0.00 178.44 180.09 2jah h ALA 28 N 0.60 1.37 -0.15 1.53 0.00 -1.11 -2.00 119.26 119.49 2jah h ALA 28 Ca 0.02 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2jah h ALA 28 Cb 0.86 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2jah h ALA 28 CO 0.07 0.13 -0.05 0.00 0.00 0.00 0.00 179.25 179.39 2jah h ALA 29 N 1.52 1.64 -0.05 0.00 0.00 -0.98 -1.17 119.26 120.21 2jah h ALA 29 Ca 0.46 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2jah h ALA 29 Cb 0.48 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2jah h ALA 29 CO -0.28 0.27 0.00 0.39 0.00 0.00 0.00 179.25 179.63 2jah n GLU 30 N -4.35 1.17 -0.18 0.00 -0.58 -0.79 -4.74 120.64 111.16 2jah n GLU 30 Ca -0.01 -0.26 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 2jah n GLU 30 Cb 0.20 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 2jah n GLU 30 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jah n GLY 31 N 0.81 0.73 3.78 0.62 0.00 -0.44 -0.86 105.19 109.83 2jah n GLY 31 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2jah n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jah s ALA 32 N -2.21 3.13 0.13 4.61 0.00 -0.96 -3.58 121.76 122.89 2jah s ALA 32 Ca 0.00 0.75 -0.30 0.00 0.00 0.00 0.00 51.96 52.41 2jah s ALA 32 Cb 0.00 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 2jah s ALA 32 CO 0.00 -0.24 1.01 0.00 0.00 0.00 0.00 175.76 176.52 2jah s ALA 33 N -1.57 3.29 -0.10 0.00 0.00 -0.20 -4.28 121.76 118.90 2jah s ALA 33 Ca 0.56 0.65 0.04 0.00 0.00 0.00 0.00 51.96 53.21 2jah s ALA 33 Cb -0.24 -3.30 -0.00 0.00 0.00 0.00 0.00 23.12 19.58 2jah s ALA 33 CO 0.30 -0.08 -0.23 0.14 0.00 0.00 0.00 175.76 175.90 2jah s VAL 34 N -0.09 2.16 -0.28 0.00 -7.23 -0.52 -0.20 120.40 114.23 2jah s VAL 34 Ca 0.48 -0.98 -0.09 0.00 -1.81 0.00 0.00 61.98 59.57 2jah s VAL 34 Cb -0.25 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 2jah s VAL 34 CO 0.31 0.56 0.13 0.00 -0.31 0.00 0.00 175.10 175.79 2jah s ALA 35 N 0.36 3.32 -0.24 1.32 0.00 0.10 -0.94 121.76 125.68 2jah s ALA 35 Ca -0.18 -1.19 -0.05 0.00 0.00 0.00 0.00 51.96 50.54 2jah s ALA 35 Cb -0.18 -2.30 -0.00 0.00 0.00 0.00 0.00 23.12 20.64 2jah s ALA 35 CO 0.08 -0.63 -0.00 0.96 0.00 0.00 0.00 175.76 176.17 2jah s ILE 36 N 1.66 3.60 -0.07 0.00 -4.36 -0.25 -0.65 121.20 121.13 2jah s ILE 36 Ca 0.06 -0.54 0.05 0.00 -0.26 0.00 0.00 60.65 59.96 2jah s ILE 36 Cb -0.16 -2.71 -0.01 0.00 1.25 0.00 0.00 42.46 40.83 2jah s ILE 36 CO 0.07 0.31 -0.23 0.00 0.24 0.00 0.00 174.94 175.33 2jah s ALA 37 N 1.49 2.24 0.06 2.27 0.00 -0.06 -1.19 121.76 126.57 2jah s ALA 37 Ca 0.05 -1.02 -0.20 0.00 0.00 0.00 0.00 51.96 50.79 2jah s ALA 37 Cb -0.15 -0.77 0.07 0.00 0.00 0.00 0.00 23.12 22.27 2jah s ALA 37 CO -0.01 0.39 0.93 0.00 0.00 0.00 0.00 175.76 177.07 2jah n ALA 38 N 3.06 -2.54 -0.04 0.00 0.00 -0.99 -0.06 120.51 119.94 2jah n ALA 38 Ca -0.18 -0.73 -0.10 0.00 0.00 0.00 0.00 53.44 52.44 2jah n ALA 38 Cb 0.52 0.28 -0.14 0.00 0.00 0.00 0.00 19.45 20.11 2jah n ALA 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jah n ARG 39 N -0.66 0.65 -2.74 0.00 1.74 -1.20 -0.54 116.66 113.90 2jah n ARG 39 Ca 0.01 0.23 -0.43 0.00 -0.77 0.00 0.00 57.85 56.89 2jah n ARG 39 Cb 0.47 -1.73 -0.02 0.00 -1.02 0.00 0.00 32.46 30.16 2jah n ARG 39 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2jah s ARG 40 N -2.57 3.72 0.31 5.56 0.52 -1.26 -4.84 118.95 120.39 2jah s ARG 40 Ca -0.07 -1.67 0.01 0.00 -0.52 0.00 0.00 55.73 53.49 2jah s ARG 40 Cb 0.07 -5.20 0.56 0.00 0.52 0.00 0.00 34.95 30.90 2jah s ARG 40 CO 0.82 -2.01 1.92 -0.39 0.02 0.00 0.00 175.30 175.66 2jah h VAL 41 N 6.00 1.07 -0.35 3.52 -1.51 -1.95 -2.32 116.25 120.71 2jah h VAL 41 Ca 0.24 -0.34 -0.08 0.00 -1.23 0.00 0.00 66.70 65.29 2jah h VAL 41 Cb 0.97 -0.01 -0.02 0.00 -2.13 0.00 0.00 31.29 30.11 2jah h VAL 41 CO 1.30 0.18 -0.11 -0.33 -1.23 0.00 0.00 177.57 177.39 2jah h GLU 42 N 0.99 0.61 -0.46 5.19 5.08 -1.99 0.19 114.58 124.19 2jah h GLU 42 Ca 0.37 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.43 2jah h GLU 42 Cb 0.18 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2jah h GLU 42 CO -0.13 0.71 -0.16 0.87 -1.00 0.00 0.00 179.01 179.30 2jah h LYS 43 N 0.56 0.93 -0.47 2.33 1.57 -1.83 -2.70 116.57 116.95 2jah h LYS 43 Ca 0.10 -0.38 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 2jah h LYS 43 Cb 0.52 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 2jah h LYS 43 CO 0.03 1.04 0.24 -0.07 -0.57 0.00 0.00 179.45 180.11 2jah h LEU 44 N 0.77 0.61 -1.11 2.94 3.38 -0.86 -1.47 115.31 119.58 2jah h LEU 44 Ca 0.11 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2jah h LEU 44 Cb 0.72 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2jah h LEU 44 CO 0.06 0.56 0.07 0.03 0.09 0.00 0.00 178.44 179.24 2jah h ARG 45 N 0.62 0.70 -0.51 1.13 3.08 -0.68 0.20 114.38 118.92 2jah h ARG 45 Ca 0.16 -0.14 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 2jah h ARG 45 Cb 0.10 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2jah h ARG 45 CO -0.02 0.66 -0.11 0.00 -1.07 0.00 0.00 179.97 179.43 2jah h ALA 46 N 1.41 0.85 -0.20 0.04 0.00 -1.14 -0.90 119.26 119.32 2jah h ALA 46 Ca 0.15 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2jah h ALA 46 Cb 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2jah h ALA 46 CO 0.00 0.65 -0.11 1.25 0.00 0.00 0.00 179.25 181.05 2jah h LEU 47 N 0.84 0.45 -1.04 0.00 5.85 -0.97 -2.84 115.31 117.60 2jah h LEU 47 Ca 0.13 -0.42 0.10 0.00 0.84 0.00 0.00 57.88 58.53 2jah h LEU 47 Cb 0.65 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.48 2jah h LEU 47 CO 0.05 0.77 0.63 1.23 -0.34 0.00 0.00 178.44 180.77 2jah h GLY 48 N 0.13 1.54 0.96 3.75 0.00 -0.44 0.91 103.07 109.91 2jah h GLY 48 Ca 0.04 -0.43 -0.06 0.00 0.00 0.00 0.00 47.33 46.88 2jah h GLY 48 CO 0.03 0.23 0.03 -0.55 0.00 0.00 0.00 176.54 176.28 2jah h ASP 49 N 1.04 0.73 -0.09 0.19 3.32 -1.16 0.05 116.42 120.50 2jah h ASP 49 Ca 0.46 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2jah h ASP 49 Cb 0.36 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2jah h ASP 49 CO -0.22 0.84 0.05 -0.08 -1.72 0.00 0.00 179.24 178.11 2jah h GLU 50 N 0.60 0.10 -0.68 3.56 4.81 -1.07 -0.16 114.58 121.74 2jah h GLU 50 Ca 0.13 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2jah h GLU 50 Cb 0.45 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 2jah h GLU 50 CO 0.02 0.07 0.29 -0.07 -0.73 0.00 0.00 179.01 178.58 2jah h LEU 51 N 0.11 0.92 -0.52 1.64 3.38 -0.73 -1.62 115.31 118.49 2jah h LEU 51 Ca 0.03 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2jah h LEU 51 Cb -0.00 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2jah h LEU 51 CO -0.02 0.83 0.23 0.74 0.09 0.00 0.00 178.44 180.30 2jah h THR 52 N 0.95 1.21 -0.11 0.22 2.02 -0.89 -1.59 112.91 114.72 2jah h THR 52 Ca 0.23 -0.63 0.03 0.00 0.77 0.00 0.00 66.41 66.82 2jah h THR 52 Cb 0.18 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2jah h THR 52 CO -0.02 0.24 0.08 0.00 0.37 0.00 0.00 175.52 176.19 2jah h ALA 53 N 1.07 2.07 -0.00 6.16 0.00 -0.62 -1.22 119.26 126.72 2jah h ALA 53 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2jah h ALA 53 Cb 0.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2jah h ALA 53 CO -0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 179.25 178.98 2jah n ALA 54 N -2.54 2.73 0.00 0.00 0.00 -0.64 -4.92 120.51 115.13 2jah n ALA 54 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2jah n ALA 54 Cb 0.20 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2jah n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jah n GLY 55 N 1.30 0.80 3.87 0.00 0.00 -0.46 -5.06 105.19 105.63 2jah n GLY 55 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2jah n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jah s ALA 56 N -2.00 3.40 -0.10 4.61 0.00 -0.64 -4.99 121.76 122.04 2jah s ALA 56 Ca 0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 51.96 51.58 2jah s ALA 56 Cb 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 2jah s ALA 56 CO 0.00 0.23 0.63 0.21 0.00 0.00 0.00 175.76 176.83 2jah s LYS 57 N -3.33 4.38 -0.04 0.00 2.20 -1.26 -4.05 119.74 117.64 2jah s LYS 57 Ca 0.51 0.72 0.05 0.00 -0.36 0.00 0.00 55.97 56.89 2jah s LYS 57 Cb -0.10 -3.46 -0.01 0.00 -1.51 0.00 0.00 37.83 32.75 2jah s LYS 57 CO 0.24 0.05 -0.18 0.08 -0.36 0.00 0.00 175.35 175.19 2jah s VAL 58 N 0.89 1.45 -0.18 4.02 1.01 -1.26 -1.44 120.40 124.88 2jah s VAL 58 Ca 0.33 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.58 2jah s VAL 58 Cb -0.17 -1.23 0.02 0.00 0.00 0.00 0.00 36.38 35.00 2jah s VAL 58 CO 0.15 0.41 -0.19 -2.28 0.00 0.00 0.00 175.10 173.19 2jah s HIS 59 N -0.06 2.79 -0.14 5.22 2.46 -0.11 -4.99 115.29 120.45 2jah s HIS 59 Ca -0.02 -1.57 -0.20 0.00 0.47 0.00 0.00 55.06 53.75 2jah s HIS 59 Cb -0.11 -1.93 -0.04 0.00 -0.13 0.00 0.00 32.58 30.38 2jah s HIS 59 CO 0.02 -0.77 0.55 0.08 -2.47 0.00 0.00 174.74 172.15 2jah s VAL 60 N 1.26 5.12 -0.24 0.89 1.01 -1.26 -1.10 120.40 126.08 2jah s VAL 60 Ca 0.04 1.09 0.02 0.00 0.00 0.00 0.00 61.98 63.13 2jah s VAL 60 Cb -0.13 -3.89 0.05 0.00 0.00 0.00 0.00 36.38 32.42 2jah s VAL 60 CO -0.11 0.24 -0.11 -0.76 0.00 0.00 0.00 175.10 174.36 2jah s LEU 61 N 1.08 3.07 -0.11 3.92 1.43 -0.33 -4.94 118.68 122.79 2jah s LEU 61 Ca 0.28 -1.24 -0.30 0.00 -1.03 0.00 0.00 54.13 51.85 2jah s LEU 61 Cb -0.16 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 2jah s LEU 61 CO 0.12 -0.17 1.18 -0.70 0.23 0.00 0.00 176.35 177.01 2jah s GLU 62 N 1.19 4.31 -0.24 1.70 2.12 -1.26 -2.33 118.70 124.19 2jah s GLU 62 Ca -0.06 1.61 -0.13 0.00 0.36 0.00 0.00 54.97 56.74 2jah s GLU 62 Cb -0.19 -3.63 0.07 0.00 0.26 0.00 0.00 34.13 30.64 2jah s GLU 62 CO -0.06 -0.54 0.58 -1.17 -0.54 0.00 0.00 175.26 173.53 2jah s LEU 63 N 2.71 -0.64 -0.37 2.70 2.96 0.29 -4.92 118.68 121.43 2jah s LEU 63 Ca 0.53 1.29 -0.15 0.00 -0.22 0.00 0.00 54.13 55.58 2jah s LEU 63 Cb -0.22 1.99 -0.00 0.00 0.50 0.00 0.00 46.19 48.46 2jah s LEU 63 CO 0.17 -0.22 0.33 -0.62 -1.32 0.00 0.00 176.35 174.70 2jah s ASP 64 N 1.61 6.14 0.54 3.68 -1.08 -1.26 -3.27 116.67 123.03 2jah s ASP 64 Ca -0.10 -0.46 0.30 0.00 -0.52 0.00 0.00 52.55 51.78 2jah s ASP 64 Cb -0.07 -2.18 1.50 0.00 -1.46 0.00 0.00 42.92 40.72 2jah s ASP 64 CO -0.17 -0.37 2.07 1.62 0.52 0.00 0.00 175.17 178.83 2jah h VAL 65 N 5.57 0.39 0.00 1.11 3.04 -1.95 -2.00 116.25 122.42 2jah h VAL 65 Ca -0.29 -0.53 0.00 0.00 -1.01 0.00 0.00 66.70 64.87 2jah h VAL 65 Cb 1.14 1.38 0.00 0.00 -2.01 0.00 0.00 31.29 31.80 2jah h VAL 65 CO 0.70 0.09 0.00 0.00 -1.01 0.00 0.00 177.57 177.36 2jah h ALA 66 N 1.90 1.00 -2.01 3.17 0.00 -1.89 -3.38 119.26 118.05 2jah h ALA 66 Ca -0.00 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.23 2jah h ALA 66 Cb 0.37 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.99 2jah h ALA 66 CO 0.01 0.00 0.15 0.34 0.00 0.00 0.00 179.25 179.75 2jah s ASP 67 N -4.89 6.23 0.13 0.00 2.15 -0.75 -4.87 116.67 114.66 2jah s ASP 67 Ca 0.02 -0.92 -0.19 0.00 0.43 0.00 0.00 52.55 51.89 2jah s ASP 67 Cb 0.09 -2.32 -0.02 0.00 -0.30 0.00 0.00 42.92 40.38 2jah s ASP 67 CO 0.44 -0.99 1.74 -0.09 -0.17 0.00 0.00 175.17 176.10 2jah h ARG 68 N 9.09 0.14 -0.11 4.34 2.43 -1.85 -1.00 114.38 127.42 2jah h ARG 68 Ca -0.28 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 58.93 2jah h ARG 68 Cb 1.09 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.55 2jah h ARG 68 CO 1.01 0.09 -0.29 1.96 -1.51 0.00 0.00 179.97 181.23 2jah h GLN 69 N 0.15 -0.37 -0.90 0.20 7.50 -1.95 -1.48 115.11 118.26 2jah h GLN 69 Ca 0.11 0.02 0.14 0.00 0.50 0.00 0.00 58.65 59.42 2jah h GLN 69 Cb 0.10 0.08 -0.07 0.00 0.05 0.00 0.00 27.48 27.64 2jah h GLN 69 CO -0.13 -0.24 0.58 0.78 -1.50 0.00 0.00 178.83 178.31 2jah h GLY 70 N -0.38 1.24 0.83 3.46 0.00 -1.78 -0.83 103.07 105.62 2jah h GLY 70 Ca 0.09 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 2jah h GLY 70 CO -0.32 0.10 -0.01 -2.08 0.00 0.00 0.00 176.54 174.23 2jah h VAL 71 N 0.72 1.11 -0.76 4.60 2.07 -0.51 -0.85 116.25 122.63 2jah h VAL 71 Ca 0.45 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.60 2jah h VAL 71 Cb 0.68 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.79 2jah h VAL 71 CO -0.21 0.10 0.50 0.44 0.02 0.00 0.00 177.57 178.42 2jah h ASP 72 N -0.20 0.83 0.14 0.57 5.19 -0.47 -2.10 116.42 120.37 2jah h ASP 72 Ca -0.00 -0.01 -0.15 0.00 -0.62 0.00 0.00 57.03 56.24 2jah h ASP 72 Cb 0.19 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.49 2jah h ASP 72 CO 0.01 0.58 -0.56 0.00 -3.12 0.00 0.00 179.24 176.15 2jah h ALA 73 N 1.55 0.77 -0.46 3.45 0.00 -1.04 -2.48 119.26 121.05 2jah h ALA 73 Ca 0.29 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 2jah h ALA 73 Cb -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2jah h ALA 73 CO -0.08 0.69 -0.10 0.00 0.00 0.00 0.00 179.25 179.76 2jah h ALA 74 N 1.06 0.63 0.22 0.00 0.00 -0.57 -0.49 119.26 120.12 2jah h ALA 74 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2jah h ALA 74 Cb 1.08 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2jah h ALA 74 CO 0.10 0.52 -0.10 0.28 0.00 0.00 0.00 179.25 180.04 2jah h VAL 75 N 0.72 0.81 -0.50 0.00 2.07 -1.39 -2.39 116.25 115.57 2jah h VAL 75 Ca 0.12 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.59 2jah h VAL 75 Cb 0.65 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 2jah h VAL 75 CO 0.04 0.03 0.20 0.00 0.02 0.00 0.00 177.57 177.86 2jah h ALA 76 N 0.43 0.61 -0.74 1.67 0.00 -1.42 -2.25 119.26 117.56 2jah h ALA 76 Ca -0.03 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2jah h ALA 76 Cb 0.27 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2jah h ALA 76 CO 0.05 -0.19 0.42 1.03 0.00 0.00 0.00 179.25 180.56 2jah h SER 77 N 0.39 0.63 -0.18 0.00 0.87 -1.04 -1.78 113.55 112.44 2jah h SER 77 Ca 0.23 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.81 2jah h SER 77 Cb 0.22 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 2jah h SER 77 CO -0.22 0.40 0.07 0.74 -0.53 0.00 0.00 176.83 177.29 2jah h THR 78 N 0.76 1.16 -0.50 2.23 2.02 -1.11 -0.12 112.91 117.36 2jah h THR 78 Ca 0.33 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 66.97 2jah h THR 78 Cb 0.22 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 2jah h THR 78 CO -0.19 0.15 0.04 0.58 0.37 0.00 0.00 175.52 176.47 2jah h VAL 79 N 0.14 1.24 0.03 3.16 2.07 -1.16 0.96 116.25 122.69 2jah h VAL 79 Ca 0.06 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 2jah h VAL 79 Cb 0.17 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2jah h VAL 79 CO -0.00 0.34 -0.01 -0.08 0.02 0.00 0.00 177.57 177.83 2jah h GLU 80 N 0.75 -0.04 -0.23 1.57 4.57 -1.26 -1.26 114.58 118.69 2jah h GLU 80 Ca 0.15 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 58.15 2jah h GLU 80 Cb 0.40 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 2jah h GLU 80 CO 0.01 0.13 -0.59 0.00 -1.18 0.00 0.00 179.01 177.38 2jah h ALA 81 N 0.77 0.52 -0.00 2.92 0.00 -0.70 -3.39 119.26 119.38 2jah h ALA 81 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2jah h ALA 81 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2jah h ALA 81 CO 0.01 0.69 -0.13 1.28 0.00 0.00 0.00 179.25 181.10 2jah n LEU 82 N -3.97 0.25 0.00 0.00 4.77 0.33 -5.04 117.00 113.33 2jah n LEU 82 Ca -0.04 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 2jah n LEU 82 Cb 0.64 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 2jah n LEU 82 CO 0.50 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 2jah n GLY 83 N 0.99 2.38 0.00 -0.72 0.00 -0.47 -4.96 105.19 102.41 2jah n GLY 83 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2jah n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jah n GLY 84 N -0.49 -0.54 3.03 -0.02 0.00 -1.25 -4.94 105.19 100.98 2jah n GLY 84 Ca 0.00 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 2jah n GLY 84 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jah s LEU 85 N 0.00 -0.31 -0.13 0.99 2.96 -1.26 -4.39 118.68 116.54 2jah s LEU 85 Ca 0.00 0.63 0.06 0.00 -0.22 0.00 0.00 54.13 54.59 2jah s LEU 85 Cb 0.00 0.76 -0.12 0.00 0.50 0.00 0.00 46.19 47.33 2jah s LEU 85 CO 0.00 -0.24 -0.04 0.47 -1.32 0.00 0.00 176.35 175.22 2jah n ASP 86 N 5.32 2.53 -3.84 3.68 8.00 -0.03 -4.09 116.55 128.11 2jah n ASP 86 Ca -0.07 -0.04 -0.20 0.00 0.71 0.00 0.00 54.79 55.20 2jah n ASP 86 Cb 0.50 0.28 -0.17 0.00 -0.02 0.00 0.00 41.12 41.71 2jah n ASP 86 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jah s ILE 87 N -2.28 0.39 -0.13 0.53 1.01 -0.13 -0.87 121.20 119.71 2jah s ILE 87 Ca -0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 60.65 60.52 2jah s ILE 87 Cb 0.04 -0.47 -0.01 0.00 0.01 0.00 0.00 42.46 42.03 2jah s ILE 87 CO 0.40 0.21 -0.14 -0.22 0.00 0.00 0.00 174.94 175.19 2jah s LEU 88 N 1.17 2.67 -0.33 2.97 2.96 -0.18 -0.26 118.68 127.67 2jah s LEU 88 Ca -0.07 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.47 2jah s LEU 88 Cb -0.14 -1.60 0.07 0.00 0.50 0.00 0.00 46.19 45.02 2jah s LEU 88 CO -0.02 0.15 0.06 -0.69 -1.32 0.00 0.00 176.35 174.53 2jah s VAL 89 N 0.44 2.99 -1.14 1.68 1.01 0.64 0.55 120.40 126.57 2jah s VAL 89 Ca -0.10 -1.66 -0.16 0.00 0.00 0.00 0.00 61.98 60.05 2jah s VAL 89 Cb -0.16 -2.85 0.13 0.00 0.00 0.00 0.00 36.38 33.50 2jah s VAL 89 CO 0.05 -0.31 1.42 0.20 0.00 0.00 0.00 175.10 176.45 2jah s ASN 90 N 1.38 6.88 -0.07 3.32 0.01 0.64 -1.26 114.94 125.84 2jah s ASN 90 Ca -0.00 -2.56 0.15 0.00 -0.71 0.00 0.00 52.86 49.75 2jah s ASN 90 Cb -0.21 -2.44 -0.23 0.00 0.41 0.00 0.00 41.25 38.78 2jah s ASN 90 CO -0.03 -0.95 0.25 -3.20 -1.51 0.00 0.00 177.10 171.66 2jah n ASN 91 N 6.59 1.24 -4.62 -1.22 2.85 -1.21 -4.70 115.26 114.19 2jah n ASN 91 Ca 0.36 0.00 -0.52 0.00 -0.11 0.00 0.00 54.58 54.30 2jah n ASN 91 Cb 0.45 1.45 -0.06 0.00 1.24 0.00 0.00 39.78 42.86 2jah n ASN 91 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jah n ALA 92 N -2.24 -0.53 -3.53 5.20 0.00 -1.14 -4.77 120.51 113.50 2jah n ALA 92 Ca -0.11 0.48 -0.08 0.00 0.00 0.00 0.00 53.44 53.73 2jah n ALA 92 Cb 0.63 -2.14 -0.03 0.00 0.00 0.00 0.00 19.45 17.90 2jah n ALA 92 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jah s GLY 93 N 1.18 -0.40 0.00 0.00 0.00 -1.26 -4.61 107.32 102.22 2jah s GLY 93 Ca 0.87 1.30 0.00 0.00 0.00 0.00 0.00 44.72 46.88 2jah s GLY 93 CO 0.49 0.51 0.00 0.29 0.00 0.00 0.00 173.10 174.39 2jah n ILE 94 N -0.01 0.00 0.00 0.90 -5.35 -1.26 -5.04 119.36 108.60 2jah n ILE 94 Ca -0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 2jah n ILE 94 Cb 0.60 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 2jah n ILE 94 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2jah n LEU 96 N 0.00 0.00 -4.89 7.28 4.77 -1.26 -4.93 117.00 117.97 2jah n LEU 96 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 2jah n LEU 96 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2jah n LEU 96 CO 0.00 0.00 0.13 -0.76 -1.33 0.00 0.00 177.39 175.43 2jah s LEU 97 N 0.00 4.19 0.00 2.23 1.43 -1.26 -4.74 118.68 120.52 2jah s LEU 97 Ca 0.00 0.73 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 2jah s LEU 97 Cb 0.00 -3.49 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2jah s LEU 97 CO 0.00 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.14 2jah n GLY 98 N -0.23 2.50 3.71 -3.19 0.00 -0.24 -4.04 105.19 103.72 2jah n GLY 98 Ca -0.01 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 2jah n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jah s PRO 99 N -2.00 1.83 0.12 1.61 0.04 -1.26 -4.19 135.00 131.15 2jah s PRO 99 Ca 0.00 1.63 -0.14 0.00 0.04 0.00 0.00 61.00 62.53 2jah s PRO 99 Cb 0.00 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.70 2jah s PRO 99 CO 0.00 -2.04 1.53 0.28 0.04 0.00 0.00 177.00 176.81 2jah h VAL 100 N -0.84 1.28 -2.12 -0.36 2.07 -2.00 -3.38 116.25 110.89 2jah h VAL 100 Ca -0.46 -1.18 -0.60 0.00 0.82 0.00 0.00 66.70 65.27 2jah h VAL 100 Cb 1.28 1.24 0.04 0.00 -1.52 0.00 0.00 31.29 32.32 2jah h VAL 100 CO 0.47 0.40 0.94 1.21 0.02 0.00 0.00 177.57 180.61 2jah n GLU 101 N -4.35 2.12 -2.46 1.57 2.13 -1.26 -2.04 120.64 116.35 2jah n GLU 101 Ca -0.01 0.77 -0.13 0.00 0.66 0.00 0.00 57.16 58.45 2jah n GLU 101 Cb 0.36 -2.58 -0.01 0.00 0.27 0.00 0.00 31.44 29.49 2jah n GLU 101 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2jah n ASP 102 N 5.05 -3.96 -4.75 4.31 8.00 -1.26 -4.91 116.55 119.03 2jah n ASP 102 Ca 0.20 0.18 -0.37 0.00 0.71 0.00 0.00 54.79 55.50 2jah n ASP 102 Cb 0.29 -3.36 0.03 0.00 -0.02 0.00 0.00 41.12 38.06 2jah n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jah s ALA 103 N -2.63 2.77 -0.41 2.24 0.00 -0.87 -4.94 121.76 117.92 2jah s ALA 103 Ca 0.01 1.17 -0.29 0.00 0.00 0.00 0.00 51.96 52.86 2jah s ALA 103 Cb -0.01 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2jah s ALA 103 CO 0.01 -1.19 1.52 0.34 0.00 0.00 0.00 175.76 176.45 2jah s ASP 104 N -1.20 6.19 0.17 0.00 -1.08 -1.26 -4.89 116.67 114.59 2jah s ASP 104 Ca 0.72 0.89 0.23 0.00 -0.52 0.00 0.00 52.55 53.87 2jah s ASP 104 Cb -0.36 -2.54 0.89 0.00 -1.46 0.00 0.00 42.92 39.46 2jah s ASP 104 CO 0.41 -1.54 1.69 0.35 0.52 0.00 0.00 175.17 176.60 2jah n THR 105 N 7.16 0.73 0.22 1.71 -2.24 -1.26 -1.86 114.28 118.74 2jah n THR 105 Ca 0.18 0.10 0.06 0.00 -2.27 0.00 0.00 64.05 62.12 2jah n THR 105 Cb 0.48 -0.94 0.50 0.00 -2.10 0.00 0.00 70.33 68.26 2jah n THR 105 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2jah h THR 106 N 0.00 1.03 -0.60 4.28 1.35 -2.00 -1.74 112.91 115.23 2jah h THR 106 Ca 0.00 -0.87 0.11 0.00 -0.55 0.00 0.00 66.41 65.10 2jah h THR 106 Cb 0.43 1.49 -0.09 0.00 -1.73 0.00 0.00 68.15 68.25 2jah h THR 106 CO 0.00 0.24 0.11 0.44 -0.25 0.00 0.00 175.52 176.06 2jah h ASP 107 N 0.00 -0.03 -0.12 5.36 5.19 -1.78 -1.74 116.42 123.30 2jah h ASP 107 Ca -0.00 0.12 -0.05 0.00 -0.62 0.00 0.00 57.03 56.48 2jah h ASP 107 Cb 0.47 0.17 -0.00 0.00 0.18 0.00 0.00 39.33 40.14 2jah h ASP 107 CO 0.03 -0.01 -0.10 -0.50 -3.12 0.00 0.00 179.24 175.54 2jah h TRP 108 N 0.24 0.34 -0.61 4.55 6.55 -1.48 -3.24 115.95 122.30 2jah h TRP 108 Ca 0.32 -0.10 -0.10 0.00 0.95 0.00 0.00 58.89 59.96 2jah h TRP 108 Cb 0.48 -0.07 -0.02 0.00 -0.86 0.00 0.00 29.16 28.68 2jah h TRP 108 CO -0.26 0.68 -0.00 1.79 -1.05 0.00 0.00 178.44 179.60 2jah h THR 109 N -0.09 1.27 0.00 1.49 1.35 -1.34 -0.50 112.91 115.09 2jah h THR 109 Ca 0.02 -1.16 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 2jah h THR 109 Cb 0.61 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 2jah h THR 109 CO 0.03 0.42 0.00 0.54 -0.25 0.00 0.00 175.52 176.26 2jah n ARG 110 N -4.18 0.01 0.00 4.72 1.74 -0.66 -1.20 116.66 117.09 2jah n ARG 110 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2jah n ARG 110 Cb 0.35 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 2jah n ARG 110 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2jah n ILE 112 N 0.39 0.00 -0.22 0.55 5.41 -0.20 -1.61 119.36 123.68 2jah n ILE 112 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.72 2jah n ILE 112 Cb 0.00 0.00 0.08 0.00 -0.71 0.00 0.00 39.64 39.01 2jah n ILE 112 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2jah h ASP 113 N 0.00 0.58 0.00 4.38 5.19 -1.40 -0.17 116.42 125.01 2jah h ASP 113 Ca 0.00 0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.37 2jah h ASP 113 Cb 0.00 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.40 2jah h ASP 113 CO 0.00 0.39 -0.54 0.74 -3.12 0.00 0.00 179.24 176.71 2jah h THR 114 N 0.71 0.44 -0.14 0.35 2.02 -1.55 0.17 112.91 114.91 2jah h THR 114 Ca 0.27 -1.45 -0.15 0.00 0.77 0.00 0.00 66.41 65.85 2jah h THR 114 Cb 0.09 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2jah h THR 114 CO -0.14 0.15 -0.55 0.78 0.37 0.00 0.00 175.52 176.14 2jah h ASN 115 N -1.00 0.45 0.00 4.18 2.35 -1.78 -3.25 115.58 116.53 2jah h ASN 115 Ca -0.09 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 2jah h ASN 115 Cb 0.66 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.91 2jah h ASN 115 CO -0.05 0.91 0.00 -0.11 -1.65 0.00 0.00 177.43 176.52 2jah n LEU 116 N -3.94 0.00 -0.15 1.61 7.94 -0.88 -4.38 117.00 117.19 2jah n LEU 116 Ca -0.03 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.83 2jah n LEU 116 Cb 0.59 -0.31 0.05 0.00 0.53 0.00 0.00 43.42 44.28 2jah n LEU 116 CO 0.45 -0.45 0.99 0.25 -1.11 0.00 0.00 177.39 177.52 2jah h LEU 117 N 0.00 0.27 -0.77 -1.96 5.85 -1.11 -2.60 115.31 114.98 2jah h LEU 117 Ca 0.00 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2jah h LEU 117 Cb 0.00 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 2jah h LEU 117 CO 0.00 0.19 0.34 1.23 -0.34 0.00 0.00 178.44 179.86 2jah h GLY 118 N 0.42 1.21 -1.20 3.75 0.00 -0.71 0.34 103.07 106.88 2jah h GLY 118 Ca 0.22 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2jah h GLY 118 CO -0.19 0.60 0.00 -0.10 0.00 0.00 0.00 176.54 176.85 2jah n LEU 119 N -4.34 0.29 -0.29 3.11 0.00 -0.98 -4.58 117.00 110.20 2jah n LEU 119 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 56.01 55.93 2jah n LEU 119 Cb 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 43.42 43.47 2jah n LEU 119 CO 0.40 0.06 0.00 -1.22 0.00 0.00 0.00 177.39 176.63 2jah n TYR 121 N 0.50 -0.29 0.00 1.96 0.53 0.12 -4.64 117.16 115.33 2jah n TYR 121 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 2jah n TYR 121 Cb 0.06 -0.40 0.00 0.00 -1.03 0.00 0.00 39.34 37.97 2jah n TYR 121 CO 0.00 0.00 0.00 2.41 -1.02 0.00 0.00 176.86 178.25 2jah n THR 123 N -0.29 0.00 -0.20 -0.72 -1.04 -1.26 -1.25 114.28 109.52 2jah n THR 123 Ca 0.00 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.94 2jah n THR 123 Cb 0.00 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 2jah n THR 123 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 2jah h ARG 124 N 0.00 0.77 -0.56 -2.82 2.43 -1.96 -1.98 114.38 110.27 2jah h ARG 124 Ca 0.00 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 2jah h ARG 124 Cb 0.00 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 2jah h ARG 124 CO 0.00 0.58 0.01 0.00 -1.51 0.00 0.00 179.97 179.05 2jah h ALA 125 N 1.15 0.96 0.00 2.80 0.00 -1.58 -3.01 119.26 119.58 2jah h ALA 125 Ca 0.20 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2jah h ALA 125 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2jah h ALA 125 CO -0.03 0.63 -0.46 0.00 0.00 0.00 0.00 179.25 179.38 2jah h ALA 126 N 1.12 0.80 -0.48 0.00 0.00 -1.80 -3.39 119.26 115.52 2jah h ALA 126 Ca 0.16 -0.42 0.08 0.00 0.00 0.00 0.00 54.91 54.73 2jah h ALA 126 Cb 0.50 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 2jah h ALA 126 CO 0.02 0.58 0.09 1.25 0.00 0.00 0.00 179.25 181.19 2jah h LEU 127 N 0.00 -0.02 -0.86 0.00 5.85 -1.21 -0.87 115.31 118.21 2jah h LEU 127 Ca -0.00 0.09 0.18 0.00 0.84 0.00 0.00 57.88 58.98 2jah h LEU 127 Cb 1.18 0.12 -0.11 0.00 0.37 0.00 0.00 40.66 42.22 2jah h LEU 127 CO 0.06 0.02 0.39 -0.65 -0.34 0.00 0.00 178.44 177.93 2jah h PRO 128 N 0.22 0.48 -0.08 5.25 0.11 -1.76 -0.51 132.00 135.71 2jah h PRO 128 Ca 0.24 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 66.11 2jah h PRO 128 Cb 0.32 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2jah h PRO 128 CO -0.32 0.32 -0.79 0.45 -0.21 0.00 0.00 178.00 177.45 2jah h HIS 129 N 0.49 0.71 -0.17 0.65 3.86 -1.47 -2.92 115.15 116.30 2jah h HIS 129 Ca 0.50 -0.33 -0.14 0.00 -1.16 0.00 0.00 60.37 59.24 2jah h HIS 129 Cb 0.83 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.19 2jah h HIS 129 CO -0.12 1.12 -0.49 -0.07 0.86 0.00 0.00 177.93 179.23 2jah h LEU 130 N 0.34 0.48 -0.30 2.43 3.38 -0.90 -2.34 115.31 118.41 2jah h LEU 130 Ca -0.05 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2jah h LEU 130 Cb 1.39 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 2jah h LEU 130 CO 0.14 0.89 0.19 -0.07 0.09 0.00 0.00 178.44 179.69 2jah h LEU 131 N 0.36 0.36 -0.65 1.67 3.38 -1.07 0.14 115.31 119.50 2jah h LEU 131 Ca 0.02 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jah h LEU 131 Cb 0.98 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2jah h LEU 131 CO 0.09 0.28 0.39 -0.09 0.09 0.00 0.00 178.44 179.20 2jah h ARG 132 N 0.40 0.88 -0.00 1.13 2.43 -1.37 -3.03 114.38 114.81 2jah h ARG 132 Ca 0.11 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2jah h ARG 132 Cb -0.01 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.35 2jah h ARG 132 CO -0.02 0.63 -0.17 -1.13 -1.51 0.00 0.00 179.97 177.77 2jah n SER 133 N -4.58 0.56 -3.74 -3.80 3.41 -0.89 -4.92 113.62 99.67 2jah n SER 133 Ca 0.05 -0.54 -0.23 0.00 -0.26 0.00 0.00 58.87 57.89 2jah n SER 133 Cb 0.06 -0.03 0.03 0.00 -0.26 0.00 0.00 64.21 64.01 2jah n SER 133 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jah n LYS 134 N -0.97 -5.05 -0.17 4.33 4.76 0.27 -4.98 118.16 116.34 2jah n LYS 134 Ca 0.13 0.62 0.00 0.00 -2.87 0.00 0.00 58.31 56.18 2jah n LYS 134 Cb 0.30 -5.24 0.00 0.00 -1.84 0.00 0.00 35.03 28.26 2jah n LYS 134 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jah n GLY 135 N -1.60 -0.05 2.96 0.72 0.00 0.02 -4.72 105.19 102.52 2jah n GLY 135 Ca -0.24 -1.79 -0.22 0.00 0.00 0.00 0.00 46.02 43.77 2jah n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jah s THR 136 N 0.08 0.84 -0.21 2.61 2.01 -0.05 -1.48 115.64 119.44 2jah s THR 136 Ca 0.00 -0.31 -0.08 0.00 0.31 0.00 0.00 61.69 61.61 2jah s THR 136 Cb 0.00 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 2jah s THR 136 CO 0.00 0.29 0.09 0.54 -0.69 0.00 0.00 174.62 174.85 2jah s VAL 137 N 0.75 4.78 -0.28 3.82 0.11 0.11 -1.02 120.40 128.68 2jah s VAL 137 Ca -0.13 -0.03 -0.07 0.00 -2.93 0.00 0.00 61.98 58.82 2jah s VAL 137 Cb -0.15 -3.19 -0.00 0.00 -1.53 0.00 0.00 36.38 31.50 2jah s VAL 137 CO 0.02 0.40 0.07 -0.69 -3.33 0.00 0.00 175.10 171.57 2jah s VAL 138 N 0.87 4.05 0.00 2.04 1.01 0.19 -0.82 120.40 127.73 2jah s VAL 138 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2jah s VAL 138 Cb -0.13 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.24 2jah s VAL 138 CO 0.03 0.19 0.00 0.00 0.00 0.00 0.00 175.10 175.31 2jah n GLN 139 N 4.88 3.80 0.00 2.72 1.13 0.13 -0.26 117.38 129.79 2jah n GLN 139 Ca -0.15 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.91 2jah n GLN 139 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.84 2jah n GLN 139 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2jah n SER 141 N 0.00 0.00 -3.59 1.08 2.88 0.52 -1.05 113.62 113.46 2jah n SER 141 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 2jah n SER 141 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 2jah n SER 141 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jah s SER 142 N -4.00 -0.20 0.55 -3.46 0.15 -1.24 -4.43 113.70 101.07 2jah s SER 142 Ca 0.00 -0.06 0.36 0.00 0.70 0.00 0.00 55.95 56.95 2jah s SER 142 Cb 0.00 0.25 1.52 0.00 -1.71 0.00 0.00 66.02 66.09 2jah s SER 142 CO 0.00 -0.43 1.79 -0.29 1.20 0.00 0.00 173.24 175.51 2jah h ILE 143 N 2.00 0.38 0.00 6.45 2.10 -1.05 -0.26 117.51 127.12 2jah h ILE 143 Ca -0.18 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.76 2jah h ILE 143 Cb 1.20 0.40 0.00 0.00 -1.09 0.00 0.00 36.82 37.33 2jah h ILE 143 CO 0.26 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.33 2jah n ALA 144 N -2.71 1.61 1.24 0.18 0.00 -1.26 0.06 120.51 119.63 2jah n ALA 144 Ca 0.24 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.78 2jah n ALA 144 Cb 1.22 -1.24 0.30 0.00 0.00 0.00 0.00 19.45 19.74 2jah n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jah n GLY 145 N -0.13 0.10 0.00 0.00 0.00 -0.11 -4.10 105.19 100.96 2jah n GLY 145 Ca 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2jah n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jah n ARG 146 N 0.23 3.07 -4.29 1.61 5.12 -0.04 -4.36 116.66 118.00 2jah n ARG 146 Ca 0.15 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.86 2jah n ARG 146 Cb 0.43 -0.92 -0.16 0.00 -1.16 0.00 0.00 32.46 30.65 2jah n ARG 146 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2jah s VAL 147 N -1.85 0.69 -0.26 1.55 1.01 0.11 -5.13 120.40 116.53 2jah s VAL 147 Ca 0.00 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.62 2jah s VAL 147 Cb 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2jah s VAL 147 CO 0.00 0.25 0.24 0.20 0.00 0.00 0.00 175.10 175.79 2jah s ASN 148 N 0.70 6.15 0.31 3.32 0.01 -1.26 -4.31 114.94 119.86 2jah s ASN 148 Ca -0.11 0.15 0.10 0.00 -0.71 0.00 0.00 52.86 52.29 2jah s ASN 148 Cb -0.14 -2.15 -0.05 0.00 0.41 0.00 0.00 41.25 39.33 2jah s ASN 148 CO 0.01 -0.05 -0.06 0.68 -1.51 0.00 0.00 177.10 176.17 2jah s VAL 149 N 1.56 2.70 0.61 1.60 -7.23 -1.26 -5.13 120.40 113.24 2jah s VAL 149 Ca 0.10 -2.11 -0.20 0.00 -1.81 0.00 0.00 61.98 57.97 2jah s VAL 149 Cb -0.15 -2.65 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 2jah s VAL 149 CO 0.08 -0.29 1.31 0.54 -0.31 0.00 0.00 175.10 176.44 2jah n ARG 150 N -0.83 1.35 -1.62 4.82 1.74 -1.26 -3.45 116.66 117.41 2jah n ARG 150 Ca -0.05 0.51 -0.11 0.00 -0.77 0.00 0.00 57.85 57.43 2jah n ARG 150 Cb 0.61 -2.54 -0.04 0.00 -1.02 0.00 0.00 32.46 29.47 2jah n ARG 150 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2jah n ASN 151 N -1.51 -4.17 -1.00 0.55 3.02 -1.26 -4.86 115.26 106.03 2jah n ASN 151 Ca 0.14 0.19 0.03 0.00 -0.03 0.00 0.00 54.58 54.91 2jah n ASN 151 Cb 0.47 -2.91 0.03 0.00 -0.61 0.00 0.00 39.78 36.76 2jah n ASN 151 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jah n ALA 152 N 0.32 2.31 0.00 5.41 0.00 -1.22 -1.08 120.51 126.26 2jah n ALA 152 Ca -0.12 -1.93 -0.10 0.00 0.00 0.00 0.00 53.44 51.30 2jah n ALA 152 Cb 0.45 -0.61 -0.04 0.00 0.00 0.00 0.00 19.45 19.25 2jah n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jah h ALA 153 N 0.58 -0.01 0.07 0.00 0.00 -1.81 0.84 119.26 118.93 2jah h ALA 153 Ca -0.12 0.05 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 2jah h ALA 153 Cb 1.61 0.20 0.01 0.00 0.00 0.00 0.00 17.79 19.61 2jah h ALA 153 CO 0.05 -0.55 -1.11 0.28 0.00 0.00 0.00 179.25 177.92 2jah h VAL 154 N -0.11 1.42 -0.17 0.00 2.07 -1.92 -1.07 116.25 116.47 2jah h VAL 154 Ca 0.07 -2.69 0.03 0.00 0.82 0.00 0.00 66.70 64.94 2jah h VAL 154 Cb 0.22 2.67 -0.03 0.00 -1.52 0.00 0.00 31.29 32.63 2jah h VAL 154 CO -0.18 0.80 -0.04 0.22 0.02 0.00 0.00 177.57 178.39 2jah h TYR 155 N 0.17 -0.08 -0.83 1.57 3.20 -1.80 -1.53 116.97 117.67 2jah h TYR 155 Ca -0.12 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.78 2jah h TYR 155 Cb 1.78 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 40.07 2jah h TYR 155 CO 0.07 -0.07 0.55 1.96 -1.64 0.00 0.00 178.16 179.03 2jah h GLN 156 N 0.01 1.08 -0.49 1.82 4.20 -0.76 -1.90 115.11 119.06 2jah h GLN 156 Ca 0.08 -0.06 0.08 0.00 0.06 0.00 0.00 58.65 58.81 2jah h GLN 156 Cb 0.12 -0.24 -0.07 0.00 0.30 0.00 0.00 27.48 27.59 2jah h GLN 156 CO -0.17 0.71 0.11 0.00 -0.67 0.00 0.00 178.83 178.81 2jah h ALA 157 N 1.31 0.56 -0.82 3.87 0.00 -0.87 0.64 119.26 123.95 2jah h ALA 157 Ca 0.31 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 2jah h ALA 157 Cb -0.11 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2jah h ALA 157 CO -0.07 -0.30 0.42 1.79 0.00 0.00 0.00 179.25 181.09 2jah h THR 158 N 0.25 1.25 0.23 0.00 1.35 -0.72 -0.72 112.91 114.56 2jah h THR 158 Ca 0.25 -0.66 -0.31 0.00 -0.55 0.00 0.00 66.41 65.13 2jah h THR 158 Cb 0.32 0.19 0.04 0.00 -1.73 0.00 0.00 68.15 66.97 2jah h THR 158 CO -0.31 0.29 -1.38 0.11 -0.25 0.00 0.00 175.52 173.98 2jah h LYS 159 N 1.15 0.50 -0.97 4.72 1.79 -0.89 0.01 116.57 122.87 2jah h LYS 159 Ca 0.28 -0.85 0.09 0.00 -2.18 0.00 0.00 60.65 57.99 2jah h LYS 159 Cb 0.08 0.32 -0.07 0.00 -1.58 0.00 0.00 32.23 30.97 2jah h LYS 159 CO -0.04 1.41 0.61 0.74 -1.08 0.00 0.00 179.45 181.09 2jah h PHE 160 N 0.05 1.13 -0.14 -1.35 -1.00 -0.93 -1.79 116.94 112.90 2jah h PHE 160 Ca -0.24 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.58 2jah h PHE 160 Cb 2.08 -0.36 -0.01 0.00 3.61 0.00 0.00 35.95 41.26 2jah h PHE 160 CO 0.14 0.52 0.07 0.78 -1.61 0.00 0.00 178.31 178.21 2jah h GLY 161 N 1.05 0.18 0.09 -1.45 0.00 -0.91 -1.57 103.07 100.46 2jah h GLY 161 Ca 0.45 -0.05 0.12 0.00 0.00 0.00 0.00 47.33 47.85 2jah h GLY 161 CO -0.22 0.04 0.09 -2.08 0.00 0.00 0.00 176.54 174.38 2jah h VAL 162 N 0.15 0.58 -0.24 4.60 2.07 -0.78 0.11 116.25 122.74 2jah h VAL 162 Ca 0.06 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2jah h VAL 162 Cb 0.02 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2jah h VAL 162 CO -0.04 0.04 0.12 0.78 0.02 0.00 0.00 177.57 178.48 2jah h ASN 163 N 0.21 0.31 0.17 0.57 4.21 -0.96 0.65 115.58 120.76 2jah h ASN 163 Ca 0.32 -0.12 -0.01 0.00 1.21 0.00 0.00 56.30 57.71 2jah h ASN 163 Cb 0.51 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.63 2jah h ASN 163 CO -0.45 0.34 -0.08 0.00 -1.29 0.00 0.00 177.43 175.95 2jah h ALA 164 N 0.98 -0.23 -0.75 -0.83 0.00 -1.01 0.39 119.26 117.80 2jah h ALA 164 Ca 0.08 -0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.09 2jah h ALA 164 Cb 0.11 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 17.88 2jah h ALA 164 CO -0.01 -0.61 0.22 0.35 0.00 0.00 0.00 179.25 179.20 2jah h PHE 165 N -0.27 0.35 0.04 0.00 3.57 -0.86 -1.22 116.94 118.55 2jah h PHE 165 Ca -0.02 0.04 -0.25 0.00 3.53 0.00 0.00 57.97 61.27 2jah h PHE 165 Cb 0.21 -0.04 0.01 0.00 2.79 0.00 0.00 35.95 38.92 2jah h PHE 165 CO -0.06 -0.05 -1.04 0.77 -2.23 0.00 0.00 178.31 175.70 2jah h SER 166 N 0.31 0.56 -0.64 0.41 0.02 -0.53 0.18 113.55 113.87 2jah h SER 166 Ca 0.43 -0.49 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2jah h SER 166 Cb 0.72 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 2jah h SER 166 CO -0.49 1.31 0.27 -0.08 -1.14 0.00 0.00 176.83 176.70 2jah h GLU 167 N 0.21 0.95 -0.33 3.45 4.57 -0.67 -0.26 114.58 122.50 2jah h GLU 167 Ca -0.11 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 57.87 2jah h GLU 167 Cb 1.70 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 30.12 2jah h GLU 167 CO 0.18 0.79 0.04 1.15 -1.18 0.00 0.00 179.01 179.99 2jah h THR 168 N 0.89 1.24 -0.61 0.32 2.02 -1.07 -1.95 112.91 113.74 2jah h THR 168 Ca 0.22 -0.85 0.10 0.00 0.77 0.00 0.00 66.41 66.64 2jah h THR 168 Cb 0.18 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.68 2jah h THR 168 CO -0.02 0.28 0.23 0.25 0.37 0.00 0.00 175.52 176.63 2jah h LEU 169 N 0.37 0.22 -0.19 2.58 5.85 -0.50 -1.49 115.31 122.15 2jah h LEU 169 Ca 0.10 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2jah h LEU 169 Cb 0.37 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 2jah h LEU 169 CO 0.01 0.13 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.07 2jah h ARG 170 N 0.41 -0.05 -0.97 1.25 2.43 -0.65 -0.92 114.38 115.87 2jah h ARG 170 Ca 0.31 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.62 2jah h ARG 170 Cb 0.39 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.87 2jah h ARG 170 CO -0.31 -0.03 0.61 1.96 -1.51 0.00 0.00 179.97 180.69 2jah h GLN 171 N -0.05 0.85 -0.00 0.20 4.20 -0.71 0.62 115.11 120.21 2jah h GLN 171 Ca 0.10 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 2jah h GLN 171 Cb 0.20 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 2jah h GLN 171 CO -0.23 0.56 -0.77 0.93 -0.67 0.00 0.00 178.83 178.65 2jah h GLU 172 N 0.88 0.04 0.00 1.46 5.08 -0.25 -3.39 114.58 118.39 2jah h GLU 172 Ca 0.49 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 2jah h GLU 172 Cb 0.61 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2jah h GLU 172 CO -0.26 0.79 0.00 1.33 -1.00 0.00 0.00 179.01 179.87 2jah n VAL 173 N -3.65 0.00 -0.35 3.13 0.24 -0.46 -4.77 118.33 112.47 2jah n VAL 173 Ca -0.01 -0.42 -0.02 0.00 -2.04 0.00 0.00 64.34 61.84 2jah n VAL 173 Cb 0.74 1.02 0.12 0.00 -1.47 0.00 0.00 33.84 34.25 2jah n VAL 173 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jah h THR 174 N 0.02 1.25 0.00 3.34 1.03 -0.98 -2.26 112.91 115.31 2jah h THR 174 Ca 0.00 -0.52 -0.02 0.00 -0.01 0.00 0.00 66.41 65.85 2jah h THR 174 Cb 0.01 -0.10 -0.00 0.00 -1.07 0.00 0.00 68.15 66.99 2jah h THR 174 CO 0.00 0.26 -0.11 -0.33 -0.01 0.00 0.00 175.52 175.33 2jah h GLU 175 N 1.30 0.00 -0.46 0.00 5.08 -1.85 -0.43 114.58 118.21 2jah h GLU 175 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2jah h GLU 175 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2jah h GLU 175 CO -0.07 0.11 0.00 0.54 -1.00 0.00 0.00 179.01 178.59 2jah n ARG 176 N -3.44 2.10 -0.58 2.33 1.74 -0.87 -4.93 116.66 113.01 2jah n ARG 176 Ca -0.01 -1.53 0.00 0.00 -0.77 0.00 0.00 57.85 55.54 2jah n ARG 176 Cb 0.28 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 2jah n ARG 176 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jah n GLY 177 N 1.08 0.70 3.55 -0.13 0.00 -0.17 -4.79 105.19 105.42 2jah n GLY 177 Ca 0.14 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2jah n GLY 177 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jah s VAL 178 N -2.00 5.03 0.03 1.61 1.01 -1.12 -3.86 120.40 121.10 2jah s VAL 178 Ca 0.00 0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.01 2jah s VAL 178 Cb 0.00 -3.97 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 2jah s VAL 178 CO 0.00 -0.24 0.67 -0.13 0.00 0.00 0.00 175.10 175.40 2jah s ARG 179 N 2.36 4.39 -0.25 2.72 0.52 -0.55 -3.82 118.95 124.33 2jah s ARG 179 Ca 0.18 0.89 -0.03 0.00 -0.52 0.00 0.00 55.73 56.25 2jah s ARG 179 Cb -0.16 -3.34 0.02 0.00 0.52 0.00 0.00 34.95 31.99 2jah s ARG 179 CO 0.13 0.36 -0.04 0.08 0.02 0.00 0.00 175.30 175.86 2jah s VAL 180 N -0.25 3.07 -0.12 3.52 1.01 -1.26 -0.72 120.40 125.66 2jah s VAL 180 Ca 0.34 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2jah s VAL 180 Cb -0.19 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 2jah s VAL 180 CO 0.20 0.22 -0.19 -0.69 0.00 0.00 0.00 175.10 174.64 2jah s VAL 181 N 1.37 2.48 -0.17 2.92 1.01 -0.00 -4.25 120.40 123.76 2jah s VAL 181 Ca 0.01 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.14 2jah s VAL 181 Cb -0.16 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.23 2jah s VAL 181 CO -0.04 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.74 2jah s VAL 182 N 0.41 2.33 -0.14 2.92 1.01 0.53 0.22 120.40 127.67 2jah s VAL 182 Ca -0.14 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 2jah s VAL 182 Cb -0.17 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2jah s VAL 182 CO 0.06 0.52 0.03 -0.63 0.00 0.00 0.00 175.10 175.09 2jah s ILE 183 N 1.12 4.54 -0.57 2.22 -1.09 -0.21 -1.72 121.20 125.48 2jah s ILE 183 Ca 0.00 -0.14 0.04 0.00 -2.23 0.00 0.00 60.65 58.33 2jah s ILE 183 Cb -0.14 -2.99 0.16 0.00 -1.58 0.00 0.00 42.46 37.91 2jah s ILE 183 CO -0.07 0.52 0.39 -1.61 -1.23 0.00 0.00 174.94 172.95 2jah s GLU 184 N -0.12 1.84 0.39 2.79 2.02 0.80 -0.35 118.70 126.07 2jah s GLU 184 Ca 0.06 -2.75 -0.24 0.00 0.02 0.00 0.00 54.97 52.06 2jah s GLU 184 Cb -0.12 -2.74 -0.09 0.00 0.10 0.00 0.00 34.13 31.28 2jah s GLU 184 CO 0.02 -1.27 1.02 -2.14 0.02 0.00 0.00 175.26 172.90 2jah s PRO 185 N -0.68 4.24 0.00 0.39 0.02 -1.26 -1.55 135.00 136.16 2jah s PRO 185 Ca 0.25 1.42 0.00 0.00 0.02 0.00 0.00 61.00 62.69 2jah s PRO 185 Cb -0.08 -2.53 0.00 0.00 0.02 0.00 0.00 34.50 31.92 2jah s PRO 185 CO -0.13 -0.06 0.00 0.41 -0.33 0.00 0.00 177.00 176.89 2jah n GLY 186 N 0.23 0.17 3.65 0.52 0.00 0.90 -0.65 105.19 110.01 2jah n GLY 186 Ca 0.05 -1.81 -0.55 0.00 0.00 0.00 0.00 46.02 43.71 2jah n GLY 186 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jah n THR 187 N -0.58 0.33 -4.80 2.61 -1.04 -1.26 -4.87 114.28 104.67 2jah n THR 187 Ca 0.00 -0.10 -0.25 0.00 -2.04 0.00 0.00 64.05 61.66 2jah n THR 187 Cb 0.00 -1.39 -0.16 0.00 -1.82 0.00 0.00 70.33 66.96 2jah n THR 187 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2jah s THR 188 N 4.36 1.35 -0.98 12.58 2.01 -1.26 -0.99 115.64 132.71 2jah s THR 188 Ca 1.00 -0.70 -0.24 0.00 0.31 0.00 0.00 61.69 62.07 2jah s THR 188 Cb -0.98 -1.15 0.02 0.00 0.01 0.00 0.00 72.50 70.40 2jah s THR 188 CO 0.61 0.39 1.61 -0.62 -0.69 0.00 0.00 174.62 175.91 2jah s ASP 189 N -0.13 6.06 0.01 3.53 -1.08 0.17 -4.89 116.67 120.34 2jah s ASP 189 Ca 0.01 -1.18 0.00 0.00 -0.52 0.00 0.00 52.55 50.85 2jah s ASP 189 Cb -0.09 -2.57 -0.00 0.00 -1.46 0.00 0.00 42.92 38.80 2jah s ASP 189 CO 0.01 -1.91 0.01 0.35 0.52 0.00 0.00 175.17 174.14 2jah n THR 190 N 7.20 0.00 1.34 1.71 -2.24 -1.26 -4.53 114.28 116.51 2jah n THR 190 Ca 0.35 -0.08 0.14 0.00 -2.27 0.00 0.00 64.05 62.19 2jah n THR 190 Cb 0.50 0.03 0.63 0.00 -2.10 0.00 0.00 70.33 69.39 2jah n THR 190 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jah n GLU 191 N -0.03 0.49 -0.11 -0.78 1.02 -1.26 -4.41 120.64 115.56 2jah n GLU 191 Ca 0.00 -0.12 -0.06 0.00 -0.02 0.00 0.00 57.16 56.96 2jah n GLU 191 Cb 0.02 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 29.95 2jah n GLU 191 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2jah h LEU 192 N 0.30 -0.59 -1.75 -4.62 5.85 -1.96 -2.12 115.31 110.42 2jah h LEU 192 Ca 0.00 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 2jah h LEU 192 Cb 0.36 0.33 -0.00 0.00 0.37 0.00 0.00 40.66 41.72 2jah h LEU 192 CO 0.00 -0.21 -0.06 0.08 -0.34 0.00 0.00 178.44 177.91 2jah h ARG 193 N -0.10 0.00 0.00 1.25 0.11 -1.95 -2.69 114.38 111.00 2jah h ARG 193 Ca 0.19 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.27 2jah h ARG 193 Cb 0.39 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.47 2jah h ARG 193 CO -0.45 0.06 -0.01 0.78 0.10 0.00 0.00 179.97 180.46 2jah h GLY 194 N 1.48 0.00 0.80 0.08 0.00 -1.69 -3.03 103.07 100.72 2jah h GLY 194 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jah h GLY 194 CO 0.01 0.00 -0.28 1.42 0.00 0.00 0.00 176.54 177.68 2jah n HIS 195 N -3.49 0.00 -1.68 5.60 8.25 -1.02 -4.91 115.22 117.97 2jah n HIS 195 Ca -0.03 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 56.97 2jah n HIS 195 Cb 0.09 -0.21 -0.04 0.00 1.12 0.00 0.00 29.99 30.94 2jah n HIS 195 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2jah n ILE 196 N -1.08 0.38 0.02 1.59 5.41 -1.15 -4.90 119.36 119.64 2jah n ILE 196 Ca 0.10 -0.07 -0.02 0.00 1.00 0.00 0.00 62.75 63.76 2jah n ILE 196 Cb 0.33 -1.88 -0.09 0.00 -0.71 0.00 0.00 39.64 37.28 2jah n ILE 196 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2jah n THR 197 N 4.59 1.28 -2.69 1.39 -2.24 -1.26 -4.71 114.28 110.63 2jah n THR 197 Ca 0.20 -0.71 -0.42 0.00 -2.27 0.00 0.00 64.05 60.84 2jah n THR 197 Cb 0.32 -0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 67.71 2jah n THR 197 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2jah s HIS 198 N -2.86 2.58 0.16 4.78 5.65 -1.26 -4.92 115.29 119.42 2jah s HIS 198 Ca -0.03 0.00 -0.16 0.00 0.25 0.00 0.00 55.06 55.12 2jah s HIS 198 Cb 0.09 -4.39 0.03 0.00 -1.18 0.00 0.00 32.58 27.13 2jah s HIS 198 CO 0.81 -1.67 1.80 1.15 -0.65 0.00 0.00 174.74 176.18 2jah h THR 199 N 6.05 1.05 -0.60 0.89 2.02 -1.92 -0.14 112.91 120.27 2jah h THR 199 Ca -0.27 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 66.75 2jah h THR 199 Cb 1.06 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 2jah h THR 199 CO 1.19 0.09 0.40 0.00 0.37 0.00 0.00 175.52 177.56 2jah h ALA 200 N 1.17 0.76 -0.53 6.16 0.00 -1.98 -1.58 119.26 123.26 2jah h ALA 200 Ca 0.16 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2jah h ALA 200 Cb -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2jah h ALA 200 CO -0.07 0.19 -0.11 1.15 0.00 0.00 0.00 179.25 180.41 2jah h THR 201 N 0.81 1.27 -0.49 0.00 2.02 -1.81 -3.06 112.91 111.66 2jah h THR 201 Ca 0.22 -1.27 0.06 0.00 0.77 0.00 0.00 66.41 66.20 2jah h THR 201 Cb -0.09 0.99 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 2jah h THR 201 CO -0.05 0.45 0.18 0.50 0.37 0.00 0.00 175.52 176.97 2jah h LYS 202 N 0.89 0.36 -0.89 6.66 3.64 -0.63 0.48 116.57 127.07 2jah h LYS 202 Ca 0.14 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2jah h LYS 202 Cb 0.68 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2jah h LYS 202 CO 0.05 0.24 0.00 0.39 -2.27 0.00 0.00 179.45 177.86 2jah n GLU 203 N -4.99 0.20 0.00 1.90 1.02 -0.63 -1.57 120.64 116.56 2jah n GLU 203 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2jah n GLU 203 Cb 0.18 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 2jah n GLU 203 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2jah n TYR 205 N 0.62 0.00 0.18 -0.32 9.36 0.16 -1.82 117.16 125.34 2jah n TYR 205 Ca 0.00 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.25 2jah n TYR 205 Cb 0.07 0.00 0.35 0.00 -0.63 0.00 0.00 39.34 39.13 2jah n TYR 205 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2jah h GLU 206 N 0.00 0.00 -0.17 2.98 5.08 -1.53 -2.22 114.58 118.73 2jah h GLU 206 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 2jah h GLU 206 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jah h GLU 206 CO 0.00 0.40 -0.33 0.37 -1.00 0.00 0.00 179.01 178.45 2jah h GLN 207 N 0.00 0.52 -0.90 2.33 5.75 -1.62 -2.91 115.11 118.29 2jah h GLN 207 Ca -0.00 -0.33 0.18 0.00 -0.15 0.00 0.00 58.65 58.34 2jah h GLN 207 Cb 0.73 0.04 -0.11 0.00 1.07 0.00 0.00 27.48 29.21 2jah h GLN 207 CO 0.05 0.94 0.46 -0.09 -2.65 0.00 0.00 178.83 177.54 2jah h ARG 208 N 0.16 0.56 -0.44 1.69 2.43 -1.69 -2.14 114.38 114.96 2jah h ARG 208 Ca 0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2jah h ARG 208 Cb 0.92 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2jah h ARG 208 CO 0.07 0.37 0.00 0.44 -1.51 0.00 0.00 179.97 179.34 2jah n ILE 209 N -4.91 0.58 0.26 1.20 -5.35 -0.88 -4.52 119.36 105.73 2jah n ILE 209 Ca 0.20 -0.79 0.13 0.00 -0.27 0.00 0.00 62.75 62.02 2jah n ILE 209 Cb 0.54 0.92 0.66 0.00 -1.74 0.00 0.00 39.64 40.02 2jah n ILE 209 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2jah h SER 210 N 4.40 0.00 0.15 7.28 4.64 -1.17 -3.26 113.55 125.60 2jah h SER 210 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2jah h SER 210 Cb 0.98 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.07 2jah h SER 210 CO 0.00 0.14 -1.88 0.00 -0.87 0.00 0.00 176.83 174.22 2jah n GLN 211 N -3.48 0.65 -2.76 4.77 1.13 -1.26 -5.00 117.38 111.43 2jah n GLN 211 Ca -0.01 -0.13 -0.31 0.00 -1.94 0.00 0.00 57.00 54.61 2jah n GLN 211 Cb 0.30 -1.57 -0.04 0.00 0.11 0.00 0.00 30.24 29.04 2jah n GLN 211 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 2jah s ILE 212 N -3.41 4.68 -0.33 5.09 -4.36 -1.23 -5.01 121.20 116.63 2jah s ILE 212 Ca -0.07 0.87 -0.29 0.00 -0.26 0.00 0.00 60.65 60.90 2jah s ILE 212 Cb 0.13 -3.71 -0.00 0.00 1.25 0.00 0.00 42.46 40.13 2jah s ILE 212 CO 0.89 -0.52 1.43 -0.13 0.24 0.00 0.00 174.94 176.85 2jah s ARG 213 N -3.78 3.73 0.61 0.37 0.52 -1.26 -5.01 118.95 114.13 2jah s ARG 213 Ca 0.54 1.22 -0.14 0.00 -0.52 0.00 0.00 55.73 56.84 2jah s ARG 213 Cb -0.10 -3.98 -0.03 0.00 0.52 0.00 0.00 34.95 31.35 2jah s ARG 213 CO 0.29 -1.37 1.04 0.15 0.02 0.00 0.00 175.30 175.43 2jah s LYS 214 N 4.65 3.38 0.65 3.54 1.02 -1.26 -4.69 119.74 127.03 2jah s LYS 214 Ca 0.62 1.00 -0.17 0.00 0.02 0.00 0.00 55.97 57.44 2jah s LYS 214 Cb -0.17 -2.05 -0.01 0.00 -0.52 0.00 0.00 37.83 35.08 2jah s LYS 214 CO 0.28 -0.75 1.24 -0.51 -0.92 0.00 0.00 175.35 174.70 2jah s LEU 215 N -4.85 3.53 0.09 3.17 1.43 -0.16 -4.82 118.68 117.07 2jah s LEU 215 Ca 0.59 2.47 0.03 0.00 -1.03 0.00 0.00 54.13 56.19 2jah s LEU 215 Cb -0.13 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.44 2jah s LEU 215 CO 0.44 -1.93 0.08 -1.10 0.23 0.00 0.00 176.35 174.07 2jah s GLN 216 N -3.51 2.88 0.42 1.70 -1.52 -1.26 -0.66 119.66 117.72 2jah s GLN 216 Ca 0.78 -0.70 0.16 0.00 -1.95 0.00 0.00 55.36 53.65 2jah s GLN 216 Cb -0.33 -2.72 1.04 0.00 -0.22 0.00 0.00 33.01 30.78 2jah s GLN 216 CO 0.39 0.56 1.91 0.00 -0.25 0.00 0.00 175.29 177.90 2jah h ALA 217 N 3.23 2.11 -0.33 6.09 0.00 -1.90 -0.36 119.26 128.10 2jah h ALA 217 Ca -0.47 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 2jah h ALA 217 Cb 1.17 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2jah h ALA 217 CO 0.66 -0.33 -0.07 1.96 0.00 0.00 0.00 179.25 181.47 2jah h GLN 218 N 0.43 0.54 -0.61 0.00 7.50 -1.93 -1.25 115.11 119.80 2jah h GLN 218 Ca 0.39 -0.14 -0.02 0.00 0.50 0.00 0.00 58.65 59.37 2jah h GLN 218 Cb 0.89 -0.07 -0.03 0.00 0.05 0.00 0.00 27.48 28.33 2jah h GLN 218 CO -0.13 0.62 0.28 -0.44 -1.50 0.00 0.00 178.83 177.66 2jah h ASP 219 N 0.51 0.80 -0.28 1.46 3.32 -1.46 -1.64 116.42 119.13 2jah h ASP 219 Ca 0.10 -0.14 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 2jah h ASP 219 Cb 0.44 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 2jah h ASP 219 CO 0.02 0.72 -0.33 0.40 -1.72 0.00 0.00 179.24 178.33 2jah h ILE 220 N 0.83 1.30 -0.96 0.35 1.08 -1.32 -2.47 117.51 116.32 2jah h ILE 220 Ca 0.21 -1.51 0.13 0.00 -0.39 0.00 0.00 64.86 63.29 2jah h ILE 220 Cb 0.14 1.62 -0.08 0.00 -3.07 0.00 0.00 36.82 35.43 2jah h ILE 220 CO -0.02 0.48 0.61 0.00 -0.69 0.00 0.00 178.15 178.53 2jah h ALA 221 N 0.69 1.63 -0.56 1.87 0.00 -1.15 -1.48 119.26 120.25 2jah h ALA 221 Ca 0.04 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2jah h ALA 221 Cb 0.91 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2jah h ALA 221 CO 0.08 0.13 0.09 1.49 0.00 0.00 0.00 179.25 181.04 2jah h GLU 222 N 0.89 0.90 -0.38 0.00 4.57 -1.00 0.79 114.58 120.36 2jah h GLU 222 Ca 0.48 -0.22 0.01 0.00 -1.18 0.00 0.00 59.36 58.45 2jah h GLU 222 Cb 0.56 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2jah h GLU 222 CO -0.24 0.84 0.23 0.00 -1.18 0.00 0.00 179.01 178.66 2jah h ALA 223 N 1.24 0.48 -0.14 2.92 0.00 -0.85 0.63 119.26 123.53 2jah h ALA 223 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2jah h ALA 223 Cb 0.38 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2jah h ALA 223 CO 0.01 -0.11 0.08 0.28 0.00 0.00 0.00 179.25 179.52 2jah h VAL 224 N 0.47 1.07 -0.43 0.00 2.07 -0.95 -1.53 116.25 116.94 2jah h VAL 224 Ca 0.15 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.56 2jah h VAL 224 Cb -0.01 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 30.64 2jah h VAL 224 CO -0.06 0.06 0.11 -0.09 0.02 0.00 0.00 177.57 177.61 2jah h ARG 225 N 0.15 0.24 -0.18 1.57 2.43 -0.53 -0.59 114.38 117.48 2jah h ARG 225 Ca 0.05 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2jah h ARG 225 Cb 0.03 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 2jah h ARG 225 CO -0.01 0.16 0.01 -0.92 -1.51 0.00 0.00 179.97 177.70 2jah h TYR 226 N 0.25 0.02 -0.56 2.20 3.20 -0.67 -2.02 116.97 119.39 2jah h TYR 226 Ca 0.21 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.07 2jah h TYR 226 Cb 0.24 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 2jah h TYR 226 CO -0.19 -0.01 0.27 0.00 -1.64 0.00 0.00 178.16 176.59 2jah h ALA 227 N 1.15 0.72 0.00 1.82 0.00 -0.66 -2.88 119.26 119.41 2jah h ALA 227 Ca 0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2jah h ALA 227 Cb 0.09 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2jah h ALA 227 CO -0.13 0.28 -0.29 -0.39 0.00 0.00 0.00 179.25 178.72 2jah h VAL 228 N 0.75 0.20 -0.01 0.00 -1.51 -1.03 -3.15 116.25 111.49 2jah h VAL 228 Ca 0.19 -1.29 0.00 0.00 -1.23 0.00 0.00 66.70 64.37 2jah h VAL 228 Cb 0.12 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 2jah h VAL 228 CO -0.02 0.11 -0.18 0.35 -1.23 0.00 0.00 177.57 176.60 2jah n THR 229 N -3.06 0.00 -1.82 7.19 -2.24 -0.77 -4.91 114.28 108.68 2jah n THR 229 Ca 0.03 -0.22 -0.36 0.00 -2.27 0.00 0.00 64.05 61.23 2jah n THR 229 Cb 0.59 0.64 0.05 0.00 -2.10 0.00 0.00 70.33 69.51 2jah n THR 229 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jah s ALA 230 N -2.30 2.41 0.70 6.98 0.00 -1.09 -4.95 121.76 123.51 2jah s ALA 230 Ca 0.28 1.00 -0.16 0.00 0.00 0.00 0.00 51.96 53.08 2jah s ALA 230 Cb 0.20 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.87 2jah s ALA 230 CO 0.45 -1.41 1.24 -1.25 0.00 0.00 0.00 175.76 174.78 2jah s PRO 231 N -3.51 2.30 0.46 0.00 0.04 -1.26 -4.88 135.00 128.15 2jah s PRO 231 Ca 0.77 1.88 0.15 0.00 0.04 0.00 0.00 61.00 63.83 2jah s PRO 231 Cb -0.31 -1.84 1.10 0.00 0.04 0.00 0.00 34.50 33.50 2jah s PRO 231 CO 0.37 -1.74 2.04 1.25 0.04 0.00 0.00 177.00 178.96 2jah h HIS 232 N 0.04 0.29 0.00 0.56 2.76 -1.95 -0.40 115.15 116.44 2jah h HIS 232 Ca -0.49 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.69 2jah h HIS 232 Cb 1.31 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 30.18 2jah h HIS 232 CO 0.45 0.15 0.00 -2.39 -1.30 0.00 0.00 177.93 174.84 2jah n HIS 233 N -4.47 0.00 -4.45 5.26 1.44 -1.26 -4.62 115.22 107.12 2jah n HIS 233 Ca 0.06 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.43 2jah n HIS 233 Cb 0.28 -0.47 -0.13 0.00 0.12 0.00 0.00 29.99 29.79 2jah n HIS 233 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2jah s ALA 234 N -2.95 2.80 -0.31 1.59 0.00 -0.16 -5.08 121.76 117.65 2jah s ALA 234 Ca 0.06 -0.93 -0.04 0.00 0.00 0.00 0.00 51.96 51.05 2jah s ALA 234 Cb 0.07 -1.44 0.04 0.00 0.00 0.00 0.00 23.12 21.79 2jah s ALA 234 CO 0.20 0.08 0.04 0.99 0.00 0.00 0.00 175.76 177.07 2jah s THR 235 N 0.61 3.36 -1.06 0.00 2.01 -1.26 -4.72 115.64 114.58 2jah s THR 235 Ca -0.05 -1.17 -0.22 0.00 0.31 0.00 0.00 61.69 60.56 2jah s THR 235 Cb -0.15 -2.87 0.06 0.00 0.01 0.00 0.00 72.50 69.55 2jah s THR 235 CO 0.03 -0.07 1.46 -0.69 -0.69 0.00 0.00 174.62 174.66 2jah s VAL 236 N 1.34 4.05 0.26 3.82 1.01 -1.26 -4.82 120.40 124.80 2jah s VAL 236 Ca -0.02 -1.05 0.08 0.00 0.00 0.00 0.00 61.98 60.98 2jah s VAL 236 Cb -0.19 -5.05 -0.02 0.00 0.00 0.00 0.00 36.38 31.12 2jah s VAL 236 CO 0.00 -1.91 1.61 -0.74 0.00 0.00 0.00 175.10 174.06 2jah h HIS 237 N 9.32 0.16 -3.28 5.22 2.76 -1.91 -3.37 115.15 124.05 2jah h HIS 237 Ca 0.24 -0.06 -0.21 0.00 -2.20 0.00 0.00 60.37 58.13 2jah h HIS 237 Cb 0.99 -0.03 -0.29 0.00 1.55 0.00 0.00 27.41 29.63 2jah h HIS 237 CO 1.29 0.68 -0.56 -1.21 -1.30 0.00 0.00 177.93 176.83 2jah s GLU 238 N -3.75 0.15 -0.14 5.26 2.02 -1.25 -0.35 118.70 120.63 2jah s GLU 238 Ca -0.03 0.32 -0.01 0.00 0.02 0.00 0.00 54.97 55.27 2jah s GLU 238 Cb 0.12 -0.05 0.04 0.00 0.10 0.00 0.00 34.13 34.34 2jah s GLU 238 CO 0.78 -0.10 -0.05 0.42 0.02 0.00 0.00 175.26 176.33 2jah s ILE 239 N 0.68 1.00 -0.33 -1.63 1.01 -0.70 -4.97 121.20 116.26 2jah s ILE 239 Ca -0.05 -0.46 -0.06 0.00 0.00 0.00 0.00 60.65 60.08 2jah s ILE 239 Cb -0.07 -1.14 0.04 0.00 0.01 0.00 0.00 42.46 41.30 2jah s ILE 239 CO -0.03 0.19 0.09 0.12 0.00 0.00 0.00 174.94 175.31 2jah s PHE 240 N 1.69 3.25 -0.17 3.97 5.36 -1.26 -0.14 117.98 130.69 2jah s PHE 240 Ca 0.02 -1.48 0.01 0.00 -0.96 0.00 0.00 56.93 54.52 2jah s PHE 240 Cb -0.14 -2.25 0.02 0.00 -0.34 0.00 0.00 43.02 40.31 2jah s PHE 240 CO -0.08 -0.74 -0.19 -1.50 -1.46 0.00 0.00 175.22 171.26 2jah s ILE 241 N 1.38 1.94 0.16 3.12 2.07 -0.60 -5.00 121.20 124.27 2jah s ILE 241 Ca -0.02 -0.86 0.10 0.00 -1.41 0.00 0.00 60.65 58.46 2jah s ILE 241 Cb -0.19 -1.76 -0.04 0.00 0.13 0.00 0.00 42.46 40.59 2jah s ILE 241 CO 0.02 0.52 -0.20 -0.13 -1.91 0.00 0.00 174.94 173.24 2jah s ARG 242 N 1.32 1.66 0.17 3.50 0.52 -1.26 -0.07 118.95 124.79 2jah s ARG 242 Ca 0.05 -1.37 -0.31 0.00 -0.52 0.00 0.00 55.73 53.58 2jah s ARG 242 Cb -0.13 -1.97 -0.10 0.00 0.52 0.00 0.00 34.95 33.27 2jah s ARG 242 CO -0.12 0.43 1.51 -2.14 0.02 0.00 0.00 175.30 175.00 2jah s PRO 243 N -2.47 4.25 0.43 3.54 0.02 -1.26 -4.90 135.00 134.60 2jah s PRO 243 Ca 0.20 2.29 0.11 0.00 0.02 0.00 0.00 61.00 63.61 2jah s PRO 243 Cb -0.09 -3.17 0.96 0.00 0.02 0.00 0.00 34.50 32.23 2jah s PRO 243 CO 0.10 -0.54 2.03 1.15 -0.33 0.00 0.00 177.00 179.41 2jah h THR 244 N 3.99 1.00 0.00 0.99 2.02 -1.99 -2.47 112.91 116.45 2jah h THR 244 Ca -0.43 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.59 2jah h THR 244 Cb 1.21 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 2jah h THR 244 CO 0.88 0.08 0.00 0.47 0.37 0.00 0.00 175.52 177.32 2jah n ASP 245 N -4.48 0.00 -4.24 4.18 8.00 -1.26 -4.76 116.55 113.99 2jah n ASP 245 Ca 0.06 0.34 -0.36 0.00 0.71 0.00 0.00 54.79 55.54 2jah n ASP 245 Cb 0.20 -0.43 -0.14 0.00 -0.02 0.00 0.00 41.12 40.73 2jah n ASP 245 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2jah s GLN 246 N -2.87 2.79 0.00 -1.24 0.74 -0.93 -4.95 119.66 113.20 2jah s GLN 246 Ca 0.13 -1.03 0.05 0.00 0.05 0.00 0.00 55.36 54.56 2jah s GLN 246 Cb 0.14 -3.18 0.28 0.00 1.10 0.00 0.00 33.01 31.35 2jah s GLN 246 CO 0.37 -0.49 0.76 0.28 -0.55 0.00 0.00 175.29 175.66