#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jap n ALA 4 N 0.00 2.02 -1.04 7.33 0.00 -1.15 -3.43 120.51 124.24 2jap n ALA 4 Ca 0.00 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.49 2jap n ALA 4 Cb 0.00 -1.38 0.13 0.00 0.00 0.00 0.00 19.45 18.20 2jap n ALA 4 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jap n LEU 5 N -1.71 2.33 -4.63 0.00 4.77 -0.08 -5.02 117.00 112.65 2jap n LEU 5 Ca 0.05 -3.04 -0.50 0.00 -0.03 0.00 0.00 56.01 52.49 2jap n LEU 5 Cb 0.28 -0.41 -0.05 0.00 -2.33 0.00 0.00 43.42 40.91 2jap n LEU 5 CO 0.22 0.70 1.07 1.67 -1.33 0.00 0.00 177.39 179.72 2jap n GLN 6 N -1.40 1.59 -0.96 3.23 -0.06 -1.16 -1.24 117.38 117.37 2jap n GLN 6 Ca 0.15 0.57 0.00 0.00 -2.00 0.00 0.00 57.00 55.73 2jap n GLN 6 Cb 0.63 -2.28 0.00 0.00 -4.06 0.00 0.00 30.24 24.53 2jap n GLN 6 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2jap n GLY 7 N 3.07 0.81 3.89 1.69 0.00 -1.24 -4.96 105.19 108.44 2jap n GLY 7 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2jap n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jap s LYS 8 N -0.12 3.72 -0.15 1.61 -0.14 -0.38 -4.95 119.74 119.34 2jap s LYS 8 Ca 0.00 0.14 -0.01 0.00 -1.36 0.00 0.00 55.97 54.74 2jap s LYS 8 Cb 0.00 -2.66 -0.01 0.00 -1.68 0.00 0.00 37.83 33.48 2jap s LYS 8 CO 0.00 0.29 -0.11 0.08 -0.76 0.00 0.00 175.35 174.85 2jap s VAL 9 N -1.91 3.12 -0.10 3.17 1.01 -1.26 -0.48 120.40 123.94 2jap s VAL 9 Ca 0.46 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2jap s VAL 9 Cb -0.11 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 2jap s VAL 9 CO 0.25 0.50 -0.18 0.00 0.00 0.00 0.00 175.10 175.68 2jap s ALA 10 N 0.63 2.45 -0.23 5.51 0.00 0.48 -0.80 121.76 129.81 2jap s ALA 10 Ca -0.06 -0.94 -0.06 0.00 0.00 0.00 0.00 51.96 50.89 2jap s ALA 10 Cb -0.15 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 2jap s ALA 10 CO 0.03 0.32 0.04 -1.17 0.00 0.00 0.00 175.76 174.99 2jap s LEU 11 N 0.13 3.37 -0.21 0.00 2.96 0.29 -0.30 118.68 124.91 2jap s LEU 11 Ca -0.09 -0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 2jap s LEU 11 Cb -0.15 -1.89 0.02 0.00 0.50 0.00 0.00 46.19 44.66 2jap s LEU 11 CO 0.06 -0.00 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.34 2jap s ILE 12 N 1.40 2.64 0.33 6.68 1.09 -0.13 -0.29 121.20 132.93 2jap s ILE 12 Ca 0.05 -0.87 -0.10 0.00 -1.10 0.00 0.00 60.65 58.62 2jap s ILE 12 Cb -0.15 -2.22 -0.07 0.00 -1.06 0.00 0.00 42.46 38.96 2jap s ILE 12 CO 0.02 0.39 0.69 0.42 -0.10 0.00 0.00 174.94 176.36 2jap s THR 13 N 1.34 4.82 -1.04 2.92 -4.23 -0.59 -1.20 115.64 117.67 2jap s THR 13 Ca 0.03 0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 61.08 2jap s THR 13 Cb -0.15 -3.68 0.01 0.00 1.34 0.00 0.00 72.50 70.02 2jap s THR 13 CO -0.08 -0.33 0.90 0.61 -0.54 0.00 0.00 174.62 175.18 2jap n GLY 14 N -0.81 -0.22 0.41 3.99 0.00 0.29 -2.79 105.19 106.06 2jap n GLY 14 Ca 0.02 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2jap n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jap n ALA 15 N -4.17 2.88 0.55 4.61 0.00 -0.84 -3.64 120.51 119.90 2jap n ALA 15 Ca -0.07 -0.46 0.13 0.00 0.00 0.00 0.00 53.44 53.04 2jap n ALA 15 Cb 0.58 -1.09 0.40 0.00 0.00 0.00 0.00 19.45 19.33 2jap n ALA 15 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jap h SER 16 N 2.01 0.00 -5.04 0.00 4.64 -1.90 -3.23 113.55 110.03 2jap h SER 16 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 2jap h SER 16 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2jap h SER 16 CO 0.00 0.00 0.30 -0.94 -0.87 0.00 0.00 176.83 175.32 2jap s SER 17 N -4.69 -0.06 1.22 4.97 1.04 -1.26 -4.78 113.70 110.14 2jap s SER 17 Ca 0.09 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.55 2jap s SER 17 Cb 0.11 0.79 0.00 0.00 0.10 0.00 0.00 66.02 67.02 2jap s SER 17 CO 0.57 -1.54 0.00 0.61 0.98 0.00 0.00 173.24 173.87 2jap n GLY 18 N -0.53 3.05 0.30 7.32 0.00 -1.26 -2.33 105.19 111.74 2jap n GLY 18 Ca -0.07 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 2jap n GLY 18 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jap h ILE 19 N 0.00 1.24 -0.82 -0.61 2.04 -1.88 -2.48 117.51 115.00 2jap h ILE 19 Ca 0.00 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 2jap h ILE 19 Cb 0.00 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 2jap h ILE 19 CO 0.00 0.30 0.40 1.23 0.00 0.00 0.00 178.15 180.08 2jap h GLY 20 N 0.97 1.27 0.93 5.37 0.00 -1.61 0.42 103.07 110.42 2jap h GLY 20 Ca 0.23 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 2jap h GLY 20 CO -0.02 0.59 0.06 -2.09 0.00 0.00 0.00 176.54 175.08 2jap h GLU 21 N 1.17 0.14 -0.57 4.80 4.81 -1.30 -0.90 114.58 122.72 2jap h GLU 21 Ca 0.28 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.45 2jap h GLU 21 Cb 0.11 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 2jap h GLU 21 CO -0.04 0.17 0.14 0.00 -0.73 0.00 0.00 179.01 178.56 2jap h ALA 22 N 0.96 1.18 -0.35 2.92 0.00 -1.19 -2.19 119.26 120.59 2jap h ALA 22 Ca 0.04 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2jap h ALA 22 Cb 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2jap h ALA 22 CO -0.01 0.56 -0.11 1.15 0.00 0.00 0.00 179.25 180.84 2jap h THR 23 N 0.84 1.28 -0.81 0.00 2.02 -0.78 -1.08 112.91 114.39 2jap h THR 23 Ca 0.19 -1.19 0.01 0.00 0.77 0.00 0.00 66.41 66.18 2jap h THR 23 Cb 0.30 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 2jap h THR 23 CO -0.00 0.39 0.53 0.00 0.37 0.00 0.00 175.52 176.81 2jap h ALA 24 N 0.81 1.02 -0.44 6.16 0.00 -1.00 -0.84 119.26 124.97 2jap h ALA 24 Ca 0.09 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2jap h ALA 24 Cb 0.63 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2jap h ALA 24 CO 0.04 0.44 0.22 0.00 0.00 0.00 0.00 179.25 179.94 2jap h ARG 25 N 1.09 0.64 -0.50 0.00 3.08 -1.29 -1.86 114.38 115.55 2jap h ARG 25 Ca 0.29 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 2jap h ARG 25 Cb -0.12 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 2jap h ARG 25 CO -0.06 0.55 0.01 0.00 -1.07 0.00 0.00 179.97 179.40 2jap h ALA 26 N 1.06 0.67 -0.37 0.04 0.00 -0.70 -0.29 119.26 119.67 2jap h ALA 26 Ca 0.15 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 2jap h ALA 26 Cb 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2jap h ALA 26 CO -0.02 0.46 -0.38 -0.07 0.00 0.00 0.00 179.25 179.24 2jap h LEU 27 N 0.73 0.98 -1.05 0.00 3.38 -1.17 -2.53 115.31 115.65 2jap h LEU 27 Ca 0.14 -0.47 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 2jap h LEU 27 Cb 0.50 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2jap h LEU 27 CO 0.02 1.25 0.30 0.00 0.09 0.00 0.00 178.44 180.11 2jap h ALA 28 N 0.76 1.26 0.00 1.53 0.00 -1.21 -1.72 119.26 119.88 2jap h ALA 28 Ca 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2jap h ALA 28 Cb 0.98 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2jap h ALA 28 CO 0.09 0.56 -0.09 0.00 0.00 0.00 0.00 179.25 179.81 2jap h ALA 29 N 1.37 1.60 -0.02 0.00 0.00 -0.80 -0.50 119.26 120.91 2jap h ALA 29 Ca 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2jap h ALA 29 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2jap h ALA 29 CO -0.03 0.11 0.00 0.39 0.00 0.00 0.00 179.25 179.73 2jap n GLU 30 N -4.07 1.35 -0.11 0.00 -0.58 -0.71 -4.83 120.64 111.68 2jap n GLU 30 Ca -0.03 -0.50 0.00 0.00 -0.42 0.00 0.00 57.16 56.21 2jap n GLU 30 Cb 0.18 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 2jap n GLU 30 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jap n GLY 31 N 1.07 0.71 3.77 0.62 0.00 -0.19 -0.90 105.19 110.25 2jap n GLY 31 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 2jap n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jap s ALA 32 N -2.14 3.28 0.21 4.61 0.00 -0.83 -3.61 121.76 123.28 2jap s ALA 32 Ca 0.00 0.79 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 2jap s ALA 32 Cb 0.00 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.75 2jap s ALA 32 CO 0.00 -0.13 1.09 0.00 0.00 0.00 0.00 175.76 176.71 2jap s ALA 33 N -1.35 3.38 -0.14 0.00 0.00 0.37 -4.13 121.76 119.88 2jap s ALA 33 Ca 0.49 0.82 0.02 0.00 0.00 0.00 0.00 51.96 53.29 2jap s ALA 33 Cb -0.28 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.52 2jap s ALA 33 CO 0.35 -0.16 -0.21 0.14 0.00 0.00 0.00 175.76 175.87 2jap s VAL 34 N -0.54 2.00 -0.28 0.00 -7.23 -0.26 -0.39 120.40 113.70 2jap s VAL 34 Ca 0.47 -0.94 -0.15 0.00 -1.81 0.00 0.00 61.98 59.55 2jap s VAL 34 Cb -0.30 -1.77 -0.03 0.00 0.56 0.00 0.00 36.38 34.84 2jap s VAL 34 CO 0.36 0.54 0.39 0.00 -0.31 0.00 0.00 175.10 176.08 2jap s ALA 35 N 0.86 3.55 -0.22 1.32 0.00 0.58 -1.20 121.76 126.66 2jap s ALA 35 Ca -0.06 -0.84 -0.05 0.00 0.00 0.00 0.00 51.96 51.00 2jap s ALA 35 Cb -0.15 -2.75 -0.02 0.00 0.00 0.00 0.00 23.12 20.19 2jap s ALA 35 CO -0.03 -0.74 0.01 0.96 0.00 0.00 0.00 175.76 175.97 2jap s ILE 36 N 2.11 3.95 -0.05 0.00 -4.36 -0.05 -0.95 121.20 121.84 2jap s ILE 36 Ca 0.15 -0.31 0.05 0.00 -0.26 0.00 0.00 60.65 60.28 2jap s ILE 36 Cb -0.16 -2.80 -0.00 0.00 1.25 0.00 0.00 42.46 40.75 2jap s ILE 36 CO 0.10 0.41 -0.20 0.00 0.24 0.00 0.00 174.94 175.49 2jap s ALA 37 N 1.23 1.74 -0.01 2.27 0.00 -0.34 -0.74 121.76 125.91 2jap s ALA 37 Ca 0.03 -0.80 -0.21 0.00 0.00 0.00 0.00 51.96 50.99 2jap s ALA 37 Cb -0.15 -0.58 0.07 0.00 0.00 0.00 0.00 23.12 22.47 2jap s ALA 37 CO 0.01 0.31 0.95 0.00 0.00 0.00 0.00 175.76 177.03 2jap n ALA 38 N 3.15 -2.66 0.01 0.00 0.00 -0.94 -0.55 120.51 119.51 2jap n ALA 38 Ca -0.18 -0.61 -0.17 0.00 0.00 0.00 0.00 53.44 52.48 2jap n ALA 38 Cb 0.53 0.13 -0.14 0.00 0.00 0.00 0.00 19.45 19.97 2jap n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jap h ARG 39 N 0.00 0.19 -6.00 0.00 3.08 -1.86 0.07 114.38 109.86 2jap h ARG 39 Ca -0.16 -0.33 -0.54 0.00 0.07 0.00 0.00 59.98 59.02 2jap h ARG 39 Cb 0.88 0.12 -0.09 0.00 0.08 0.00 0.00 29.97 30.97 2jap h ARG 39 CO 0.23 1.00 1.39 1.03 -1.07 0.00 0.00 179.97 182.55 2jap s ARG 40 N -2.58 3.39 0.23 0.04 0.52 -1.26 -4.83 118.95 114.45 2jap s ARG 40 Ca -0.15 -1.02 -0.07 0.00 -0.52 0.00 0.00 55.73 53.97 2jap s ARG 40 Cb 0.07 -5.31 0.31 0.00 0.52 0.00 0.00 34.95 30.54 2jap s ARG 40 CO 0.80 -2.48 1.81 0.28 0.02 0.00 0.00 175.30 175.73 2jap h VAL 41 N 6.79 0.95 -0.69 3.52 2.07 -1.96 -2.56 116.25 124.36 2jap h VAL 41 Ca 0.20 -0.26 0.08 0.00 0.82 0.00 0.00 66.70 67.54 2jap h VAL 41 Cb 1.00 0.13 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 2jap h VAL 41 CO 1.38 0.14 0.36 -0.08 0.02 0.00 0.00 177.57 179.40 2jap h GLU 42 N 0.75 0.62 -0.32 1.57 4.81 -1.99 0.10 114.58 120.12 2jap h GLU 42 Ca 0.35 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.40 2jap h GLU 42 Cb 0.25 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2jap h GLU 42 CO -0.21 0.41 -0.37 0.87 -0.73 0.00 0.00 179.01 178.99 2jap h LYS 43 N 0.64 0.75 -0.70 1.92 1.57 -1.84 -2.32 116.57 116.59 2jap h LYS 43 Ca 0.33 -0.37 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2jap h LYS 43 Cb 0.29 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 2jap h LYS 43 CO -0.23 0.99 0.27 -0.07 -0.57 0.00 0.00 179.45 179.84 2jap h LEU 44 N 0.62 0.97 -0.71 2.94 3.38 -0.99 -1.87 115.31 119.65 2jap h LEU 44 Ca 0.06 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 2jap h LEU 44 Cb 0.91 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2jap h LEU 44 CO 0.08 0.89 0.02 0.03 0.09 0.00 0.00 178.44 179.55 2jap h ARG 45 N 1.00 1.01 -0.42 1.13 3.08 -0.72 0.42 114.38 119.88 2jap h ARG 45 Ca 0.23 -0.30 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 2jap h ARG 45 Cb 0.22 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2jap h ARG 45 CO -0.02 0.98 0.19 0.00 -1.07 0.00 0.00 179.97 180.05 2jap h ALA 46 N 1.08 0.55 -0.36 0.04 0.00 -1.30 0.11 119.26 119.37 2jap h ALA 46 Ca 0.17 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2jap h ALA 46 Cb 0.51 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2jap h ALA 46 CO 0.02 0.12 0.07 1.25 0.00 0.00 0.00 179.25 180.72 2jap h LEU 47 N 0.54 0.57 -0.74 0.00 5.85 -1.13 -2.24 115.31 118.16 2jap h LEU 47 Ca 0.14 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.67 2jap h LEU 47 Cb 0.15 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 2jap h LEU 47 CO -0.02 0.67 0.43 1.23 -0.34 0.00 0.00 178.44 180.42 2jap h GLY 48 N 0.44 1.09 0.92 3.75 0.00 0.05 0.15 103.07 109.48 2jap h GLY 48 Ca 0.11 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.15 2jap h GLY 48 CO 0.00 0.20 0.13 -0.55 0.00 0.00 0.00 176.54 176.33 2jap h ASP 49 N 0.80 0.20 0.03 0.19 3.32 -0.73 -0.40 116.42 119.83 2jap h ASP 49 Ca 0.33 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.40 2jap h ASP 49 Cb 0.17 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2jap h ASP 49 CO -0.17 0.15 -0.20 -0.08 -1.72 0.00 0.00 179.24 177.22 2jap h GLU 50 N 0.27 -0.32 -0.53 3.56 4.81 -0.76 0.29 114.58 121.90 2jap h GLU 50 Ca 0.10 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2jap h GLU 50 Cb 0.01 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2jap h GLU 50 CO -0.06 -0.22 0.12 -0.07 -0.73 0.00 0.00 179.01 178.06 2jap h LEU 51 N -0.34 0.81 -0.93 1.64 3.38 -0.94 -1.91 115.31 117.03 2jap h LEU 51 Ca 0.05 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 2jap h LEU 51 Cb 0.39 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2jap h LEU 51 CO -0.16 0.84 0.19 0.74 0.09 0.00 0.00 178.44 180.14 2jap h THR 52 N 0.75 1.24 0.00 0.22 2.02 -0.97 -0.05 112.91 116.12 2jap h THR 52 Ca 0.17 -0.83 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 2jap h THR 52 Cb 0.35 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.30 2jap h THR 52 CO 0.00 0.32 -0.15 0.00 0.37 0.00 0.00 175.52 176.06 2jap h ALA 53 N 1.27 1.10 -0.23 6.16 0.00 -0.71 -2.13 119.26 124.72 2jap h ALA 53 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2jap h ALA 53 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2jap h ALA 53 CO -0.01 0.19 0.00 0.00 0.00 0.00 0.00 179.25 179.43 2jap n ALA 54 N -2.22 2.50 -0.15 0.00 0.00 -0.74 -4.92 120.51 114.97 2jap n ALA 54 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2jap n ALA 54 Cb 0.33 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.73 2jap n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jap n GLY 55 N 1.13 0.82 3.88 0.00 0.00 -0.80 -5.06 105.19 105.17 2jap n GLY 55 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2jap n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jap s ALA 56 N -2.09 3.34 -0.27 4.61 0.00 -0.09 -4.98 121.76 122.28 2jap s ALA 56 Ca 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 2jap s ALA 56 Cb 0.00 -2.70 -0.03 0.00 0.00 0.00 0.00 23.12 20.38 2jap s ALA 56 CO 0.00 -0.19 0.39 0.21 0.00 0.00 0.00 175.76 176.17 2jap s LYS 57 N -4.28 4.00 -0.03 0.00 2.20 -1.26 -4.10 119.74 116.27 2jap s LYS 57 Ca 0.50 0.05 0.05 0.00 -0.36 0.00 0.00 55.97 56.22 2jap s LYS 57 Cb -0.10 -3.66 -0.01 0.00 -1.51 0.00 0.00 37.83 32.54 2jap s LYS 57 CO 0.38 -0.30 -0.19 0.08 -0.36 0.00 0.00 175.35 174.96 2jap s VAL 58 N 2.10 1.55 -0.21 4.02 1.01 -1.26 -1.10 120.40 126.50 2jap s VAL 58 Ca 0.15 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.33 2jap s VAL 58 Cb -0.16 -1.31 0.05 0.00 0.00 0.00 0.00 36.38 34.96 2jap s VAL 58 CO 0.10 0.44 -0.07 -2.28 0.00 0.00 0.00 175.10 173.29 2jap s HIS 59 N -0.23 2.29 -0.13 5.22 5.04 -0.34 -4.99 115.29 122.15 2jap s HIS 59 Ca 0.02 -1.59 -0.22 0.00 -1.54 0.00 0.00 55.06 51.73 2jap s HIS 59 Cb -0.10 -1.56 -0.03 0.00 0.04 0.00 0.00 32.58 30.93 2jap s HIS 59 CO 0.01 -0.74 0.67 0.08 -2.34 0.00 0.00 174.74 172.42 2jap s VAL 60 N 1.43 5.03 -0.19 0.89 1.01 -1.26 -0.87 120.40 126.44 2jap s VAL 60 Ca -0.03 1.33 0.01 0.00 0.00 0.00 0.00 61.98 63.29 2jap s VAL 60 Cb -0.17 -4.00 0.04 0.00 0.00 0.00 0.00 36.38 32.25 2jap s VAL 60 CO -0.07 0.18 -0.09 -0.76 0.00 0.00 0.00 175.10 174.35 2jap s LEU 61 N 1.35 2.13 -0.32 3.92 1.43 0.08 -4.95 118.68 122.33 2jap s LEU 61 Ca 0.33 -0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 52.31 2jap s LEU 61 Cb -0.17 -1.17 0.01 0.00 0.03 0.00 0.00 46.19 44.89 2jap s LEU 61 CO 0.14 -0.15 1.22 -0.70 0.23 0.00 0.00 176.35 177.09 2jap s GLU 62 N 1.44 3.94 -0.11 1.70 2.12 -1.26 -2.22 118.70 124.31 2jap s GLU 62 Ca -0.01 1.13 -0.08 0.00 0.36 0.00 0.00 54.97 56.38 2jap s GLU 62 Cb -0.16 -3.84 0.04 0.00 0.26 0.00 0.00 34.13 30.43 2jap s GLU 62 CO -0.08 -1.09 0.28 -1.17 -0.54 0.00 0.00 175.26 172.66 2jap s LEU 63 N 4.19 0.54 -0.31 2.70 2.96 0.01 -4.91 118.68 123.86 2jap s LEU 63 Ca 0.52 0.59 -0.10 0.00 -0.22 0.00 0.00 54.13 54.93 2jap s LEU 63 Cb -0.14 0.91 -0.01 0.00 0.50 0.00 0.00 46.19 47.45 2jap s LEU 63 CO 0.22 -0.14 0.16 -0.62 -1.32 0.00 0.00 176.35 174.64 2jap s ASP 64 N 0.85 5.59 0.52 3.68 2.15 -1.26 -3.24 116.67 124.95 2jap s ASP 64 Ca -0.06 -0.52 0.34 0.00 0.43 0.00 0.00 52.55 52.74 2jap s ASP 64 Cb -0.07 -2.01 1.50 0.00 -0.30 0.00 0.00 42.92 42.04 2jap s ASP 64 CO -0.06 -0.20 2.00 -0.37 -0.17 0.00 0.00 175.17 176.38 2jap h VAL 65 N 5.65 0.00 0.00 1.11 -1.51 -1.94 -1.52 116.25 118.04 2jap h VAL 65 Ca -0.32 -0.34 0.00 0.00 -1.23 0.00 0.00 66.70 64.81 2jap h VAL 65 Cb 1.15 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 2jap h VAL 65 CO 0.62 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.96 2jap n ALA 66 N -2.02 1.91 -2.71 5.19 0.00 -1.26 -4.17 120.51 117.45 2jap n ALA 66 Ca 0.00 0.02 -0.43 0.00 0.00 0.00 0.00 53.44 53.03 2jap n ALA 66 Cb 0.24 -1.41 -0.06 0.00 0.00 0.00 0.00 19.45 18.22 2jap n ALA 66 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jap s ASP 67 N -4.12 6.27 0.21 0.00 2.15 -0.57 -4.91 116.67 115.69 2jap s ASP 67 Ca 0.07 -0.69 -0.10 0.00 0.43 0.00 0.00 52.55 52.27 2jap s ASP 67 Cb 0.11 -2.34 0.21 0.00 -0.30 0.00 0.00 42.92 40.60 2jap s ASP 67 CO 0.46 -1.00 1.84 -0.09 -0.17 0.00 0.00 175.17 176.21 2jap h ARG 68 N 9.10 0.82 -0.25 4.34 2.43 -1.86 0.76 114.38 129.72 2jap h ARG 68 Ca -0.27 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 58.72 2jap h ARG 68 Cb 1.09 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 2jap h ARG 68 CO 1.00 0.54 -0.40 1.96 -1.51 0.00 0.00 179.97 181.56 2jap h GLN 69 N 0.84 0.59 -0.73 0.20 4.20 -1.96 -2.45 115.11 115.81 2jap h GLN 69 Ca 0.29 -0.30 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 2jap h GLN 69 Cb 0.05 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2jap h GLN 69 CO -0.12 0.89 0.19 0.78 -0.67 0.00 0.00 178.83 179.90 2jap h GLY 70 N 1.03 1.24 0.72 3.46 0.00 -1.72 -2.13 103.07 105.67 2jap h GLY 70 Ca 0.04 -0.77 0.02 0.00 0.00 0.00 0.00 47.33 46.62 2jap h GLY 70 CO 0.08 0.71 -0.12 -2.08 0.00 0.00 0.00 176.54 175.14 2jap h VAL 71 N 1.09 0.71 -0.70 4.60 2.07 -0.73 -0.62 116.25 122.68 2jap h VAL 71 Ca 0.23 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.77 2jap h VAL 71 Cb 0.36 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 2jap h VAL 71 CO -0.00 0.00 0.45 0.44 0.02 0.00 0.00 177.57 178.48 2jap h ASP 72 N -0.21 0.74 -0.49 0.57 3.32 -1.27 -1.91 116.42 117.18 2jap h ASP 72 Ca 0.04 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 2jap h ASP 72 Cb 0.25 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2jap h ASP 72 CO -0.11 0.52 -0.11 0.00 -1.72 0.00 0.00 179.24 177.82 2jap h ALA 73 N 1.29 0.67 -0.48 3.45 0.00 -1.26 -2.36 119.26 120.57 2jap h ALA 73 Ca 0.28 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2jap h ALA 73 Cb -0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2jap h ALA 73 CO -0.10 0.57 0.28 0.00 0.00 0.00 0.00 179.25 180.00 2jap h ALA 74 N 0.89 0.61 -0.27 0.00 0.00 -0.69 0.15 119.26 119.95 2jap h ALA 74 Ca 0.12 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2jap h ALA 74 Cb 0.66 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2jap h ALA 74 CO 0.05 -0.03 0.09 0.28 0.00 0.00 0.00 179.25 179.64 2jap h VAL 75 N 0.56 1.19 -0.83 0.00 2.07 -1.35 -1.83 116.25 116.06 2jap h VAL 75 Ca 0.19 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2jap h VAL 75 Cb 0.02 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 2jap h VAL 75 CO -0.09 0.20 0.47 0.00 0.02 0.00 0.00 177.57 178.17 2jap h ALA 76 N 0.92 1.07 -0.69 1.67 0.00 -1.20 -1.93 119.26 119.09 2jap h ALA 76 Ca 0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2jap h ALA 76 Cb 0.23 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2jap h ALA 76 CO -0.00 0.57 0.30 1.03 0.00 0.00 0.00 179.25 181.15 2jap h SER 77 N 1.16 0.93 -0.11 0.00 0.87 -0.63 -1.28 113.55 114.48 2jap h SER 77 Ca 0.30 -0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2jap h SER 77 Cb 0.01 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 2jap h SER 77 CO -0.05 0.82 0.06 0.74 -0.53 0.00 0.00 176.83 177.87 2jap h THR 78 N 0.97 1.11 -0.39 2.23 2.02 -0.96 -0.42 112.91 117.46 2jap h THR 78 Ca 0.23 -0.31 -0.10 0.00 0.77 0.00 0.00 66.41 67.00 2jap h THR 78 Cb 0.16 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2jap h THR 78 CO -0.02 0.10 -0.18 0.58 0.37 0.00 0.00 175.52 176.36 2jap h VAL 79 N 0.07 1.26 -0.20 3.16 2.07 -1.31 0.81 116.25 122.11 2jap h VAL 79 Ca 0.04 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.28 2jap h VAL 79 Cb 0.10 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2jap h VAL 79 CO -0.01 0.42 0.05 -0.08 0.02 0.00 0.00 177.57 177.98 2jap h GLU 80 N 0.66 0.33 0.06 1.57 4.22 -1.14 0.32 114.58 120.60 2jap h GLU 80 Ca 0.10 -0.08 -0.23 0.00 0.08 0.00 0.00 59.36 59.23 2jap h GLU 80 Cb 0.67 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 2jap h GLU 80 CO 0.05 0.45 -1.08 0.00 -2.18 0.00 0.00 179.01 176.25 2jap h ALA 81 N 0.87 0.28 -0.00 2.92 0.00 -0.91 -3.37 119.26 119.04 2jap h ALA 81 Ca 0.06 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.12 2jap h ALA 81 Cb 0.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2jap h ALA 81 CO 0.00 1.05 -0.04 1.28 0.00 0.00 0.00 179.25 181.54 2jap n LEU 82 N -3.50 1.02 0.00 0.00 4.77 0.27 -5.03 117.00 114.53 2jap n LEU 82 Ca -0.04 -0.87 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 2jap n LEU 82 Cb 0.94 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.03 2jap n LEU 82 CO 0.50 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 2jap n GLY 83 N 0.45 0.57 0.00 -0.72 0.00 0.10 -4.94 105.19 100.65 2jap n GLY 83 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jap n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jap n GLY 84 N -2.00 -1.26 2.92 -0.02 0.00 -1.20 -4.96 105.19 98.66 2jap n GLY 84 Ca 0.00 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.85 2jap n GLY 84 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jap s LEU 85 N 0.00 -0.08 -0.10 0.99 2.96 -1.26 -4.35 118.68 116.84 2jap s LEU 85 Ca 0.00 0.44 0.07 0.00 -0.22 0.00 0.00 54.13 54.43 2jap s LEU 85 Cb 0.00 0.47 -0.11 0.00 0.50 0.00 0.00 46.19 47.05 2jap s LEU 85 CO 0.00 -0.23 0.01 0.47 -1.32 0.00 0.00 176.35 175.28 2jap n ASP 86 N 5.19 2.75 -3.80 3.68 8.00 0.02 -4.15 116.55 128.25 2jap n ASP 86 Ca -0.08 -0.01 -0.19 0.00 0.71 0.00 0.00 54.79 55.23 2jap n ASP 86 Cb 0.50 0.61 -0.17 0.00 -0.02 0.00 0.00 41.12 42.04 2jap n ASP 86 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jap s ILE 87 N -2.23 0.21 -0.17 0.53 1.01 -0.25 -0.69 121.20 119.62 2jap s ILE 87 Ca -0.06 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.66 2jap s ILE 87 Cb 0.03 -0.33 -0.02 0.00 0.01 0.00 0.00 42.46 42.15 2jap s ILE 87 CO 0.37 0.17 -0.04 -0.22 0.00 0.00 0.00 174.94 175.22 2jap s LEU 88 N 1.28 3.16 -0.38 2.97 2.96 -0.39 -0.55 118.68 127.74 2jap s LEU 88 Ca -0.06 -0.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.60 2jap s LEU 88 Cb -0.13 -1.77 0.07 0.00 0.50 0.00 0.00 46.19 44.86 2jap s LEU 88 CO -0.02 0.13 0.17 -0.69 -1.32 0.00 0.00 176.35 174.62 2jap s VAL 89 N 0.57 3.74 -1.25 1.68 1.01 0.60 0.09 120.40 126.85 2jap s VAL 89 Ca -0.03 -1.44 -0.17 0.00 0.00 0.00 0.00 61.98 60.34 2jap s VAL 89 Cb -0.14 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 33.07 2jap s VAL 89 CO 0.03 -0.39 1.62 0.20 0.00 0.00 0.00 175.10 176.56 2jap s ASN 90 N 1.72 6.88 -0.06 3.32 0.01 0.52 -1.55 114.94 125.78 2jap s ASN 90 Ca 0.01 -2.53 0.15 0.00 -0.71 0.00 0.00 52.86 49.79 2jap s ASN 90 Cb -0.21 -2.53 -0.22 0.00 0.41 0.00 0.00 41.25 38.70 2jap s ASN 90 CO 0.01 -1.07 0.25 -3.20 -1.51 0.00 0.00 177.10 171.58 2jap n ASN 91 N 7.62 1.43 -4.63 -1.22 2.85 -1.23 -1.72 115.26 118.36 2jap n ASN 91 Ca 0.44 0.00 -0.48 0.00 -0.11 0.00 0.00 54.58 54.42 2jap n ASN 91 Cb 0.45 1.45 -0.05 0.00 1.24 0.00 0.00 39.78 42.88 2jap n ASN 91 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jap n ALA 92 N -2.20 0.28 -3.56 5.20 0.00 -1.12 -4.76 120.51 114.35 2jap n ALA 92 Ca -0.09 0.47 -0.06 0.00 0.00 0.00 0.00 53.44 53.76 2jap n ALA 92 Cb 0.58 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.79 2jap n ALA 92 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jap s GLY 93 N 0.64 -0.34 0.01 0.00 0.00 -1.26 -4.57 107.32 101.80 2jap s GLY 93 Ca 0.80 1.45 0.00 0.00 0.00 0.00 0.00 44.72 46.97 2jap s GLY 93 CO 0.43 0.51 -0.02 -0.26 0.00 0.00 0.00 173.10 173.76 2jap s ILE 94 N -2.55 0.08 -0.29 0.90 -4.36 -1.26 -5.03 121.20 108.69 2jap s ILE 94 Ca 0.07 -0.52 0.02 0.00 -0.26 0.00 0.00 60.65 59.96 2jap s ILE 94 Cb -0.01 -0.17 0.08 0.00 1.25 0.00 0.00 42.46 43.62 2jap s ILE 94 CO -0.06 -0.27 -0.00 -0.32 0.24 0.00 0.00 174.94 174.53 2jap s MET 95 N -0.82 1.51 -0.46 0.37 1.75 -1.26 -4.85 119.30 115.54 2jap s MET 95 Ca -0.09 -1.37 -0.04 0.00 -1.25 0.00 0.00 55.69 52.95 2jap s MET 95 Cb -0.06 -2.75 0.12 0.00 2.84 0.00 0.00 34.83 34.99 2jap s MET 95 CO -0.01 -0.78 0.27 -0.51 -0.65 0.00 0.00 175.02 173.34 2jap s LEU 96 N 1.22 5.32 0.35 4.11 1.43 -1.26 -4.03 118.68 125.81 2jap s LEU 96 Ca 0.02 -2.17 -0.09 0.00 -1.03 0.00 0.00 54.13 50.87 2jap s LEU 96 Cb -0.19 -1.86 -0.06 0.00 0.03 0.00 0.00 46.19 44.11 2jap s LEU 96 CO -0.10 -0.53 0.67 -0.76 0.23 0.00 0.00 176.35 175.86 2jap s LEU 97 N 0.95 3.95 0.00 1.79 1.43 -1.26 -4.74 118.68 120.79 2jap s LEU 97 Ca 0.09 0.97 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 2jap s LEU 97 Cb -0.23 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.17 2jap s LEU 97 CO -0.04 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 176.86 2jap n GLY 98 N -1.05 3.38 3.72 -3.19 0.00 -0.03 -3.94 105.19 104.08 2jap n GLY 98 Ca 0.01 -1.06 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 2jap n GLY 98 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2jap s PRO 99 N -2.23 1.68 0.10 1.61 0.02 -1.26 -4.27 135.00 130.65 2jap s PRO 99 Ca 0.00 1.37 -0.17 0.00 0.02 0.00 0.00 61.00 62.22 2jap s PRO 99 Cb 0.00 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.65 2jap s PRO 99 CO 0.00 -2.11 1.54 0.28 -0.33 0.00 0.00 177.00 176.37 2jap h VAL 100 N -1.44 1.26 -1.94 3.83 2.07 -2.00 -3.38 116.25 114.65 2jap h VAL 100 Ca -0.43 -0.99 -0.64 0.00 0.82 0.00 0.00 66.70 65.46 2jap h VAL 100 Cb 1.25 1.27 0.04 0.00 -1.52 0.00 0.00 31.29 32.32 2jap h VAL 100 CO 0.47 0.32 0.86 1.21 0.02 0.00 0.00 177.57 180.45 2jap n GLU 101 N -4.53 1.79 -2.16 1.57 2.13 -1.26 -1.82 120.64 116.35 2jap n GLU 101 Ca -0.02 0.65 -0.17 0.00 0.66 0.00 0.00 57.16 58.28 2jap n GLU 101 Cb 0.28 -2.41 -0.03 0.00 0.27 0.00 0.00 31.44 29.55 2jap n GLU 101 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2jap n ASP 102 N 4.75 -4.77 -4.74 4.31 2.03 -1.26 -4.92 116.55 111.94 2jap n ASP 102 Ca 0.21 0.18 -0.35 0.00 0.52 0.00 0.00 54.79 55.35 2jap n ASP 102 Cb 0.24 -4.08 0.06 0.00 -0.72 0.00 0.00 41.12 36.62 2jap n ASP 102 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jap s ALA 103 N -2.71 2.37 -0.56 -1.67 0.00 -0.76 -4.94 121.76 113.49 2jap s ALA 103 Ca 0.00 0.92 -0.28 0.00 0.00 0.00 0.00 51.96 52.61 2jap s ALA 103 Cb 0.00 -3.45 0.01 0.00 0.00 0.00 0.00 23.12 19.68 2jap s ALA 103 CO 0.00 -1.47 1.44 0.34 0.00 0.00 0.00 175.76 176.07 2jap s ASP 104 N -1.85 6.10 0.05 0.00 -1.08 -1.26 -4.90 116.67 113.72 2jap s ASP 104 Ca 0.75 0.31 0.16 0.00 -0.52 0.00 0.00 52.55 53.26 2jap s ASP 104 Cb -0.29 -2.54 0.69 0.00 -1.46 0.00 0.00 42.92 39.32 2jap s ASP 104 CO 0.39 -1.73 1.52 0.35 0.52 0.00 0.00 175.17 176.22 2jap n THR 105 N 6.88 0.95 0.23 1.71 -2.24 -1.26 -1.17 114.28 119.38 2jap n THR 105 Ca 0.13 0.24 0.09 0.00 -2.27 0.00 0.00 64.05 62.24 2jap n THR 105 Cb 0.49 -1.02 0.58 0.00 -2.10 0.00 0.00 70.33 68.28 2jap n THR 105 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2jap h THR 106 N 0.00 0.75 -0.80 4.28 1.35 -2.00 -1.92 112.91 114.57 2jap h THR 106 Ca 0.00 -0.83 0.09 0.00 -0.55 0.00 0.00 66.41 65.12 2jap h THR 106 Cb 0.28 1.51 -0.07 0.00 -1.73 0.00 0.00 68.15 68.14 2jap h THR 106 CO 0.00 0.20 0.46 0.44 -0.25 0.00 0.00 175.52 176.37 2jap h ASP 107 N 0.00 0.66 -0.05 5.36 5.19 -1.56 -1.72 116.42 124.31 2jap h ASP 107 Ca -0.00 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.42 2jap h ASP 107 Cb 0.49 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.92 2jap h ASP 107 CO 0.03 0.38 -0.09 -0.50 -3.12 0.00 0.00 179.24 175.94 2jap h TRP 108 N 0.78 0.19 -0.50 4.55 4.06 -1.50 -1.91 115.95 121.62 2jap h TRP 108 Ca 0.38 -0.07 -0.10 0.00 2.06 0.00 0.00 58.89 61.17 2jap h TRP 108 Cb 0.33 -0.04 -0.02 0.00 -1.00 0.00 0.00 29.16 28.44 2jap h TRP 108 CO -0.06 0.68 -0.08 1.79 -3.56 0.00 0.00 178.44 177.21 2jap h THR 109 N -0.35 1.26 -0.12 1.49 1.35 -1.38 -0.07 112.91 115.08 2jap h THR 109 Ca 0.00 -1.17 -0.00 0.00 -0.55 0.00 0.00 66.41 64.69 2jap h THR 109 Cb 0.66 0.96 -0.01 0.00 -1.73 0.00 0.00 68.15 68.03 2jap h THR 109 CO 0.02 0.41 0.07 0.03 -0.25 0.00 0.00 175.52 175.80 2jap h ARG 110 N 0.81 0.16 -0.60 4.72 3.08 -1.34 -0.20 114.38 121.02 2jap h ARG 110 Ca 0.14 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.12 2jap h ARG 110 Cb 0.59 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 2jap h ARG 110 CO 0.04 0.16 0.17 0.52 -1.07 0.00 0.00 179.97 179.79 2jap h MET 111 N 0.12 0.94 -0.36 0.04 2.86 -1.02 -1.38 114.93 116.11 2jap h MET 111 Ca 0.04 -0.21 -0.06 0.00 -2.06 0.00 0.00 59.70 57.41 2jap h MET 111 Cb 0.04 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 2jap h MET 111 CO -0.01 0.84 0.00 0.82 1.06 0.00 0.00 176.91 179.63 2jap h ILE 112 N 0.85 1.26 -0.37 -1.22 2.04 -0.98 0.83 117.51 119.92 2jap h ILE 112 Ca 0.19 -0.98 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 2jap h ILE 112 Cb 0.31 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 2jap h ILE 112 CO -0.00 0.33 0.23 0.44 0.00 0.00 0.00 178.15 179.15 2jap h ASP 113 N 0.46 0.44 0.00 1.72 3.45 -0.91 0.31 116.42 121.89 2jap h ASP 113 Ca 0.10 -0.04 -0.01 0.00 0.43 0.00 0.00 57.03 57.51 2jap h ASP 113 Cb 0.46 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 39.12 2jap h ASP 113 CO 0.02 0.35 -0.09 0.74 -1.57 0.00 0.00 179.24 178.70 2jap h THR 114 N 0.49 0.41 -0.17 0.35 2.02 -1.25 0.39 112.91 115.15 2jap h THR 114 Ca 0.13 -1.32 -0.14 0.00 0.77 0.00 0.00 66.41 65.85 2jap h THR 114 Cb -0.01 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 2jap h THR 114 CO -0.03 0.14 -0.48 0.78 0.37 0.00 0.00 175.52 176.30 2jap h ASN 115 N -1.00 0.49 0.00 4.18 2.35 -0.96 -3.19 115.58 117.46 2jap h ASN 115 Ca -0.01 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2jap h ASN 115 Cb 0.30 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.53 2jap h ASN 115 CO -0.01 0.90 -0.16 -0.11 -1.65 0.00 0.00 177.43 176.40 2jap n LEU 116 N -3.98 0.44 -0.16 1.61 7.94 -1.01 -4.39 117.00 117.45 2jap n LEU 116 Ca -0.02 0.07 -0.08 0.00 -1.11 0.00 0.00 56.01 54.86 2jap n LEU 116 Cb 0.55 -0.37 0.00 0.00 0.53 0.00 0.00 43.42 44.13 2jap n LEU 116 CO 0.45 -0.49 0.94 0.25 -1.11 0.00 0.00 177.39 177.43 2jap h LEU 117 N -0.16 0.64 -0.61 -1.96 5.85 -1.02 -0.99 115.31 117.07 2jap h LEU 117 Ca 0.00 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.56 2jap h LEU 117 Cb 0.16 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2jap h LEU 117 CO 0.00 0.63 0.40 1.23 -0.34 0.00 0.00 178.44 180.36 2jap h GLY 118 N 0.61 0.86 1.01 3.75 0.00 -0.23 0.21 103.07 109.27 2jap h GLY 118 Ca 0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 2jap h GLY 118 CO -0.01 0.32 0.34 -2.00 0.00 0.00 0.00 176.54 175.18 2jap h LEU 119 N 0.82 0.90 -0.42 3.11 6.46 -1.50 -1.20 115.31 123.48 2jap h LEU 119 Ca 0.22 -0.13 -0.08 0.00 -0.12 0.00 0.00 57.88 57.77 2jap h LEU 119 Cb -0.09 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 39.60 2jap h LEU 119 CO -0.05 0.77 -0.05 0.24 -0.62 0.00 0.00 178.44 178.73 2jap h MET 120 N 0.96 0.77 -0.11 1.25 2.86 -0.68 -1.28 114.93 118.70 2jap h MET 120 Ca 0.24 -0.27 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2jap h MET 120 Cb 0.11 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2jap h MET 120 CO -0.03 0.88 0.03 1.88 1.06 0.00 0.00 176.91 180.73 2jap h TYR 121 N 0.60 0.05 -0.53 -0.22 0.99 -0.47 -1.63 116.97 115.77 2jap h TYR 121 Ca 0.11 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.84 2jap h TYR 121 Cb 0.56 -0.01 -0.03 0.00 1.00 0.00 0.00 36.73 38.26 2jap h TYR 121 CO 0.04 0.03 0.32 0.52 -0.00 0.00 0.00 178.16 179.07 2jap h MET 122 N 0.08 0.72 -0.21 4.88 2.86 -1.18 -1.30 114.93 120.78 2jap h MET 122 Ca 0.05 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.65 2jap h MET 122 Cb 0.03 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.51 2jap h MET 122 CO -0.05 0.53 0.04 1.15 1.06 0.00 0.00 176.91 179.64 2jap h THR 123 N 0.71 0.91 -0.42 2.22 2.02 -1.11 -1.10 112.91 116.13 2jap h THR 123 Ca 0.19 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.31 2jap h THR 123 Cb -0.01 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 2jap h THR 123 CO -0.04 0.02 0.18 -0.09 0.37 0.00 0.00 175.52 175.97 2jap h ARG 124 N 0.13 0.62 -0.44 6.66 2.43 -1.07 -1.13 114.38 121.57 2jap h ARG 124 Ca 0.10 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 59.06 2jap h ARG 124 Cb 0.09 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 2jap h ARG 124 CO -0.13 0.56 -0.14 0.00 -1.51 0.00 0.00 179.97 178.76 2jap h ALA 125 N 1.03 0.93 0.00 2.80 0.00 -1.12 -3.06 119.26 119.84 2jap h ALA 125 Ca 0.14 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 2jap h ALA 125 Cb 0.16 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2jap h ALA 125 CO -0.01 0.62 -0.58 0.00 0.00 0.00 0.00 179.25 179.27 2jap h ALA 126 N 1.11 0.84 -0.60 0.00 0.00 -1.02 -3.38 119.26 116.21 2jap h ALA 126 Ca 0.12 -0.53 0.10 0.00 0.00 0.00 0.00 54.91 54.60 2jap h ALA 126 Cb 0.64 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 2jap h ALA 126 CO 0.04 0.73 0.19 1.25 0.00 0.00 0.00 179.25 181.46 2jap h LEU 127 N 0.00 0.14 -1.08 0.00 5.85 -1.09 -0.76 115.31 118.36 2jap h LEU 127 Ca -0.01 0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.92 2jap h LEU 127 Cb 1.18 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 42.22 2jap h LEU 127 CO 0.08 0.09 0.62 -0.65 -0.34 0.00 0.00 178.44 178.23 2jap h PRO 128 N 0.35 0.93 -0.15 5.25 0.11 -1.76 0.14 132.00 136.87 2jap h PRO 128 Ca 0.31 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 66.15 2jap h PRO 128 Cb 0.41 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.31 2jap h PRO 128 CO -0.34 0.62 -0.74 0.45 -0.21 0.00 0.00 178.00 177.78 2jap h HIS 129 N 0.96 0.93 -0.41 0.65 3.86 -1.46 -2.80 115.15 116.88 2jap h HIS 129 Ca 0.47 -0.40 -0.11 0.00 -1.16 0.00 0.00 60.37 59.16 2jap h HIS 129 Cb 0.47 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 2jap h HIS 129 CO -0.00 1.21 -0.21 -0.07 0.86 0.00 0.00 177.93 179.72 2jap h LEU 130 N 0.48 0.81 -0.67 2.43 3.38 -0.48 -2.42 115.31 118.84 2jap h LEU 130 Ca -0.04 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.67 2jap h LEU 130 Cb 1.35 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 2jap h LEU 130 CO 0.15 1.00 0.42 -0.07 0.09 0.00 0.00 178.44 180.02 2jap h LEU 131 N 0.70 0.69 -0.85 1.67 3.38 -0.72 0.15 115.31 120.33 2jap h LEU 131 Ca 0.10 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2jap h LEU 131 Cb 0.72 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 2jap h LEU 131 CO 0.06 0.48 0.28 0.03 0.09 0.00 0.00 178.44 179.38 2jap h ARG 132 N 0.82 1.13 -0.04 1.13 3.08 -1.31 -3.09 114.38 116.10 2jap h ARG 132 Ca 0.27 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2jap h ARG 132 Cb 0.01 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.88 2jap h ARG 132 CO -0.10 0.92 0.00 -1.13 -1.07 0.00 0.00 179.97 178.59 2jap n SER 133 N -4.28 2.33 -4.04 7.04 3.41 -0.93 -4.94 113.62 112.21 2jap n SER 133 Ca 0.07 -1.78 -0.30 0.00 -0.26 0.00 0.00 58.87 56.60 2jap n SER 133 Cb 0.19 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 2jap n SER 133 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jap n LYS 134 N 0.82 -2.05 -0.25 4.33 5.02 0.35 -4.95 118.16 121.43 2jap n LYS 134 Ca 0.16 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.74 2jap n LYS 134 Cb 0.49 -3.99 0.00 0.00 -0.02 0.00 0.00 35.03 31.51 2jap n LYS 134 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jap n GLY 135 N -2.14 0.10 3.03 0.72 0.00 -0.15 -4.71 105.19 102.05 2jap n GLY 135 Ca -0.27 -1.82 -0.24 0.00 0.00 0.00 0.00 46.02 43.69 2jap n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jap s THR 136 N 0.09 1.11 -0.21 2.61 2.01 0.13 -1.19 115.64 120.19 2jap s THR 136 Ca 0.00 -0.49 -0.06 0.00 0.31 0.00 0.00 61.69 61.45 2jap s THR 136 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.48 2jap s THR 136 CO 0.00 0.34 0.03 0.54 -0.69 0.00 0.00 174.62 174.85 2jap s VAL 137 N 0.48 4.26 -0.25 3.82 0.11 0.06 -1.26 120.40 127.63 2jap s VAL 137 Ca -0.11 -0.21 -0.07 0.00 -2.93 0.00 0.00 61.98 58.66 2jap s VAL 137 Cb -0.14 -2.94 -0.03 0.00 -1.53 0.00 0.00 36.38 31.74 2jap s VAL 137 CO 0.03 0.41 0.07 -0.69 -3.33 0.00 0.00 175.10 171.59 2jap s VAL 138 N 0.97 4.28 -0.23 2.04 1.01 0.11 -0.97 120.40 127.61 2jap s VAL 138 Ca 0.03 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.70 2jap s VAL 138 Cb -0.14 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 2jap s VAL 138 CO 0.02 0.33 0.18 -1.10 0.00 0.00 0.00 175.10 174.53 2jap s GLN 139 N 1.61 4.10 -0.84 2.72 -1.52 0.92 -0.36 119.66 126.29 2jap s GLN 139 Ca 0.06 -0.22 -0.20 0.00 -1.95 0.00 0.00 55.36 53.05 2jap s GLN 139 Cb -0.15 -3.52 0.10 0.00 -0.22 0.00 0.00 33.01 29.22 2jap s GLN 139 CO 0.03 0.10 1.10 1.41 -0.25 0.00 0.00 175.29 177.68 2jap s MET 140 N 0.94 3.43 0.00 2.91 1.75 -0.70 -1.04 119.30 126.59 2jap s MET 140 Ca 0.09 -1.38 0.00 0.00 -1.25 0.00 0.00 55.69 53.15 2jap s MET 140 Cb -0.13 -4.71 0.00 0.00 2.84 0.00 0.00 34.83 32.82 2jap s MET 140 CO 0.04 -1.83 0.00 0.45 -0.65 0.00 0.00 175.02 173.03 2jap n SER 141 N 7.16 0.00 -3.59 1.11 2.88 0.88 -4.89 113.62 117.17 2jap n SER 141 Ca 0.15 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.64 2jap n SER 141 Cb 0.48 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.92 2jap n SER 141 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jap s SER 142 N -1.00 -0.24 0.55 -3.46 0.15 -1.24 -4.39 113.70 104.07 2jap s SER 142 Ca 0.00 -0.11 0.31 0.00 0.70 0.00 0.00 55.95 56.85 2jap s SER 142 Cb 0.00 0.34 1.47 0.00 -1.71 0.00 0.00 66.02 66.12 2jap s SER 142 CO 0.00 -0.58 1.89 -0.29 1.20 0.00 0.00 173.24 175.46 2jap h ILE 143 N 2.00 0.52 0.00 6.45 2.10 -1.17 0.78 117.51 128.20 2jap h ILE 143 Ca -0.21 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.73 2jap h ILE 143 Cb 1.22 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.51 2jap h ILE 143 CO 0.28 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.35 2jap n ALA 144 N -2.65 1.56 1.29 0.18 0.00 -1.26 -0.63 120.51 119.01 2jap n ALA 144 Ca 0.17 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.71 2jap n ALA 144 Cb 0.91 -1.21 0.38 0.00 0.00 0.00 0.00 19.45 19.52 2jap n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jap n GLY 145 N -0.23 0.37 0.00 0.00 0.00 0.27 -4.07 105.19 101.52 2jap n GLY 145 Ca 0.03 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2jap n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jap n ARG 146 N 0.57 2.91 -3.90 1.61 5.12 0.20 -4.41 116.66 118.76 2jap n ARG 146 Ca 0.17 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.96 2jap n ARG 146 Cb 0.43 -0.87 -0.14 0.00 -1.16 0.00 0.00 32.46 30.72 2jap n ARG 146 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2jap s VAL 147 N -1.73 0.06 -0.19 1.55 1.01 0.17 -5.13 120.40 116.15 2jap s VAL 147 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 2jap s VAL 147 Cb 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 36.38 36.26 2jap s VAL 147 CO 0.00 0.04 0.05 0.20 0.00 0.00 0.00 175.10 175.39 2jap s ASN 148 N 0.19 5.50 0.28 3.32 0.01 -1.26 -4.32 114.94 118.65 2jap s ASN 148 Ca -0.02 0.03 0.08 0.00 -0.71 0.00 0.00 52.86 52.25 2jap s ASN 148 Cb -0.03 -1.94 -0.06 0.00 0.41 0.00 0.00 41.25 39.63 2jap s ASN 148 CO -0.01 0.15 -0.10 0.68 -1.51 0.00 0.00 177.10 176.32 2jap s VAL 149 N 0.49 1.86 0.62 1.60 -7.23 -1.26 -5.14 120.40 111.34 2jap s VAL 149 Ca 0.02 -2.19 -0.19 0.00 -1.81 0.00 0.00 61.98 57.82 2jap s VAL 149 Cb -0.13 -2.39 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 2jap s VAL 149 CO 0.01 -0.35 1.29 -0.13 -0.31 0.00 0.00 175.10 175.60 2jap s ARG 150 N -3.67 2.75 -1.18 4.82 0.52 -1.26 -3.46 118.95 117.48 2jap s ARG 150 Ca 0.29 2.04 0.00 0.00 -0.52 0.00 0.00 55.73 57.54 2jap s ARG 150 Cb 0.02 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.55 2jap s ARG 150 CO 0.12 -1.43 0.00 0.09 0.02 0.00 0.00 175.30 174.10 2jap n ASN 151 N -1.68 -4.30 -1.22 0.23 3.02 -1.26 -4.87 115.26 105.19 2jap n ASN 151 Ca 0.14 0.25 0.04 0.00 -0.03 0.00 0.00 54.58 54.98 2jap n ASN 151 Cb 0.48 -2.88 0.04 0.00 -0.61 0.00 0.00 39.78 36.81 2jap n ASN 151 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jap n ALA 152 N 0.91 2.47 0.05 5.41 0.00 -1.22 -0.85 120.51 127.27 2jap n ALA 152 Ca -0.12 -2.29 -0.12 0.00 0.00 0.00 0.00 53.44 50.92 2jap n ALA 152 Cb 0.40 -0.65 -0.05 0.00 0.00 0.00 0.00 19.45 19.15 2jap n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jap h ALA 153 N 0.84 -0.45 -0.05 0.00 0.00 -1.82 0.20 119.26 117.98 2jap h ALA 153 Ca -0.17 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.50 2jap h ALA 153 Cb 1.70 0.58 0.01 0.00 0.00 0.00 0.00 17.79 20.08 2jap h ALA 153 CO 0.07 -0.83 -0.91 0.28 0.00 0.00 0.00 179.25 177.86 2jap h VAL 154 N -0.46 1.33 0.03 0.00 2.07 -1.92 -0.23 116.25 117.07 2jap h VAL 154 Ca 0.07 -2.23 0.01 0.00 0.82 0.00 0.00 66.70 65.37 2jap h VAL 154 Cb 0.56 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 2jap h VAL 154 CO -0.29 0.68 -0.07 0.22 0.02 0.00 0.00 177.57 178.13 2jap h TYR 155 N 0.36 -0.18 -0.99 1.57 3.20 -1.81 -1.21 116.97 117.91 2jap h TYR 155 Ca -0.08 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.82 2jap h TYR 155 Cb 1.54 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 39.83 2jap h TYR 155 CO 0.08 -0.11 0.65 1.96 -1.64 0.00 0.00 178.16 179.10 2jap h GLN 156 N -0.14 1.25 -0.44 1.82 4.20 -0.55 -1.76 115.11 119.48 2jap h GLN 156 Ca 0.02 -0.08 0.06 0.00 0.06 0.00 0.00 58.65 58.72 2jap h GLN 156 Cb 0.16 -0.28 -0.06 0.00 0.30 0.00 0.00 27.48 27.60 2jap h GLN 156 CO -0.06 0.83 0.12 0.00 -0.67 0.00 0.00 178.83 179.05 2jap h ALA 157 N 1.41 0.51 -0.68 3.87 0.00 -0.61 0.78 119.26 124.53 2jap h ALA 157 Ca 0.38 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.30 2jap h ALA 157 Cb -0.06 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2jap h ALA 157 CO -0.10 -0.28 0.19 1.79 0.00 0.00 0.00 179.25 180.85 2jap h THR 158 N 0.27 1.25 -0.02 0.00 1.35 -0.54 -0.32 112.91 114.91 2jap h THR 158 Ca 0.21 -0.90 -0.20 0.00 -0.55 0.00 0.00 66.41 64.97 2jap h THR 158 Cb 0.24 0.52 0.02 0.00 -1.73 0.00 0.00 68.15 67.20 2jap h THR 158 CO -0.25 0.35 -0.78 0.11 -0.25 0.00 0.00 175.52 174.69 2jap h LYS 159 N 1.02 0.57 -1.00 4.72 1.79 -0.98 0.15 116.57 122.83 2jap h LYS 159 Ca 0.22 -0.58 0.04 0.00 -2.18 0.00 0.00 60.65 58.14 2jap h LYS 159 Cb 0.32 0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 31.07 2jap h LYS 159 CO -0.00 1.20 0.65 0.74 -1.08 0.00 0.00 179.45 180.96 2jap h PHE 160 N 0.16 1.22 -0.36 -1.35 -1.00 -0.86 -2.09 116.94 112.66 2jap h PHE 160 Ca -0.09 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.72 2jap h PHE 160 Cb 1.46 -0.41 -0.02 0.00 3.61 0.00 0.00 35.95 40.60 2jap h PHE 160 CO 0.12 0.70 0.22 0.78 -1.61 0.00 0.00 178.31 178.53 2jap h GLY 161 N 1.26 0.52 0.62 -1.45 0.00 -0.85 -1.99 103.07 101.17 2jap h GLY 161 Ca 0.40 -0.21 0.08 0.00 0.00 0.00 0.00 47.33 47.60 2jap h GLY 161 CO -0.13 0.20 0.47 -2.08 0.00 0.00 0.00 176.54 175.01 2jap h VAL 162 N 0.48 0.96 -0.48 4.60 2.07 -0.45 -0.44 116.25 122.99 2jap h VAL 162 Ca 0.13 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 2jap h VAL 162 Cb -0.02 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 2jap h VAL 162 CO -0.03 0.15 0.11 0.78 0.02 0.00 0.00 177.57 178.61 2jap h ASN 163 N 0.83 0.73 -0.06 0.57 4.21 -1.06 -0.44 115.58 120.37 2jap h ASN 163 Ca 0.37 -0.23 -0.01 0.00 1.21 0.00 0.00 56.30 57.63 2jap h ASN 163 Cb 0.26 -0.19 -0.00 0.00 -1.12 0.00 0.00 38.32 37.27 2jap h ASN 163 CO -0.21 0.77 -0.01 0.00 -1.29 0.00 0.00 177.43 176.69 2jap h ALA 164 N 0.98 0.08 -0.65 -0.83 0.00 -1.15 -0.30 119.26 117.39 2jap h ALA 164 Ca 0.15 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.99 2jap h ALA 164 Cb 0.33 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.00 2jap h ALA 164 CO 0.00 -0.21 0.10 0.35 0.00 0.00 0.00 179.25 179.49 2jap h PHE 165 N -0.22 0.13 -0.15 0.00 3.57 -1.04 -1.18 116.94 118.05 2jap h PHE 165 Ca 0.02 0.04 -0.22 0.00 3.53 0.00 0.00 57.97 61.34 2jap h PHE 165 Cb 0.40 0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.19 2jap h PHE 165 CO 0.05 -0.10 -0.76 0.77 -2.23 0.00 0.00 178.31 176.04 2jap h SER 166 N 0.21 0.93 -0.65 0.41 0.02 -0.86 0.17 113.55 113.77 2jap h SER 166 Ca 0.35 -0.63 0.01 0.00 -0.84 0.00 0.00 61.79 60.68 2jap h SER 166 Cb 0.57 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 2jap h SER 166 CO -0.49 1.41 0.42 -0.08 -1.14 0.00 0.00 176.83 176.96 2jap h GLU 167 N 0.51 0.83 -0.35 3.45 4.57 -0.94 0.50 114.58 123.15 2jap h GLU 167 Ca -0.05 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 2jap h GLU 167 Cb 1.39 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.78 2jap h GLU 167 CO 0.16 0.55 0.17 1.15 -1.18 0.00 0.00 179.01 179.86 2jap h THR 168 N 0.86 1.16 -0.45 0.32 2.02 -1.09 -1.84 112.91 113.90 2jap h THR 168 Ca 0.24 -0.46 0.07 0.00 0.77 0.00 0.00 66.41 67.03 2jap h THR 168 Cb -0.07 0.83 -0.06 0.00 -1.74 0.00 0.00 68.15 67.11 2jap h THR 168 CO -0.07 0.17 0.11 0.25 0.37 0.00 0.00 175.52 176.36 2jap h LEU 169 N 0.43 0.06 -0.37 2.58 5.85 -0.75 -1.78 115.31 121.34 2jap h LEU 169 Ca 0.12 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.99 2jap h LEU 169 Cb 0.12 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.15 2jap h LEU 169 CO -0.02 0.07 -0.14 -0.09 -0.34 0.00 0.00 178.44 177.92 2jap h ARG 170 N 0.26 -0.07 -0.94 1.25 2.43 -0.56 -0.60 114.38 116.15 2jap h ARG 170 Ca 0.22 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.49 2jap h ARG 170 Cb 0.25 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.75 2jap h ARG 170 CO -0.26 -0.04 0.60 1.96 -1.51 0.00 0.00 179.97 180.72 2jap h GLN 171 N -0.07 0.91 -0.00 0.20 4.20 -0.72 0.17 115.11 119.79 2jap h GLN 171 Ca 0.18 -0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.63 2jap h GLN 171 Cb 0.35 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 2jap h GLN 171 CO -0.42 0.60 -0.89 0.93 -0.67 0.00 0.00 178.83 178.38 2jap h GLU 172 N 0.94 0.28 0.00 1.46 5.08 -0.36 -3.39 114.58 118.59 2jap h GLU 172 Ca 0.44 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2jap h GLU 172 Cb 0.43 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2jap h GLU 172 CO -0.21 1.00 -0.31 1.33 -1.00 0.00 0.00 179.01 179.83 2jap n VAL 173 N -3.70 0.00 -0.16 3.13 0.24 -0.37 -4.77 118.33 112.71 2jap n VAL 173 Ca -0.05 -0.36 0.03 0.00 -2.04 0.00 0.00 64.34 61.92 2jap n VAL 173 Cb 0.81 0.86 0.32 0.00 -1.47 0.00 0.00 33.84 34.36 2jap n VAL 173 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jap h THR 174 N 0.00 1.13 0.00 3.34 1.03 -1.07 -1.49 112.91 115.85 2jap h THR 174 Ca 0.00 -0.29 0.00 0.00 -0.01 0.00 0.00 66.41 66.11 2jap h THR 174 Cb 0.03 0.21 0.00 0.00 -1.07 0.00 0.00 68.15 67.32 2jap h THR 174 CO 0.00 0.15 0.00 -0.33 -0.01 0.00 0.00 175.52 175.33 2jap h GLU 175 N 0.84 0.00 -0.53 0.00 5.08 -1.85 -1.01 114.58 117.12 2jap h GLU 175 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2jap h GLU 175 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2jap h GLU 175 CO -0.06 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.49 2jap n ARG 176 N -2.95 2.23 -0.80 2.33 1.74 -0.57 -4.95 116.66 113.69 2jap n ARG 176 Ca 0.01 -1.91 0.00 0.00 -0.77 0.00 0.00 57.85 55.17 2jap n ARG 176 Cb 0.28 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 2jap n ARG 176 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jap n GLY 177 N 1.35 0.58 3.60 -0.13 0.00 -0.38 -4.79 105.19 105.41 2jap n GLY 177 Ca 0.18 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 2jap n GLY 177 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jap s VAL 178 N -2.00 4.96 0.00 1.61 1.01 -1.16 -4.00 120.40 120.82 2jap s VAL 178 Ca 0.00 0.80 -0.21 0.00 0.00 0.00 0.00 61.98 62.57 2jap s VAL 178 Cb 0.00 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 2jap s VAL 178 CO 0.00 -0.12 0.60 -0.13 0.00 0.00 0.00 175.10 175.45 2jap s ARG 179 N 2.55 4.32 -0.25 2.72 0.52 -0.33 -3.87 118.95 124.60 2jap s ARG 179 Ca 0.24 0.75 -0.02 0.00 -0.52 0.00 0.00 55.73 56.18 2jap s ARG 179 Cb -0.15 -3.34 0.02 0.00 0.52 0.00 0.00 34.95 32.01 2jap s ARG 179 CO 0.12 0.37 -0.05 0.08 0.02 0.00 0.00 175.30 175.85 2jap s VAL 180 N -0.22 2.99 -0.12 3.52 1.01 -1.26 -0.76 120.40 125.56 2jap s VAL 180 Ca 0.31 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.31 2jap s VAL 180 Cb -0.18 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2jap s VAL 180 CO 0.18 0.18 -0.15 -0.69 0.00 0.00 0.00 175.10 174.62 2jap s VAL 181 N 1.34 2.89 -0.18 2.92 1.01 -0.14 -4.26 120.40 123.98 2jap s VAL 181 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2jap s VAL 181 Cb -0.17 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.04 2jap s VAL 181 CO -0.04 0.54 -0.19 -0.69 0.00 0.00 0.00 175.10 174.72 2jap s VAL 182 N 0.24 2.01 -0.19 2.92 1.01 0.93 -0.06 120.40 127.26 2jap s VAL 182 Ca -0.10 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 60.85 2jap s VAL 182 Cb -0.16 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.34 2jap s VAL 182 CO 0.06 0.50 0.10 -0.63 0.00 0.00 0.00 175.10 175.13 2jap s ILE 183 N 1.30 5.14 -0.57 2.22 -1.09 -0.21 -1.63 121.20 126.36 2jap s ILE 183 Ca 0.04 0.09 0.04 0.00 -2.23 0.00 0.00 60.65 58.59 2jap s ILE 183 Cb -0.13 -3.34 0.15 0.00 -1.58 0.00 0.00 42.46 37.56 2jap s ILE 183 CO -0.12 0.45 0.35 -1.61 -1.23 0.00 0.00 174.94 172.78 2jap s GLU 184 N 0.39 1.94 0.38 2.79 2.02 0.67 -0.08 118.70 126.80 2jap s GLU 184 Ca 0.06 -2.74 -0.24 0.00 0.02 0.00 0.00 54.97 52.06 2jap s GLU 184 Cb -0.12 -3.01 -0.09 0.00 0.10 0.00 0.00 34.13 31.01 2jap s GLU 184 CO -0.01 -1.21 1.01 -2.14 0.02 0.00 0.00 175.26 172.93 2jap s PRO 185 N -0.59 4.29 0.00 0.39 0.02 -1.26 -1.42 135.00 136.43 2jap s PRO 185 Ca 0.21 1.42 0.00 0.00 0.02 0.00 0.00 61.00 62.65 2jap s PRO 185 Cb -0.15 -2.58 0.00 0.00 0.02 0.00 0.00 34.50 31.80 2jap s PRO 185 CO -0.08 -0.01 0.00 0.41 -0.33 0.00 0.00 177.00 176.99 2jap n GLY 186 N 0.29 -0.52 3.65 0.52 0.00 0.10 -0.83 105.19 108.40 2jap n GLY 186 Ca 0.04 -1.70 -0.54 0.00 0.00 0.00 0.00 46.02 43.83 2jap n GLY 186 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jap n THR 187 N -0.64 0.36 -4.90 2.61 -1.04 -1.26 -4.86 114.28 104.55 2jap n THR 187 Ca 0.00 -0.11 -0.27 0.00 -2.04 0.00 0.00 64.05 61.64 2jap n THR 187 Cb 0.00 -1.48 -0.16 0.00 -1.82 0.00 0.00 70.33 66.87 2jap n THR 187 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2jap s THR 188 N 4.46 1.52 -1.02 12.58 2.01 -1.26 -0.87 115.64 133.07 2jap s THR 188 Ca 0.99 -0.77 -0.23 0.00 0.31 0.00 0.00 61.69 61.99 2jap s THR 188 Cb -0.93 -1.30 0.02 0.00 0.01 0.00 0.00 72.50 70.30 2jap s THR 188 CO 0.59 0.44 1.61 -0.62 -0.69 0.00 0.00 174.62 175.94 2jap s ASP 189 N -0.03 6.15 0.21 3.53 -1.08 -0.28 -4.90 116.67 120.26 2jap s ASP 189 Ca -0.03 -1.34 0.02 0.00 -0.52 0.00 0.00 52.55 50.68 2jap s ASP 189 Cb -0.11 -2.57 -0.01 0.00 -1.46 0.00 0.00 42.92 38.77 2jap s ASP 189 CO 0.02 -1.84 0.07 0.35 0.52 0.00 0.00 175.17 174.29 2jap n THR 190 N 7.13 0.00 0.63 1.71 -2.24 -1.26 -4.56 114.28 115.68 2jap n THR 190 Ca 0.36 -1.21 0.12 0.00 -2.27 0.00 0.00 64.05 61.06 2jap n THR 190 Cb 0.49 0.42 0.46 0.00 -2.10 0.00 0.00 70.33 69.60 2jap n THR 190 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jap n GLU 191 N -0.48 0.18 -0.37 -0.78 1.02 -1.26 -4.41 120.64 114.54 2jap n GLU 191 Ca -0.03 0.23 0.04 0.00 -0.02 0.00 0.00 57.16 57.38 2jap n GLU 191 Cb 0.31 -1.74 0.11 0.00 -0.02 0.00 0.00 31.44 30.11 2jap n GLU 191 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2jap n LEU 192 N -2.05 -0.44 0.26 -4.62 7.94 -1.26 -1.03 117.00 115.80 2jap n LEU 192 Ca 0.05 1.72 0.15 0.00 -1.11 0.00 0.00 56.01 56.82 2jap n LEU 192 Cb 0.34 -0.49 0.58 0.00 0.53 0.00 0.00 43.42 44.39 2jap n LEU 192 CO 0.26 -1.63 0.93 0.08 -1.11 0.00 0.00 177.39 175.92 2jap h ARG 193 N 0.00 0.00 0.00 1.96 0.11 -1.88 -2.98 114.38 111.59 2jap h ARG 193 Ca 0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.52 2jap h ARG 193 Cb 0.69 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.77 2jap h ARG 193 CO -1.02 0.06 0.00 0.78 0.10 0.00 0.00 179.97 179.89 2jap h GLY 194 N 2.23 0.00 1.01 0.08 0.00 -1.39 -2.82 103.07 102.18 2jap h GLY 194 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jap h GLY 194 CO 0.01 0.00 -0.92 0.45 0.00 0.00 0.00 176.54 176.08 2jap h HIS 195 N 0.00 0.00 -1.44 5.60 3.86 -1.67 -3.47 115.15 118.02 2jap h HIS 195 Ca 0.00 0.00 -0.75 0.00 -1.16 0.00 0.00 60.37 58.46 2jap h HIS 195 Cb 0.08 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.58 2jap h HIS 195 CO 0.00 0.00 0.63 -0.89 0.86 0.00 0.00 177.93 178.53 2jap n ILE 196 N -2.53 0.13 0.03 2.45 5.41 -1.07 -4.88 119.36 118.90 2jap n ILE 196 Ca 0.01 -0.02 -0.03 0.00 1.00 0.00 0.00 62.75 63.70 2jap n ILE 196 Cb 0.52 -0.85 -0.09 0.00 -0.71 0.00 0.00 39.64 38.51 2jap n ILE 196 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2jap h THR 197 N 4.34 0.77 -3.17 1.39 1.35 -1.90 -3.44 112.91 112.26 2jap h THR 197 Ca -0.47 -2.38 -0.56 0.00 -0.55 0.00 0.00 66.41 62.45 2jap h THR 197 Cb 1.34 2.28 -0.08 0.00 -1.73 0.00 0.00 68.15 69.96 2jap h THR 197 CO 0.87 0.44 0.96 -2.28 -0.25 0.00 0.00 175.52 175.26 2jap s HIS 198 N -2.81 2.61 0.12 4.73 5.65 -1.25 -4.92 115.29 119.42 2jap s HIS 198 Ca -0.02 0.38 -0.20 0.00 0.25 0.00 0.00 55.06 55.46 2jap s HIS 198 Cb 0.08 -4.50 -0.04 0.00 -1.18 0.00 0.00 32.58 26.94 2jap s HIS 198 CO 0.81 -1.59 1.71 1.15 -0.65 0.00 0.00 174.74 176.17 2jap h THR 199 N 6.15 0.84 -0.93 0.89 2.02 -1.92 0.04 112.91 120.00 2jap h THR 199 Ca -0.25 -0.01 0.01 0.00 0.77 0.00 0.00 66.41 66.94 2jap h THR 199 Cb 1.06 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 68.24 2jap h THR 199 CO 1.19 0.00 0.62 0.00 0.37 0.00 0.00 175.52 177.70 2jap h ALA 200 N 1.17 1.19 -0.14 6.16 0.00 -1.98 -1.76 119.26 123.89 2jap h ALA 200 Ca 0.08 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 2jap h ALA 200 Cb 0.12 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.55 2jap h ALA 200 CO -0.17 0.56 -0.64 1.15 0.00 0.00 0.00 179.25 180.16 2jap h THR 201 N 1.25 1.31 -0.64 0.00 2.02 -1.80 -1.38 112.91 113.68 2jap h THR 201 Ca 0.35 -1.88 0.12 0.00 0.77 0.00 0.00 66.41 65.77 2jap h THR 201 Cb -0.12 2.04 -0.09 0.00 -1.74 0.00 0.00 68.15 68.24 2jap h THR 201 CO -0.08 0.59 0.15 0.50 0.37 0.00 0.00 175.52 177.05 2jap h LYS 202 N 0.37 0.27 -0.41 6.66 3.64 -0.81 0.20 116.57 126.50 2jap h LYS 202 Ca -0.04 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.19 2jap h LYS 202 Cb 1.27 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 2jap h LYS 202 CO 0.13 0.18 -0.26 1.49 -2.27 0.00 0.00 179.45 178.72 2jap h GLU 203 N 0.28 0.90 -0.57 1.90 4.57 -1.25 -1.80 114.58 118.60 2jap h GLU 203 Ca 0.34 -0.42 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2jap h GLU 203 Cb 0.53 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.08 2jap h GLU 203 CO -0.43 1.07 0.32 0.52 -1.18 0.00 0.00 179.01 179.31 2jap h MET 204 N 0.72 0.80 -0.46 1.92 2.86 -0.69 -2.18 114.93 117.90 2jap h MET 204 Ca 0.08 -0.09 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2jap h MET 204 Cb 0.84 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 2jap h MET 204 CO 0.07 0.61 0.13 -0.92 1.06 0.00 0.00 176.91 177.86 2jap h TYR 205 N 0.77 0.77 -0.63 -0.22 3.20 -0.58 -1.71 116.97 118.57 2jap h TYR 205 Ca 0.20 -0.09 0.01 0.00 3.14 0.00 0.00 58.73 62.00 2jap h TYR 205 Cb 0.04 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.06 2jap h TYR 205 CO -0.01 0.69 0.41 1.49 -1.64 0.00 0.00 178.16 179.10 2jap h GLU 206 N 0.62 0.80 -0.61 1.82 4.57 -1.16 -1.84 114.58 118.78 2jap h GLU 206 Ca 0.15 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.24 2jap h GLU 206 Cb 0.30 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 2jap h GLU 206 CO -0.00 0.53 0.25 1.96 -1.18 0.00 0.00 179.01 180.56 2jap h GLN 207 N 0.82 0.91 -0.69 1.92 1.08 -1.33 -2.15 115.11 115.67 2jap h GLN 207 Ca 0.24 -0.16 0.06 0.00 -1.45 0.00 0.00 58.65 57.34 2jap h GLN 207 Cb -0.06 -0.15 -0.06 0.00 -0.05 0.00 0.00 27.48 27.17 2jap h GLN 207 CO -0.07 0.77 0.39 -0.09 -0.95 0.00 0.00 178.83 178.88 2jap h ARG 208 N 0.85 0.69 -0.23 1.46 2.43 -0.66 -2.77 114.38 116.15 2jap h ARG 208 Ca 0.20 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2jap h ARG 208 Cb 0.20 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 2jap h ARG 208 CO -0.02 0.46 0.00 0.44 -1.51 0.00 0.00 179.97 179.34 2jap n ILE 209 N -4.77 0.29 0.21 1.20 -5.35 -0.75 -4.36 119.36 105.83 2jap n ILE 209 Ca 0.09 -0.54 0.08 0.00 -0.27 0.00 0.00 62.75 62.10 2jap n ILE 209 Cb 0.18 0.83 0.44 0.00 -1.74 0.00 0.00 39.64 39.34 2jap n ILE 209 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2jap h SER 210 N 3.63 0.00 -0.43 7.28 4.64 -1.08 -3.27 113.55 124.32 2jap h SER 210 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2jap h SER 210 Cb 0.79 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.83 2jap h SER 210 CO 0.00 0.29 0.06 0.00 -0.87 0.00 0.00 176.83 176.31 2jap n GLN 211 N -3.55 3.06 -4.34 4.77 6.02 -1.26 -4.95 117.38 117.13 2jap n GLN 211 Ca -0.01 -3.00 -0.24 0.00 -0.01 0.00 0.00 57.00 53.75 2jap n GLN 211 Cb 0.43 -1.97 -0.12 0.00 1.02 0.00 0.00 30.24 29.61 2jap n GLN 211 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 2jap s ILE 212 N -2.95 1.93 -0.29 5.09 -4.36 -1.24 -5.04 121.20 114.34 2jap s ILE 212 Ca 0.47 -1.83 -0.29 0.00 -0.26 0.00 0.00 60.65 58.74 2jap s ILE 212 Cb 0.39 -1.84 -0.01 0.00 1.25 0.00 0.00 42.46 42.25 2jap s ILE 212 CO 0.09 -0.18 1.50 -0.13 0.24 0.00 0.00 174.94 176.45 2jap s ARG 213 N -2.49 3.76 0.56 0.37 0.52 -1.26 -5.01 118.95 115.38 2jap s ARG 213 Ca 0.14 1.39 -0.17 0.00 -0.52 0.00 0.00 55.73 56.58 2jap s ARG 213 Cb -0.08 -4.00 -0.06 0.00 0.52 0.00 0.00 34.95 31.34 2jap s ARG 213 CO 0.07 -1.33 1.03 0.15 0.02 0.00 0.00 175.30 175.24 2jap s LYS 214 N 4.64 3.57 0.66 3.54 1.02 -1.26 -4.69 119.74 127.21 2jap s LYS 214 Ca 0.66 1.16 -0.17 0.00 0.02 0.00 0.00 55.97 57.63 2jap s LYS 214 Cb -0.20 -2.07 -0.00 0.00 -0.52 0.00 0.00 37.83 35.03 2jap s LYS 214 CO 0.28 -0.60 1.25 -0.51 -0.92 0.00 0.00 175.35 174.85 2jap s LEU 215 N -4.23 3.53 0.08 3.17 1.43 -0.05 -4.81 118.68 117.80 2jap s LEU 215 Ca 0.63 2.51 0.02 0.00 -1.03 0.00 0.00 54.13 56.25 2jap s LEU 215 Cb -0.14 -4.61 -0.04 0.00 0.03 0.00 0.00 46.19 41.43 2jap s LEU 215 CO 0.33 -1.99 0.16 -1.10 0.23 0.00 0.00 176.35 173.98 2jap s GLN 216 N -3.50 3.19 0.40 1.70 -1.52 -1.26 -1.13 119.66 117.55 2jap s GLN 216 Ca 0.79 -0.58 0.15 0.00 -1.95 0.00 0.00 55.36 53.78 2jap s GLN 216 Cb -0.34 -2.89 1.01 0.00 -0.22 0.00 0.00 33.01 30.57 2jap s GLN 216 CO 0.40 0.58 1.87 0.00 -0.25 0.00 0.00 175.29 177.89 2jap h ALA 217 N 3.04 2.08 -0.24 6.09 0.00 -1.90 -0.34 119.26 128.00 2jap h ALA 217 Ca -0.46 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 2jap h ALA 217 Cb 1.17 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2jap h ALA 217 CO 0.71 -0.34 -0.18 -0.56 0.00 0.00 0.00 179.25 178.88 2jap h GLN 218 N 0.48 0.41 -0.63 0.00 -0.00 -1.92 -1.49 115.11 111.97 2jap h GLN 218 Ca 0.44 -0.13 -0.00 0.00 -0.00 0.00 0.00 58.65 58.96 2jap h GLN 218 Cb 0.98 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.48 28.39 2jap h GLN 218 CO -0.17 0.58 0.38 -0.44 -0.00 0.00 0.00 178.83 179.18 2jap h ASP 219 N 0.38 0.76 -0.33 0.06 3.32 -1.46 -1.27 116.42 117.87 2jap h ASP 219 Ca 0.07 -0.06 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 2jap h ASP 219 Cb 0.54 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 2jap h ASP 219 CO 0.04 0.60 -0.37 0.40 -1.72 0.00 0.00 179.24 178.18 2jap h ILE 220 N 0.85 1.28 -0.78 0.35 1.08 -1.22 -2.15 117.51 116.91 2jap h ILE 220 Ca 0.22 -1.54 0.03 0.00 -0.39 0.00 0.00 64.86 63.19 2jap h ILE 220 Cb -0.02 1.38 -0.04 0.00 -3.07 0.00 0.00 36.82 35.07 2jap h ILE 220 CO -0.04 0.51 0.51 0.00 -0.69 0.00 0.00 178.15 178.45 2jap h ALA 221 N 0.85 1.52 -0.26 1.87 0.00 -1.11 -1.62 119.26 120.50 2jap h ALA 221 Ca 0.06 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2jap h ALA 221 Cb 0.94 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2jap h ALA 221 CO 0.09 0.41 -0.26 0.93 0.00 0.00 0.00 179.25 180.42 2jap h GLU 222 N 0.97 0.51 -0.28 0.00 4.39 -0.82 -0.27 114.58 119.09 2jap h GLU 222 Ca 0.31 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2jap h GLU 222 Cb 0.02 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2jap h GLU 222 CO -0.09 0.73 0.06 0.00 -1.16 0.00 0.00 179.01 178.55 2jap h ALA 223 N 1.28 0.37 -0.32 3.43 0.00 -0.73 -0.16 119.26 123.12 2jap h ALA 223 Ca 0.06 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2jap h ALA 223 Cb 0.69 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2jap h ALA 223 CO 0.05 0.03 0.16 0.28 0.00 0.00 0.00 179.25 179.77 2jap h VAL 224 N 0.28 0.98 -0.38 0.00 2.07 -1.16 -1.70 116.25 116.33 2jap h VAL 224 Ca 0.09 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.51 2jap h VAL 224 Cb 0.30 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2jap h VAL 224 CO 0.00 0.06 0.22 -0.09 0.02 0.00 0.00 177.57 177.79 2jap h ARG 225 N 0.33 0.44 -0.47 1.57 2.43 -0.87 -0.49 114.38 117.32 2jap h ARG 225 Ca 0.14 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.32 2jap h ARG 225 Cb 0.05 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 2jap h ARG 225 CO -0.10 0.29 0.22 -0.92 -1.51 0.00 0.00 179.97 177.96 2jap h TYR 226 N 0.46 0.40 -0.43 2.20 3.20 -0.87 -1.98 116.97 119.95 2jap h TYR 226 Ca 0.15 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 2jap h TYR 226 Cb -0.00 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 2jap h TYR 226 CO -0.07 0.19 -0.00 0.00 -1.64 0.00 0.00 178.16 176.64 2jap h ALA 227 N 1.26 0.57 0.00 1.82 0.00 -0.79 -2.57 119.26 119.55 2jap h ALA 227 Ca 0.21 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2jap h ALA 227 Cb 0.13 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2jap h ALA 227 CO -0.16 0.36 -0.05 -0.39 0.00 0.00 0.00 179.25 179.01 2jap h VAL 228 N 0.59 0.08 -0.01 0.00 -1.51 -1.03 -3.17 116.25 111.20 2jap h VAL 228 Ca 0.12 -1.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.47 2jap h VAL 228 Cb 0.49 2.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.69 2jap h VAL 228 CO 0.02 0.05 -0.34 0.35 -1.23 0.00 0.00 177.57 176.42 2jap n THR 229 N -3.11 0.00 -1.69 7.19 -2.24 -0.75 -4.92 114.28 108.76 2jap n THR 229 Ca 0.04 -0.20 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 2jap n THR 229 Cb 0.55 0.79 0.06 0.00 -2.10 0.00 0.00 70.33 69.62 2jap n THR 229 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jap n ALA 230 N -0.31 0.90 -1.66 6.98 0.00 -0.98 -4.94 120.51 120.51 2jap n ALA 230 Ca 0.11 0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.23 2jap n ALA 230 Cb 0.40 -2.26 0.06 0.00 0.00 0.00 0.00 19.45 17.66 2jap n ALA 230 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jap s PRO 231 N -3.02 2.58 0.48 0.00 0.04 -1.26 -4.86 135.00 128.95 2jap s PRO 231 Ca 0.77 1.94 0.18 0.00 0.04 0.00 0.00 61.00 63.93 2jap s PRO 231 Cb -0.41 -1.86 1.18 0.00 0.04 0.00 0.00 34.50 33.45 2jap s PRO 231 CO 0.45 -1.54 2.01 1.25 0.04 0.00 0.00 177.00 179.20 2jap h HIS 232 N 0.46 0.24 0.00 0.56 2.76 -1.95 0.21 115.15 117.43 2jap h HIS 232 Ca -0.50 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.68 2jap h HIS 232 Cb 1.32 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 30.20 2jap h HIS 232 CO 0.44 0.11 0.00 -2.39 -1.30 0.00 0.00 177.93 174.79 2jap n HIS 233 N -4.45 0.00 -4.18 5.26 1.44 -1.26 -4.58 115.22 107.45 2jap n HIS 233 Ca 0.08 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.45 2jap n HIS 233 Cb 0.41 -0.42 -0.13 0.00 0.12 0.00 0.00 29.99 29.97 2jap n HIS 233 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2jap s ALA 234 N -2.84 2.87 -0.34 1.59 0.00 0.06 -5.08 121.76 118.02 2jap s ALA 234 Ca 0.10 -1.02 -0.06 0.00 0.00 0.00 0.00 51.96 50.98 2jap s ALA 234 Cb 0.10 -1.62 0.04 0.00 0.00 0.00 0.00 23.12 21.65 2jap s ALA 234 CO 0.26 -0.14 0.10 0.99 0.00 0.00 0.00 175.76 176.97 2jap s THR 235 N 0.99 3.72 -1.08 0.00 2.01 -1.26 -4.68 115.64 115.33 2jap s THR 235 Ca 0.00 -1.16 -0.22 0.00 0.31 0.00 0.00 61.69 60.62 2jap s THR 235 Cb -0.15 -3.11 0.05 0.00 0.01 0.00 0.00 72.50 69.30 2jap s THR 235 CO 0.01 -0.18 1.53 -0.69 -0.69 0.00 0.00 174.62 174.60 2jap s VAL 236 N 1.39 3.95 0.24 3.82 1.01 -1.26 -4.82 120.40 124.73 2jap s VAL 236 Ca -0.02 -1.02 0.07 0.00 0.00 0.00 0.00 61.98 61.01 2jap s VAL 236 Cb -0.20 -5.07 -0.06 0.00 0.00 0.00 0.00 36.38 31.05 2jap s VAL 236 CO 0.02 -1.93 1.54 -0.74 0.00 0.00 0.00 175.10 173.99 2jap h HIS 237 N 9.31 0.13 -3.48 5.22 2.76 -1.92 -3.37 115.15 123.80 2jap h HIS 237 Ca 0.26 -0.06 -0.28 0.00 -2.20 0.00 0.00 60.37 58.08 2jap h HIS 237 Cb 0.98 -0.02 -0.33 0.00 1.55 0.00 0.00 27.41 29.58 2jap h HIS 237 CO 1.31 0.74 -0.70 -1.21 -1.30 0.00 0.00 177.93 176.78 2jap s GLU 238 N -3.54 -0.01 -0.16 5.26 2.02 -1.26 -0.05 118.70 120.96 2jap s GLU 238 Ca -0.02 0.21 0.01 0.00 0.02 0.00 0.00 54.97 55.19 2jap s GLU 238 Cb 0.12 -0.22 0.03 0.00 0.10 0.00 0.00 34.13 34.16 2jap s GLU 238 CO 0.79 -0.16 -0.13 0.42 0.02 0.00 0.00 175.26 176.20 2jap s ILE 239 N 1.01 1.62 -0.39 -1.63 1.01 -0.65 -4.98 121.20 117.19 2jap s ILE 239 Ca -0.08 -0.76 -0.07 0.00 0.00 0.00 0.00 60.65 59.74 2jap s ILE 239 Cb -0.12 -1.57 0.08 0.00 0.01 0.00 0.00 42.46 40.86 2jap s ILE 239 CO -0.03 0.38 0.20 0.12 0.00 0.00 0.00 174.94 175.61 2jap s PHE 240 N 1.45 3.36 -0.20 3.97 5.36 -1.26 -0.24 117.98 130.42 2jap s PHE 240 Ca 0.03 -1.71 -0.03 0.00 -0.96 0.00 0.00 56.93 54.26 2jap s PHE 240 Cb -0.14 -2.82 -0.01 0.00 -0.34 0.00 0.00 43.02 39.71 2jap s PHE 240 CO -0.10 -0.85 -0.06 0.42 -1.46 0.00 0.00 175.22 173.18 2jap s ILE 241 N 1.35 3.36 0.10 3.12 1.01 -0.50 -5.01 121.20 124.63 2jap s ILE 241 Ca 0.02 -0.51 0.08 0.00 0.00 0.00 0.00 60.65 60.24 2jap s ILE 241 Cb -0.22 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.70 2jap s ILE 241 CO 0.01 0.44 -0.14 -0.13 0.00 0.00 0.00 174.94 175.13 2jap s ARG 242 N 1.24 1.99 0.13 2.79 0.52 -1.26 0.00 118.95 124.36 2jap s ARG 242 Ca 0.03 -1.08 -0.31 0.00 -0.52 0.00 0.00 55.73 53.85 2jap s ARG 242 Cb -0.14 -2.23 -0.09 0.00 0.52 0.00 0.00 34.95 33.01 2jap s ARG 242 CO -0.02 0.50 1.50 -2.14 0.02 0.00 0.00 175.30 175.16 2jap s PRO 243 N -2.13 4.26 0.53 3.54 0.02 -1.26 -4.89 135.00 135.07 2jap s PRO 243 Ca 0.20 2.23 0.21 0.00 0.02 0.00 0.00 61.00 63.65 2jap s PRO 243 Cb -0.11 -3.24 1.38 0.00 0.02 0.00 0.00 34.50 32.54 2jap s PRO 243 CO 0.12 -0.55 2.10 1.15 -0.33 0.00 0.00 177.00 179.49 2jap h THR 244 N 4.21 0.84 0.00 0.99 2.02 -1.99 -2.21 112.91 116.77 2jap h THR 244 Ca -0.42 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.76 2jap h THR 244 Cb 1.21 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 2jap h THR 244 CO 0.90 0.00 0.00 0.47 0.37 0.00 0.00 175.52 177.26 2jap n ASP 245 N -4.38 0.00 -4.35 4.18 8.00 -1.26 -4.78 116.55 113.95 2jap n ASP 245 Ca 0.02 0.47 -0.38 0.00 0.71 0.00 0.00 54.79 55.60 2jap n ASP 245 Cb 0.28 -0.49 -0.12 0.00 -0.02 0.00 0.00 41.12 40.77 2jap n ASP 245 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2jap s GLN 246 N -2.98 2.95 0.00 -1.24 0.74 -0.83 -4.94 119.66 113.36 2jap s GLN 246 Ca 0.14 -0.96 0.08 0.00 0.05 0.00 0.00 55.36 54.66 2jap s GLN 246 Cb 0.18 -3.51 0.49 0.00 1.10 0.00 0.00 33.01 31.27 2jap s GLN 246 CO 0.49 -0.55 0.94 0.28 -0.55 0.00 0.00 175.29 175.90