#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d2c s ASP 2 N 0.00 6.73 0.03 4.52 2.15 -1.26 -5.09 116.67 123.75 1d2c s ASP 2 Ca 0.00 1.00 -0.01 0.00 0.43 0.00 0.00 52.55 53.97 1d2c s ASP 2 Cb 0.00 -2.26 -0.02 0.00 -0.30 0.00 0.00 42.92 40.34 1d2c s ASP 2 CO 0.00 0.03 -0.02 -0.44 -0.17 0.00 0.00 175.17 174.57 1d2c s SER 3 N -2.00 0.29 -0.00 -0.34 0.01 -1.26 -5.16 113.70 105.24 1d2c s SER 3 Ca 0.42 -0.61 0.05 0.00 1.31 0.00 0.00 55.95 57.12 1d2c s SER 3 Cb -0.13 0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.20 1d2c s SER 3 CO 0.20 -0.39 -0.15 -0.69 0.41 0.00 0.00 173.24 172.63 1d2c s VAL 4 N -2.11 3.03 -0.22 3.43 1.01 -1.26 -5.11 120.40 119.18 1d2c s VAL 4 Ca -0.10 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 60.94 1d2c s VAL 4 Cb -0.05 -2.24 0.07 0.00 0.00 0.00 0.00 36.38 34.15 1d2c s VAL 4 CO -0.03 0.46 0.04 -0.47 0.00 0.00 0.00 175.10 175.10 1d2c s TYR 5 N -0.85 1.21 0.12 5.22 5.04 -1.26 -5.13 117.35 121.70 1d2c s TYR 5 Ca 0.14 -1.05 0.03 0.00 -2.44 0.00 0.00 57.07 53.74 1d2c s TYR 5 Cb -0.11 -1.16 -0.04 0.00 0.35 0.00 0.00 41.96 41.01 1d2c s TYR 5 CO 0.04 -0.67 0.18 -0.98 -1.34 0.00 0.00 175.55 172.78 1d2c s ARG 6 N 1.79 3.18 0.09 4.97 1.70 -1.26 -5.03 118.95 124.39 1d2c s ARG 6 Ca 0.00 -0.65 -0.31 0.00 -0.47 0.00 0.00 55.73 54.31 1d2c s ARG 6 Cb -0.17 -2.85 -0.15 0.00 -0.57 0.00 0.00 34.95 31.20 1d2c s ARG 6 CO -0.11 0.54 1.63 1.15 -1.08 0.00 0.00 175.30 177.44 1d2c h THR 7 N 2.05 0.38 -3.96 4.99 2.02 -2.08 -3.45 112.91 112.87 1d2c h THR 7 Ca -0.47 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.51 1d2c h THR 7 Cb 1.18 0.38 -0.16 0.00 -1.74 0.00 0.00 68.15 67.81 1d2c h THR 7 CO 0.68 0.00 -0.70 0.00 0.37 0.00 0.00 175.52 175.88 1d2c s ARG 8 N -6.05 0.70 0.93 6.66 1.70 -1.26 -5.15 118.95 116.48 1d2c s ARG 8 Ca -0.17 -1.17 -0.11 0.00 -0.47 0.00 0.00 55.73 53.82 1d2c s ARG 8 Cb 0.05 -0.09 0.16 0.00 -0.57 0.00 0.00 34.95 34.49 1d2c s ARG 8 CO 0.63 -0.03 1.12 -1.12 -1.08 0.00 0.00 175.30 174.81 1d2c s SER 9 N -2.69 2.85 -0.27 -2.89 0.01 -1.26 -4.93 113.70 104.52 1d2c s SER 9 Ca 0.05 1.98 -0.29 0.00 1.31 0.00 0.00 55.95 59.00 1d2c s SER 9 Cb 0.03 -2.49 0.00 0.00 0.21 0.00 0.00 66.02 63.77 1d2c s SER 9 CO -0.05 -3.11 1.21 -0.76 0.41 0.00 0.00 173.24 170.94 1d2c s LEU 10 N -6.59 3.97 0.00 2.44 1.02 -1.26 -3.51 118.68 114.76 1d2c s LEU 10 Ca 0.66 1.27 0.00 0.00 0.02 0.00 0.00 54.13 56.08 1d2c s LEU 10 Cb -0.22 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.45 1d2c s LEU 10 CO 0.59 -0.93 0.00 0.61 0.02 0.00 0.00 176.35 176.64 1d2c n GLY 11 N 3.97 1.58 3.89 -3.19 0.00 -1.26 -5.11 105.19 105.07 1d2c n GLY 11 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 1d2c n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1d2c s VAL 12 N -1.72 4.82 0.36 1.61 -7.23 -1.23 -5.09 120.40 111.93 1d2c s VAL 12 Ca 0.00 0.48 0.07 0.00 -1.81 0.00 0.00 61.98 60.73 1d2c s VAL 12 Cb 0.00 -3.85 -0.07 0.00 0.56 0.00 0.00 36.38 33.02 1d2c s VAL 12 CO 0.00 -0.91 -0.03 0.00 -0.31 0.00 0.00 175.10 173.85 1d2c s ALA 13 N -2.85 2.90 -0.14 1.32 0.00 -1.26 -4.79 121.76 116.95 1d2c s ALA 13 Ca 0.50 -2.16 -0.08 0.00 0.00 0.00 0.00 51.96 50.23 1d2c s ALA 13 Cb -0.10 0.16 0.05 0.00 0.00 0.00 0.00 23.12 23.23 1d2c s ALA 13 CO 0.46 -0.07 0.34 0.00 0.00 0.00 0.00 175.76 176.49 1d2c s ALA 14 N -2.79 -0.83 0.26 0.00 0.00 -1.26 -5.13 121.76 112.01 1d2c s ALA 14 Ca 0.34 1.25 -0.30 0.00 0.00 0.00 0.00 51.96 53.24 1d2c s ALA 14 Cb 0.07 -0.76 -0.13 0.00 0.00 0.00 0.00 23.12 22.29 1d2c s ALA 14 CO 0.16 -0.22 1.36 0.39 0.00 0.00 0.00 175.76 177.45 1d2c n GLU 15 N 4.05 1.99 0.00 0.00 4.71 -1.26 -2.61 120.64 127.52 1d2c n GLU 15 Ca -0.23 0.71 0.00 0.00 -0.01 0.00 0.00 57.16 57.63 1d2c n GLU 15 Cb 0.55 -2.33 0.00 0.00 -1.01 0.00 0.00 31.44 28.65 1d2c n GLU 15 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1d2c n GLY 16 N 1.84 3.18 3.27 0.62 0.00 -1.26 -5.03 105.19 107.81 1d2c n GLY 16 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1d2c n GLY 16 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1d2c s ILE 17 N -2.27 2.01 0.75 -0.61 -4.36 -1.07 -5.11 121.20 110.52 1d2c s ILE 17 Ca 0.00 -1.06 -0.16 0.00 -0.26 0.00 0.00 60.65 59.18 1d2c s ILE 17 Cb 0.00 -1.69 -0.02 0.00 1.25 0.00 0.00 42.46 42.00 1d2c s ILE 17 CO 0.00 0.56 0.63 -2.65 0.24 0.00 0.00 174.94 173.72 1d2c n PRO 18 N 2.81 0.27 -1.72 0.37 -0.02 -1.26 -4.59 135.00 130.85 1d2c n PRO 18 Ca -0.17 0.14 -0.32 0.00 -2.02 0.00 0.00 63.50 61.13 1d2c n PRO 18 Cb 0.52 -1.93 0.05 0.00 -0.02 0.00 0.00 33.50 32.11 1d2c n PRO 18 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1d2c s ASP 19 N -1.59 5.19 0.00 2.55 1.01 -1.26 -4.92 116.67 117.65 1d2c s ASP 19 Ca 0.66 1.89 0.00 0.00 0.71 0.00 0.00 52.55 55.82 1d2c s ASP 19 Cb -0.33 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.06 1d2c s ASP 19 CO 0.57 -1.57 0.00 0.00 0.21 0.00 0.00 175.17 174.38 1d2c n GLN 20 N -2.58 0.00 -1.27 8.23 3.00 -1.26 -1.98 117.38 121.52 1d2c n GLN 20 Ca 0.09 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.03 1d2c n GLN 20 Cb 0.52 0.00 0.12 0.00 0.00 0.00 0.00 30.24 30.89 1d2c n GLN 20 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1d2c n TYR 21 N -2.02 1.04 0.23 1.08 4.02 -1.26 -4.82 117.16 115.44 1d2c n TYR 21 Ca 0.00 -1.72 0.07 0.00 -0.01 0.00 0.00 57.90 56.24 1d2c n TYR 21 Cb 0.00 -0.27 0.56 0.00 -0.02 0.00 0.00 39.34 39.61 1d2c n TYR 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1d2c h ALA 22 N 1.49 1.56 -0.23 -0.72 0.00 -1.76 -3.16 119.26 116.44 1d2c h ALA 22 Ca 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1d2c h ALA 22 Cb 1.26 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1d2c h ALA 22 CO 0.29 0.22 -0.01 -3.47 0.00 0.00 0.00 179.25 176.28 1d2c n ASP 23 N -4.12 3.52 -4.74 0.00 -0.08 -1.26 -4.63 116.55 105.24 1d2c n ASP 23 Ca -0.02 -3.11 -0.31 0.00 -1.51 0.00 0.00 54.79 49.83 1d2c n ASP 23 Cb 0.25 -0.54 0.11 0.00 2.34 0.00 0.00 41.12 43.28 1d2c n ASP 23 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1d2c s GLY 24 N -2.14 1.70 0.55 0.27 0.00 -1.19 -4.79 107.32 101.72 1d2c s GLY 24 Ca 0.41 0.38 0.26 0.00 0.00 0.00 0.00 44.72 45.78 1d2c s GLY 24 CO 0.07 0.75 2.16 1.05 0.00 0.00 0.00 173.10 177.13 1d2c h GLU 25 N -1.31 0.00 0.00 2.90 4.11 -1.95 -0.28 114.58 118.06 1d2c h GLU 25 Ca -0.44 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 58.87 1d2c h GLU 25 Cb 1.24 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.50 1d2c h GLU 25 CO 0.48 0.06 -0.51 0.00 0.07 0.00 0.00 179.01 179.12 1d2c h ALA 26 N 1.94 0.05 -0.21 1.06 0.00 -1.90 -2.28 119.26 117.92 1d2c h ALA 26 Ca -0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.29 1d2c h ALA 26 Cb 0.15 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1d2c h ALA 26 CO 0.01 0.27 -0.18 0.00 0.00 0.00 0.00 179.25 179.35 1d2c h ALA 27 N 0.29 1.30 0.28 0.00 0.00 -1.72 -0.77 119.26 118.64 1d2c h ALA 27 Ca -0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1d2c h ALA 27 Cb 1.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1d2c h ALA 27 CO 0.10 0.47 -0.13 0.00 0.00 0.00 0.00 179.25 179.68 1d2c h ARG 28 N 0.34 -0.36 -0.50 0.00 -0.00 -1.05 -2.06 114.38 110.75 1d2c h ARG 28 Ca 0.06 0.02 0.10 0.00 -0.50 0.00 0.00 59.98 59.67 1d2c h ARG 28 Cb 0.51 0.08 -0.03 0.00 0.00 0.00 0.00 29.97 30.54 1d2c h ARG 28 CO 0.03 -0.24 0.34 -0.24 0.00 0.00 0.00 179.97 179.87 1d2c h VAL 29 N -0.38 0.86 -0.52 2.04 3.04 -1.37 -0.92 116.25 118.99 1d2c h VAL 29 Ca -0.04 -0.08 -0.05 0.00 -1.01 0.00 0.00 66.70 65.52 1d2c h VAL 29 Cb 0.29 0.62 -0.02 0.00 -2.01 0.00 0.00 31.29 30.16 1d2c h VAL 29 CO 0.06 0.04 0.11 -0.25 -1.01 0.00 0.00 177.57 176.52 1d2c h TRP 30 N 0.22 0.84 0.00 3.17 7.01 -1.06 -0.69 115.95 125.43 1d2c h TRP 30 Ca 0.23 -0.08 -0.04 0.00 2.11 0.00 0.00 58.89 61.11 1d2c h TRP 30 Cb 0.63 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.44 1d2c h TRP 30 CO -0.00 0.72 -0.17 1.96 -2.79 0.00 0.00 178.44 178.16 1d2c h GLN 31 N 0.78 0.00 -0.12 2.65 4.20 -0.42 -0.68 115.11 121.51 1d2c h GLN 31 Ca 0.17 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.67 1d2c h GLN 31 Cb 0.32 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.10 1d2c h GLN 31 CO 0.00 0.17 -0.77 -0.07 -0.67 0.00 0.00 178.83 177.49 1d2c h LEU 32 N 0.00 0.78 0.08 1.46 3.38 -1.06 -2.89 115.31 117.07 1d2c h LEU 32 Ca -0.00 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.45 1d2c h LEU 32 Cb 0.41 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1d2c h LEU 32 CO 0.02 1.30 -0.04 0.22 0.09 0.00 0.00 178.44 180.03 1d2c h TYR 33 N 0.45 -0.10 0.00 1.13 5.03 -0.28 0.18 116.97 123.37 1d2c h TYR 33 Ca -0.05 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.26 1d2c h TYR 33 Cb 1.38 0.03 0.00 0.00 1.55 0.00 0.00 36.73 39.70 1d2c h TYR 33 CO 0.07 -0.06 0.16 0.44 -1.32 0.00 0.00 178.16 177.45 1d2c n ILE 34 N -2.37 1.01 -0.07 1.81 -5.35 -0.39 -0.76 119.36 113.25 1d2c n ILE 34 Ca -0.01 0.66 -0.06 0.00 -0.27 0.00 0.00 62.75 63.07 1d2c n ILE 34 Cb 0.04 -1.66 -0.03 0.00 -1.74 0.00 0.00 39.64 36.25 1d2c n ILE 34 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1d2c h GLY 35 N 0.00 0.00 0.64 3.28 0.00 -1.38 -3.36 103.07 102.25 1d2c h GLY 35 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 1d2c h GLY 35 CO 0.00 0.00 0.63 -1.80 0.00 0.00 0.00 176.54 175.37 1d2c h ASP 36 N -1.00 0.00 -3.23 0.19 1.82 0.15 -3.22 116.42 111.13 1d2c h ASP 36 Ca -0.04 0.00 -0.78 0.00 -0.39 0.00 0.00 57.03 55.82 1d2c h ASP 36 Cb 0.48 0.00 -0.25 0.00 0.68 0.00 0.00 39.33 40.24 1d2c h ASP 36 CO -0.03 0.00 0.62 -0.89 -1.61 0.00 0.00 179.24 177.33 1d2c s THR 37 N -4.21 5.66 0.00 2.25 2.01 -0.95 -4.24 115.64 116.17 1d2c s THR 37 Ca -0.03 -3.00 0.00 0.00 0.31 0.00 0.00 61.69 58.97 1d2c s THR 37 Cb 0.08 -4.66 0.00 0.00 0.01 0.00 0.00 72.50 67.93 1d2c s THR 37 CO 0.28 -1.28 0.00 -2.11 -0.69 0.00 0.00 174.62 170.82 1d2c n ARG 38 N 3.76 0.00 -0.10 4.92 1.85 -1.22 -4.97 116.66 120.90 1d2c n ARG 38 Ca 0.25 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 57.06 1d2c n ARG 38 Cb 0.42 -0.42 -0.01 0.00 -1.05 0.00 0.00 32.46 31.39 1d2c n ARG 38 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1d2c n SER 39 N -0.81 0.09 -4.42 2.89 3.41 -1.26 -4.88 113.62 108.63 1d2c n SER 39 Ca 0.00 -1.91 -0.47 0.00 -0.26 0.00 0.00 58.87 56.24 1d2c n SER 39 Cb 0.00 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 63.47 1d2c n SER 39 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1d2c n ARG 40 N 5.07 0.25 -3.20 4.33 0.63 -1.26 -1.19 116.66 121.29 1d2c n ARG 40 Ca 0.05 0.09 -0.35 0.00 -0.92 0.00 0.00 57.85 56.71 1d2c n ARG 40 Cb 0.04 -1.16 -0.06 0.00 0.45 0.00 0.00 32.46 31.73 1d2c n ARG 40 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1d2c s THR 41 N -1.09 4.68 0.17 5.15 2.01 -0.42 -4.75 115.64 121.39 1d2c s THR 41 Ca 0.63 1.08 -0.14 0.00 0.31 0.00 0.00 61.69 63.57 1d2c s THR 41 Cb -0.85 -3.79 0.05 0.00 0.01 0.00 0.00 72.50 67.93 1d2c s THR 41 CO 0.57 0.17 1.79 0.00 -0.69 0.00 0.00 174.62 176.47 1d2c h ALA 42 N 3.32 0.66 -1.00 7.40 0.00 -1.91 0.47 119.26 128.19 1d2c h ALA 42 Ca -0.48 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.39 1d2c h ALA 42 Cb 1.19 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1d2c h ALA 42 CO 0.65 0.15 0.66 1.49 0.00 0.00 0.00 179.25 182.21 1d2c h GLU 43 N 0.69 1.25 -0.10 0.00 4.57 -1.94 -0.90 114.58 118.16 1d2c h GLU 43 Ca 0.18 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.24 1d2c h GLU 43 Cb 0.00 -0.28 -0.00 0.00 -0.16 0.00 0.00 28.75 28.31 1d2c h GLU 43 CO -0.03 0.83 -0.12 -0.92 -1.18 0.00 0.00 179.01 177.58 1d2c h TYR 44 N 1.29 0.31 -0.29 0.92 3.20 -1.63 -2.55 116.97 118.22 1d2c h TYR 44 Ca 0.39 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 1d2c h TYR 44 Cb -0.03 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 1d2c h TYR 44 CO -0.00 0.70 0.14 -0.22 -1.64 0.00 0.00 178.16 177.14 1d2c h LYS 45 N -0.18 0.41 -0.54 1.82 3.64 -0.69 -2.41 116.57 118.63 1d2c h LYS 45 Ca 0.01 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 1d2c h LYS 45 Cb 0.66 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1d2c h LYS 45 CO 0.03 0.38 -0.03 0.00 -2.27 0.00 0.00 179.45 177.56 1d2c h ALA 46 N 1.00 0.93 0.09 5.00 0.00 -1.26 -2.89 119.26 122.12 1d2c h ALA 46 Ca 0.10 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1d2c h ALA 46 Cb 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1d2c h ALA 46 CO -0.01 0.64 -0.04 2.35 0.00 0.00 0.00 179.25 182.18 1d2c h TRP 47 N 0.87 -0.11 0.05 0.00 7.01 -1.33 -2.15 115.95 120.28 1d2c h TRP 47 Ca 0.15 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.15 1d2c h TRP 47 Cb 0.55 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.64 1d2c h TRP 47 CO 0.03 0.21 -0.02 1.25 -2.79 0.00 0.00 178.44 177.12 1d2c h LEU 48 N -0.43 -0.05 0.00 0.65 5.85 -1.50 -1.41 115.31 118.42 1d2c h LEU 48 Ca -0.01 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.54 1d2c h LEU 48 Cb 0.36 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1d2c h LEU 48 CO 0.02 0.16 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.07 1d2c h LEU 49 N -0.27 -0.43 -0.17 2.25 4.07 -1.61 -0.73 115.31 118.43 1d2c h LEU 49 Ca -0.01 0.06 0.05 0.00 0.08 0.00 0.00 57.88 58.07 1d2c h LEU 49 Cb 0.24 0.18 -0.07 0.00 1.08 0.00 0.00 40.66 42.10 1d2c h LEU 49 CO 0.01 -0.21 -0.30 1.23 -1.08 0.00 0.00 178.44 178.10 1d2c h GLY 50 N -0.25 -0.36 0.01 0.83 0.00 -1.36 0.13 103.07 102.08 1d2c h GLY 50 Ca 0.05 0.37 0.10 0.00 0.00 0.00 0.00 47.33 47.85 1d2c h GLY 50 CO -0.14 -0.21 -0.11 -2.00 0.00 0.00 0.00 176.54 174.08 1d2c h LEU 51 N -0.35 -0.44 -0.37 3.11 5.85 -0.86 0.29 115.31 122.54 1d2c h LEU 51 Ca 0.11 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 1d2c h LEU 51 Cb 0.52 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1d2c h LEU 51 CO -0.37 -0.16 0.20 -0.07 -0.34 0.00 0.00 178.44 177.71 1d2c h LEU 52 N 0.01 0.47 0.00 2.25 -0.00 -0.22 -2.64 115.31 115.18 1d2c h LEU 52 Ca 0.24 -0.10 -0.00 0.00 -0.00 0.00 0.00 57.88 58.03 1d2c h LEU 52 Cb 0.37 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 40.91 1d2c h LEU 52 CO -0.51 0.43 -0.00 0.03 -0.00 0.00 0.00 178.44 178.39 1d2c h ARG 53 N 0.47 -0.00 -0.89 1.13 3.08 -0.29 -1.03 114.38 116.85 1d2c h ARG 53 Ca 0.13 0.00 0.26 0.00 0.07 0.00 0.00 59.98 60.44 1d2c h ARG 53 Cb 0.07 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.08 1d2c h ARG 53 CO -0.02 0.38 0.84 0.37 -1.07 0.00 0.00 179.97 180.48 1d2c h GLN 54 N -0.39 0.00 -0.18 0.04 4.15 -0.37 0.66 115.11 119.02 1d2c h GLN 54 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1d2c h GLN 54 Cb 0.39 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1d2c h GLN 54 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.62 1d2c n HIS 55 N -3.70 0.23 -2.44 3.99 8.25 -1.00 -4.98 115.22 115.56 1d2c n HIS 55 Ca 0.19 -0.17 -0.19 0.00 -0.26 0.00 0.00 57.72 57.29 1d2c n HIS 55 Cb 1.14 -0.01 -0.00 0.00 1.12 0.00 0.00 29.99 32.24 1d2c n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d2c n GLY 56 N 0.92 -0.40 3.77 -1.41 0.00 0.23 -4.98 105.19 103.33 1d2c n GLY 56 Ca 0.12 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1d2c n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2c n HIS 58 N -3.29 -3.35 -3.25 0.00 -0.00 -1.26 -4.84 115.22 99.23 1d2c n HIS 58 Ca 0.09 0.87 -0.39 0.00 0.46 0.00 0.00 57.72 58.75 1d2c n HIS 58 Cb 0.53 1.81 -0.07 0.00 -0.12 0.00 0.00 29.99 32.14 1d2c n HIS 58 CO 0.00 0.00 0.00 -0.98 0.46 0.00 0.00 176.34 175.82 1d2c s ARG 59 N -2.00 4.16 0.01 1.57 1.70 -1.26 -1.67 118.95 121.46 1d2c s ARG 59 Ca 0.00 0.39 0.05 0.00 -0.47 0.00 0.00 55.73 55.70 1d2c s ARG 59 Cb 0.00 -3.58 -0.02 0.00 -0.57 0.00 0.00 34.95 30.78 1d2c s ARG 59 CO 0.00 -0.20 -0.16 0.14 -1.08 0.00 0.00 175.30 174.00 1d2c s VAL 60 N 1.80 1.26 -0.18 4.99 -7.23 -0.95 -1.34 120.40 118.75 1d2c s VAL 60 Ca 0.23 -0.84 -0.07 0.00 -1.81 0.00 0.00 61.98 59.49 1d2c s VAL 60 Cb -0.15 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 1d2c s VAL 60 CO 0.09 0.23 0.06 -0.22 -0.31 0.00 0.00 175.10 174.95 1d2c s LEU 61 N -0.71 3.80 -0.37 1.32 2.96 -0.55 -2.23 118.68 122.89 1d2c s LEU 61 Ca 0.05 0.08 -0.09 0.00 -0.22 0.00 0.00 54.13 53.95 1d2c s LEU 61 Cb -0.07 -1.95 0.04 0.00 0.50 0.00 0.00 46.19 44.70 1d2c s LEU 61 CO 0.00 0.19 0.18 -0.62 -1.32 0.00 0.00 176.35 174.78 1d2c s ASP 62 N 0.30 5.59 0.00 3.68 -1.08 -0.93 -0.82 116.67 123.41 1d2c s ASP 62 Ca 0.03 -1.11 0.25 0.00 -0.52 0.00 0.00 52.55 51.20 1d2c s ASP 62 Cb -0.12 -1.97 0.88 0.00 -1.46 0.00 0.00 42.92 40.25 1d2c s ASP 62 CO 0.00 -0.39 1.64 1.33 0.52 0.00 0.00 175.17 178.27 1d2c n VAL 63 N 4.93 0.09 -2.59 1.11 0.24 -0.74 -1.70 118.33 119.67 1d2c n VAL 63 Ca -0.12 -0.31 -0.12 0.00 -2.04 0.00 0.00 64.34 61.75 1d2c n VAL 63 Cb 0.45 0.52 0.03 0.00 -1.47 0.00 0.00 33.84 33.37 1d2c n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1d2c n ALA 64 N 0.33 3.74 -0.27 2.33 0.00 -1.24 -4.67 120.51 120.73 1d2c n ALA 64 Ca 0.18 -3.36 0.01 0.00 0.00 0.00 0.00 53.44 50.27 1d2c n ALA 64 Cb 0.37 -0.76 0.05 0.00 0.00 0.00 0.00 19.45 19.10 1d2c n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d2c n GLY 66 N -1.38 1.93 0.00 0.00 0.00 -1.26 -0.85 105.19 103.63 1d2c n GLY 66 Ca 0.09 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.67 1d2c n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1d2c n THR 67 N 0.00 0.14 -0.42 2.61 -2.24 -1.25 -4.13 114.28 108.99 1d2c n THR 67 Ca 0.00 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1d2c n THR 67 Cb 0.00 -0.69 0.00 0.00 -2.10 0.00 0.00 70.33 67.54 1d2c n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d2c n GLY 68 N 0.42 0.75 0.08 3.38 0.00 -0.03 -2.88 105.19 106.92 1d2c n GLY 68 Ca 0.14 -0.34 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 1d2c n GLY 68 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1d2c h VAL 69 N 0.00 0.88 0.00 1.61 -1.51 -1.89 -1.48 116.25 113.86 1d2c h VAL 69 Ca 0.00 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.39 1d2c h VAL 69 Cb 0.00 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 30.03 1d2c h VAL 69 CO 0.00 0.00 -0.39 0.44 -1.23 0.00 0.00 177.57 176.39 1d2c h ASP 70 N -0.04 0.00 -0.01 4.19 3.45 -1.95 -3.21 116.42 118.85 1d2c h ASP 70 Ca 0.04 0.00 -0.24 0.00 0.43 0.00 0.00 57.03 57.26 1d2c h ASP 70 Cb 0.10 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 38.89 1d2c h ASP 70 CO -0.09 0.39 -0.92 0.28 -1.57 0.00 0.00 179.24 177.33 1d2c h SER 71 N 0.00 0.83 -0.95 6.45 0.02 -1.84 -2.95 113.55 115.10 1d2c h SER 71 Ca -0.00 -0.74 0.03 0.00 -0.84 0.00 0.00 61.79 60.23 1d2c h SER 71 Cb 0.81 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 63.05 1d2c h SER 71 CO 0.05 1.45 0.63 0.40 -1.14 0.00 0.00 176.83 178.22 1d2c h ILE 72 N 0.28 1.20 -0.63 3.27 2.04 -1.28 0.57 117.51 122.96 1d2c h ILE 72 Ca -0.11 -0.42 -0.05 0.00 1.00 0.00 0.00 64.86 65.27 1d2c h ILE 72 Cb 1.59 -0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 1d2c h ILE 72 CO 0.18 0.23 0.17 -0.03 0.00 0.00 0.00 178.15 178.70 1d2c h MET 73 N 1.24 0.97 0.00 2.37 4.05 -1.57 -0.53 114.93 121.46 1d2c h MET 73 Ca 0.37 -0.20 -0.15 0.00 -0.28 0.00 0.00 59.70 59.43 1d2c h MET 73 Cb -0.06 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 30.58 1d2c h MET 73 CO -0.10 0.85 -0.74 -0.07 0.23 0.00 0.00 176.91 177.08 1d2c h LEU 74 N 0.93 0.00 0.02 3.39 3.38 -1.18 -2.79 115.31 119.06 1d2c h LEU 74 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1d2c h LEU 74 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1d2c h LEU 74 CO -0.00 0.74 -0.01 0.58 0.09 0.00 0.00 178.44 179.83 1d2c h VAL 75 N 0.00 1.24 0.00 1.22 2.07 -0.32 -0.57 116.25 119.88 1d2c h VAL 75 Ca -0.01 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 1d2c h VAL 75 Cb 1.36 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 1d2c h VAL 75 CO 0.10 0.20 -0.13 -0.33 0.02 0.00 0.00 177.57 177.43 1d2c h GLU 76 N -0.37 0.00 -0.74 1.57 5.08 -1.16 -2.18 114.58 116.77 1d2c h GLU 76 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1d2c h GLU 76 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1d2c h GLU 76 CO 0.00 0.13 0.00 0.39 -1.00 0.00 0.00 179.01 178.54 1d2c n GLU 77 N -3.66 2.64 -0.68 2.33 -0.58 -1.05 -4.91 120.64 114.74 1d2c n GLU 77 Ca -0.02 -1.41 0.00 0.00 -0.42 0.00 0.00 57.16 55.31 1d2c n GLU 77 Cb 0.25 -1.77 0.00 0.00 -0.57 0.00 0.00 31.44 29.36 1d2c n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d2c n GLY 78 N 0.40 1.53 3.79 0.62 0.00 -0.82 -5.03 105.19 105.69 1d2c n GLY 78 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1d2c n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1d2c s PHE 79 N -3.64 2.85 -0.76 1.61 0.40 -0.24 -4.97 117.98 113.24 1d2c s PHE 79 Ca 0.00 1.49 -0.11 0.00 -0.60 0.00 0.00 56.93 57.72 1d2c s PHE 79 Cb 0.00 -2.98 0.20 0.00 0.51 0.00 0.00 43.02 40.75 1d2c s PHE 79 CO 0.00 -1.49 0.66 0.45 0.70 0.00 0.00 175.22 175.55 1d2c s SER 80 N -3.46 6.29 -0.14 1.36 0.15 -0.67 -4.53 113.70 112.70 1d2c s SER 80 Ca 0.60 -2.71 -0.07 0.00 0.70 0.00 0.00 55.95 54.47 1d2c s SER 80 Cb -0.16 -2.10 -0.04 0.00 -1.71 0.00 0.00 66.02 62.01 1d2c s SER 80 CO 0.53 -0.52 0.11 0.68 1.20 0.00 0.00 173.24 175.24 1d2c s VAL 81 N 0.14 5.27 -0.21 4.45 -7.23 -1.26 -2.24 120.40 119.32 1d2c s VAL 81 Ca 0.17 0.13 0.00 0.00 -1.81 0.00 0.00 61.98 60.47 1d2c s VAL 81 Cb -0.14 -3.32 0.02 0.00 0.56 0.00 0.00 36.38 33.50 1d2c s VAL 81 CO -0.07 0.56 -0.15 0.42 -0.31 0.00 0.00 175.10 175.56 1d2c s THR 82 N -0.55 2.37 -0.09 5.32 -4.23 -0.95 -2.59 115.64 114.93 1d2c s THR 82 Ca 0.12 -0.98 -0.03 0.00 -1.18 0.00 0.00 61.69 59.62 1d2c s THR 82 Cb -0.12 -2.10 -0.03 0.00 1.34 0.00 0.00 72.50 71.59 1d2c s THR 82 CO 0.02 0.40 0.01 -0.44 -0.54 0.00 0.00 174.62 174.07 1d2c s SER 83 N 1.30 5.34 0.01 3.99 0.01 0.64 -2.19 113.70 122.79 1d2c s SER 83 Ca 0.03 0.16 -0.01 0.00 1.31 0.00 0.00 55.95 57.44 1d2c s SER 83 Cb -0.15 -1.55 -0.01 0.00 0.21 0.00 0.00 66.02 64.52 1d2c s SER 83 CO -0.09 0.37 0.01 0.68 0.41 0.00 0.00 173.24 174.61 1d2c s VAL 84 N -0.82 0.08 0.17 3.43 -7.23 -0.69 0.45 120.40 115.79 1d2c s VAL 84 Ca 0.13 -0.66 -0.10 0.00 -1.81 0.00 0.00 61.98 59.54 1d2c s VAL 84 Cb -0.11 -0.23 -0.00 0.00 0.56 0.00 0.00 36.38 36.59 1d2c s VAL 84 CO 0.02 -0.36 0.32 -0.62 -0.31 0.00 0.00 175.10 174.15 1d2c s ASP 85 N -1.09 -0.00 -0.03 4.85 3.68 -1.04 -2.22 116.67 120.83 1d2c s ASP 85 Ca -0.12 -0.83 0.19 0.00 2.13 0.00 0.00 52.55 53.93 1d2c s ASP 85 Cb -0.07 0.46 -0.30 0.00 -1.45 0.00 0.00 42.92 41.56 1d2c s ASP 85 CO -0.00 -0.92 0.42 0.00 0.13 0.00 0.00 175.17 174.79 1d2c n ALA 86 N -0.24 2.70 -2.59 3.66 0.00 -1.08 -0.87 120.51 122.09 1d2c n ALA 86 Ca -0.07 -0.46 -0.41 0.00 0.00 0.00 0.00 53.44 52.50 1d2c n ALA 86 Cb 0.63 -0.65 -0.07 0.00 0.00 0.00 0.00 19.45 19.36 1d2c n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1d2c s SER 87 N -4.20 6.47 0.24 0.00 0.15 -1.26 -4.92 113.70 110.18 1d2c s SER 87 Ca -0.07 0.38 0.06 0.00 0.70 0.00 0.00 55.95 57.02 1d2c s SER 87 Cb 0.12 -2.32 0.24 0.00 -1.71 0.00 0.00 66.02 62.35 1d2c s SER 87 CO 0.79 -0.47 1.55 0.44 1.20 0.00 0.00 173.24 176.74 1d2c h ASP 88 N 8.22 0.18 -0.60 5.45 3.32 -1.98 -1.48 116.42 129.52 1d2c h ASP 88 Ca -0.27 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.68 1d2c h ASP 88 Cb 1.12 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 1d2c h ASP 88 CO 0.80 0.78 0.40 0.11 -1.72 0.00 0.00 179.24 179.60 1d2c h LYS 89 N 0.11 0.77 0.03 3.56 1.57 -2.01 -1.56 116.57 119.04 1d2c h LYS 89 Ca -0.01 -0.05 -0.30 0.00 -1.87 0.00 0.00 60.65 58.42 1d2c h LYS 89 Cb 1.17 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.26 1d2c h LYS 89 CO 0.10 0.51 -1.74 0.52 -0.57 0.00 0.00 179.45 178.26 1d2c h MET 90 N 0.79 0.06 -0.15 3.15 2.86 -1.88 -3.35 114.93 116.42 1d2c h MET 90 Ca 0.23 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 1d2c h MET 90 Cb -0.05 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1d2c h MET 90 CO -0.05 0.67 -0.12 1.25 1.06 0.00 0.00 176.91 179.71 1d2c h LEU 91 N 0.02 0.22 -1.89 1.22 5.85 -0.94 -2.66 115.31 117.11 1d2c h LEU 91 Ca -0.30 -0.04 0.15 0.00 0.84 0.00 0.00 57.88 58.52 1d2c h LEU 91 Cb 2.01 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.96 1d2c h LEU 91 CO 0.09 0.37 0.40 0.50 -0.34 0.00 0.00 178.44 179.46 1d2c h LYS 92 N 0.22 0.11 0.00 1.25 3.64 -1.43 -1.92 116.57 118.44 1d2c h LYS 92 Ca 0.05 -0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.21 1d2c h LYS 92 Cb 0.36 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1d2c h LYS 92 CO 0.02 0.07 -0.89 1.88 -2.27 0.00 0.00 179.45 178.26 1d2c h TYR 93 N 0.11 0.39 -0.13 1.91 0.05 -1.70 -2.31 116.97 115.29 1d2c h TYR 93 Ca 0.27 -0.21 -0.05 0.00 0.05 0.00 0.00 58.73 58.79 1d2c h TYR 93 Cb 0.94 -0.04 -0.00 0.00 1.01 0.00 0.00 36.73 38.63 1d2c h TYR 93 CO -0.00 1.02 -0.12 0.00 -1.05 0.00 0.00 178.16 178.01 1d2c h ALA 94 N 0.91 0.18 -0.84 3.88 0.00 -1.22 -2.25 119.26 119.92 1d2c h ALA 94 Ca -0.05 -0.31 0.08 0.00 0.00 0.00 0.00 54.91 54.63 1d2c h ALA 94 Cb 1.52 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 19.20 1d2c h ALA 94 CO 0.14 0.05 0.49 -0.07 0.00 0.00 0.00 179.25 179.86 1d2c h LEU 95 N -0.08 0.73 -0.38 0.00 -0.00 -1.47 0.18 115.31 114.28 1d2c h LEU 95 Ca 0.02 0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 57.92 1d2c h LEU 95 Cb 0.65 -0.11 -0.02 0.00 -0.00 0.00 0.00 40.66 41.18 1d2c h LEU 95 CO 0.03 0.44 0.17 0.50 -0.00 0.00 0.00 178.44 179.58 1d2c h LYS 96 N 0.85 0.56 0.26 1.13 3.64 -1.36 -1.89 116.57 119.77 1d2c h LYS 96 Ca 0.39 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1d2c h LYS 96 Cb 0.30 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 1d2c h LYS 96 CO -0.22 0.52 -0.24 0.93 -2.27 0.00 0.00 179.45 178.16 1d2c h GLU 97 N 0.48 -0.51 -0.40 1.90 4.39 -0.47 -2.01 114.58 117.96 1d2c h GLU 97 Ca 0.13 0.04 0.08 0.00 0.34 0.00 0.00 59.36 59.94 1d2c h GLU 97 Cb 0.15 0.12 -0.07 0.00 -0.10 0.00 0.00 28.75 28.85 1d2c h GLU 97 CO -0.01 -0.34 -0.02 -0.09 -1.16 0.00 0.00 179.01 177.38 1d2c h ARG 98 N -0.53 0.08 -0.96 2.33 2.43 -0.61 -2.24 114.38 114.87 1d2c h ARG 98 Ca -0.01 -0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1d2c h ARG 98 Cb 0.49 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.95 1d2c h ARG 98 CO -0.04 0.05 0.61 2.35 -1.51 0.00 0.00 179.97 181.43 1d2c h TRP 99 N 0.08 1.14 0.21 2.20 2.91 -1.13 0.16 115.95 121.52 1d2c h TRP 99 Ca 0.20 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.24 1d2c h TRP 99 Cb 0.29 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 28.57 1d2c h TRP 99 CO -0.29 0.57 -0.10 -0.91 -1.03 0.00 0.00 178.44 176.68 1d2c h ASN 100 N 1.10 -0.24 -0.36 2.65 -0.26 -0.79 -2.89 115.58 114.79 1d2c h ASN 100 Ca 0.42 -0.10 -0.05 0.00 -0.56 0.00 0.00 56.30 56.02 1d2c h ASN 100 Cb 0.20 0.06 -0.03 0.00 -1.06 0.00 0.00 38.32 37.50 1d2c h ASN 100 CO -0.18 -0.05 0.06 0.54 -1.06 0.00 0.00 177.43 176.74 1d2c n ARG 101 N -5.15 2.96 0.31 0.81 1.74 -0.98 -4.42 116.66 111.93 1d2c n ARG 101 Ca -0.09 -1.76 0.18 0.00 -0.77 0.00 0.00 57.85 55.40 1d2c n ARG 101 Cb 0.18 -1.89 1.01 0.00 -1.02 0.00 0.00 32.46 30.74 1d2c n ARG 101 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1d2c h ARG 102 N 1.98 0.00 0.00 5.56 0.11 -0.46 -1.21 114.38 120.36 1d2c h ARG 102 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 1d2c h ARG 102 Cb 1.45 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.53 1d2c h ARG 102 CO 0.33 0.01 0.00 0.87 0.10 0.00 0.00 179.97 181.28 1d2c h LYS 103 N 0.00 0.00 -5.90 0.08 1.79 -1.83 -3.36 116.57 107.34 1d2c h LYS 103 Ca -0.00 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.89 1d2c h LYS 103 Cb 0.04 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.62 1d2c h LYS 103 CO 0.00 0.00 0.27 -1.21 -1.08 0.00 0.00 179.45 177.43 1d2c s GLU 104 N -3.54 4.31 0.27 3.15 2.02 -0.46 -4.95 118.70 119.50 1d2c s GLU 104 Ca 0.02 0.90 -0.01 0.00 0.02 0.00 0.00 54.97 55.90 1d2c s GLU 104 Cb 0.09 -3.55 0.61 0.00 0.10 0.00 0.00 34.13 31.38 1d2c s GLU 104 CO 0.46 -0.23 1.66 -1.35 0.02 0.00 0.00 175.26 175.81 1d2c h PRO 105 N 7.26 0.21 -0.67 0.39 0.11 -1.86 0.47 132.00 137.91 1d2c h PRO 105 Ca -0.32 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.80 1d2c h PRO 105 Cb 1.15 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 1d2c h PRO 105 CO 0.80 0.14 0.44 0.00 -0.21 0.00 0.00 178.00 179.18 1d2c h ALA 106 N 1.73 1.58 0.00 -0.75 0.00 -1.92 -2.26 119.26 117.64 1d2c h ALA 106 Ca 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1d2c h ALA 106 Cb 0.95 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1d2c h ALA 106 CO -0.62 0.37 -0.21 0.74 0.00 0.00 0.00 179.25 179.53 1d2c h PHE 107 N 0.85 0.00 0.00 0.00 -1.00 -1.16 -3.18 116.94 112.45 1d2c h PHE 107 Ca 0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.04 1d2c h PHE 107 Cb -0.01 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.55 1d2c h PHE 107 CO -0.00 0.00 0.00 0.22 -1.61 0.00 0.00 178.31 176.92 1d2c h ASP 108 N 0.00 0.00 -0.54 2.17 3.58 -0.79 -3.13 116.42 117.70 1d2c h ASP 108 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1d2c h ASP 108 Cb 0.91 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.96 1d2c h ASP 108 CO 0.00 0.00 0.00 0.29 -2.88 0.00 0.00 179.24 176.65 1d2c n LYS 109 N -2.81 2.68 -2.81 0.28 4.76 -1.07 -4.93 118.16 114.26 1d2c n LYS 109 Ca 0.04 -2.37 -0.42 0.00 -2.87 0.00 0.00 58.31 52.70 1d2c n LYS 109 Cb 0.49 -1.45 -0.03 0.00 -1.84 0.00 0.00 35.03 32.19 1d2c n LYS 109 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 1d2c s TRP 110 N -1.06 3.44 -0.29 2.13 -0.00 -1.19 -4.79 118.94 117.18 1d2c s TRP 110 Ca 0.38 1.37 -0.10 0.00 -0.00 0.00 0.00 56.10 57.75 1d2c s TRP 110 Cb 0.20 -3.09 -0.03 0.00 -0.00 0.00 0.00 33.47 30.55 1d2c s TRP 110 CO 0.27 -0.26 0.17 0.08 -0.00 0.00 0.00 176.95 177.20 1d2c s VAL 111 N 2.24 4.96 -0.14 5.86 1.01 -1.07 -5.00 120.40 128.25 1d2c s VAL 111 Ca 0.42 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.30 1d2c s VAL 111 Cb -0.17 -3.43 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 1d2c s VAL 111 CO 0.13 0.17 -0.17 -0.63 0.00 0.00 0.00 175.10 174.60 1d2c s ILE 112 N 1.69 2.54 0.20 2.22 1.01 -1.25 0.23 121.20 127.84 1d2c s ILE 112 Ca 0.06 -0.83 -0.05 0.00 0.00 0.00 0.00 60.65 59.84 1d2c s ILE 112 Cb -0.16 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.23 1d2c s ILE 112 CO 0.08 0.53 0.22 -1.61 0.00 0.00 0.00 174.94 174.17 1d2c s GLU 113 N 0.63 1.24 -0.17 2.79 0.41 0.17 -4.95 118.70 118.82 1d2c s GLU 113 Ca -0.09 -1.45 -0.13 0.00 -0.41 0.00 0.00 54.97 52.89 1d2c s GLU 113 Cb -0.16 0.33 -0.05 0.00 -1.78 0.00 0.00 34.13 32.47 1d2c s GLU 113 CO 0.03 -0.44 0.24 -1.21 -0.49 0.00 0.00 175.26 173.39 1d2c s GLU 114 N -4.09 4.22 0.11 1.61 2.02 -1.26 -2.49 118.70 118.83 1d2c s GLU 114 Ca 0.30 -0.00 -0.14 0.00 0.02 0.00 0.00 54.97 55.15 1d2c s GLU 114 Cb 0.05 -3.42 0.02 0.00 0.10 0.00 0.00 34.13 30.88 1d2c s GLU 114 CO 0.08 0.27 0.33 0.00 0.02 0.00 0.00 175.26 175.96 1d2c s ALA 115 N 0.41 -0.70 -0.03 5.21 0.00 -0.05 -4.88 121.76 121.71 1d2c s ALA 115 Ca 0.14 -0.23 0.05 0.00 0.00 0.00 0.00 51.96 51.92 1d2c s ALA 115 Cb -0.12 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.62 1d2c s ALA 115 CO 0.02 -0.60 -0.17 1.21 0.00 0.00 0.00 175.76 176.22 1d2c s ASN 116 N -2.82 2.12 0.22 0.00 3.04 -1.26 -2.63 114.94 113.61 1d2c s ASN 116 Ca 0.04 -0.34 -0.08 0.00 0.04 0.00 0.00 52.86 52.52 1d2c s ASN 116 Cb 0.03 -0.44 0.31 0.00 -1.54 0.00 0.00 41.25 39.61 1d2c s ASN 116 CO -0.12 0.18 1.78 -0.50 -3.04 0.00 0.00 177.10 175.41 1d2c h TRP 117 N 6.02 0.62 -0.22 0.43 6.55 -1.93 1.59 115.95 129.01 1d2c h TRP 117 Ca -0.34 0.03 0.06 0.00 0.95 0.00 0.00 58.89 59.59 1d2c h TRP 117 Cb 1.16 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 29.28 1d2c h TRP 117 CO 0.42 0.24 0.17 -0.07 -1.05 0.00 0.00 178.44 178.15 1d2c h LEU 118 N 0.60 0.00 -2.55 -4.49 4.07 -1.88 -2.62 115.31 108.45 1d2c h LEU 118 Ca 0.33 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.29 1d2c h LEU 118 Cb 0.33 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.07 1d2c h LEU 118 CO -0.25 0.00 -0.07 0.35 -1.08 0.00 0.00 178.44 177.39 1d2c n THR 119 N -4.33 1.00 -0.33 0.22 -2.24 -0.64 -4.87 114.28 103.09 1d2c n THR 119 Ca 0.02 -1.12 0.01 0.00 -2.27 0.00 0.00 64.05 60.70 1d2c n THR 119 Cb 0.32 0.34 0.08 0.00 -2.10 0.00 0.00 70.33 68.96 1d2c n THR 119 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1d2c h LEU 120 N 0.00 -1.09 -1.96 3.22 5.85 0.27 0.24 115.31 121.83 1d2c h LEU 120 Ca 0.00 0.28 0.41 0.00 0.84 0.00 0.00 57.88 59.41 1d2c h LEU 120 Cb 0.86 0.63 -0.06 0.00 0.37 0.00 0.00 40.66 42.47 1d2c h LEU 120 CO 0.00 -0.30 1.01 -2.24 -0.34 0.00 0.00 178.44 176.57 1d2c h ASP 121 N -0.02 0.02 -0.00 1.25 3.04 -1.84 0.18 116.42 119.04 1d2c h ASP 121 Ca 0.38 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 54.18 1d2c h ASP 121 Cb 0.63 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.92 1d2c h ASP 121 CO -0.92 -0.00 -0.73 1.17 -2.04 0.00 0.00 179.24 176.72 1d2c n LYS 122 N -4.14 1.63 -0.04 4.15 4.81 0.03 -4.52 118.16 120.09 1d2c n LYS 122 Ca 0.31 -0.08 -0.13 0.00 -0.87 0.00 0.00 58.31 57.55 1d2c n LYS 122 Cb 1.46 -1.27 -0.14 0.00 0.02 0.00 0.00 35.03 35.10 1d2c n LYS 122 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1d2c n ASP 123 N -1.27 1.09 -4.16 3.14 8.00 0.51 -4.89 116.55 118.98 1d2c n ASP 123 Ca 0.03 0.25 -0.32 0.00 0.71 0.00 0.00 54.79 55.47 1d2c n ASP 123 Cb 0.26 -0.08 -0.17 0.00 -0.02 0.00 0.00 41.12 41.12 1d2c n ASP 123 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1d2c s VAL 124 N -2.56 1.94 -0.68 2.53 1.01 -0.58 -4.97 120.40 117.08 1d2c s VAL 124 Ca -0.12 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 60.68 1d2c s VAL 124 Cb 0.07 -1.71 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 1d2c s VAL 124 CO 0.80 0.53 1.63 -2.84 0.00 0.00 0.00 175.10 175.22 1d2c s PRO 125 N 0.76 2.86 0.21 2.72 0.02 -1.26 -4.76 135.00 135.54 1d2c s PRO 125 Ca -0.09 0.20 -0.07 0.00 0.02 0.00 0.00 61.00 61.06 1d2c s PRO 125 Cb -0.16 -4.37 0.15 0.00 0.02 0.00 0.00 34.50 30.15 1d2c s PRO 125 CO 0.00 -2.53 1.71 0.00 -0.33 0.00 0.00 177.00 175.86 1d2c h ALA 126 N 12.80 0.96 -0.47 -1.55 0.00 -1.94 -3.47 119.26 125.59 1d2c h ALA 126 Ca -0.24 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1d2c h ALA 126 Cb 1.11 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1d2c h ALA 126 CO 1.25 0.65 0.00 0.41 0.00 0.00 0.00 179.25 181.56 1d2c n GLY 127 N -0.63 2.10 0.26 0.00 0.00 -1.26 -0.69 105.19 104.96 1d2c n GLY 127 Ca 0.04 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1d2c n GLY 127 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d2c n ASP 128 N 10.29 1.19 0.00 1.61 8.00 -1.26 -5.06 116.55 131.33 1d2c n ASP 128 Ca 0.00 -0.96 0.00 0.00 0.71 0.00 0.00 54.79 54.54 1d2c n ASP 128 Cb 0.00 0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 1d2c n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d2c n GLY 129 N 1.39 -0.36 3.42 0.44 0.00 0.13 -4.48 105.19 105.73 1d2c n GLY 129 Ca 0.10 -2.24 -0.21 0.00 0.00 0.00 0.00 46.02 43.68 1d2c n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1d2c s PHE 130 N -0.01 1.92 -0.06 1.61 0.40 0.22 -4.70 117.98 117.35 1d2c s PHE 130 Ca 0.00 -0.69 -0.05 0.00 -0.60 0.00 0.00 56.93 55.59 1d2c s PHE 130 Cb 0.00 -1.07 -0.03 0.00 0.51 0.00 0.00 43.02 42.43 1d2c s PHE 130 CO 0.00 0.28 0.22 -0.44 0.70 0.00 0.00 175.22 175.98 1d2c h ASP 131 N 2.31 -0.14 -3.93 1.36 3.45 -1.51 0.02 116.42 117.98 1d2c h ASP 131 Ca -0.40 0.00 -0.63 0.00 0.43 0.00 0.00 57.03 56.43 1d2c h ASP 131 Cb 1.23 0.04 -0.31 0.00 -0.56 0.00 0.00 39.33 39.73 1d2c h ASP 131 CO 0.66 0.24 -0.86 0.00 -1.57 0.00 0.00 179.24 177.71 1d2c s ALA 132 N -3.06 1.89 -0.10 3.45 0.00 -1.23 0.32 121.76 123.04 1d2c s ALA 132 Ca -0.02 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.06 1d2c s ALA 132 Cb 0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 1d2c s ALA 132 CO 0.07 0.35 -0.12 0.08 0.00 0.00 0.00 175.76 176.14 1d2c s VAL 133 N -0.05 3.18 -0.01 0.00 1.01 -0.53 -1.48 120.40 122.51 1d2c s VAL 133 Ca -0.04 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.33 1d2c s VAL 133 Cb -0.13 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1d2c s VAL 133 CO 0.03 0.55 -0.13 0.27 0.00 0.00 0.00 175.10 175.83 1d2c s ILE 134 N -0.16 1.02 -0.41 2.22 -4.36 -0.00 -0.89 121.20 118.62 1d2c s ILE 134 Ca -0.00 -0.54 0.05 0.00 -0.26 0.00 0.00 60.65 59.89 1d2c s ILE 134 Cb -0.13 -0.86 0.18 0.00 1.25 0.00 0.00 42.46 42.90 1d2c s ILE 134 CO 0.03 0.29 0.37 0.00 0.24 0.00 0.00 174.94 175.87 1d2c s LEU 136 N -0.14 3.55 0.00 0.00 2.01 -1.26 -2.49 118.68 120.36 1d2c s LEU 136 Ca 0.33 -0.56 0.00 0.00 0.01 0.00 0.00 54.13 53.91 1d2c s LEU 136 Cb 0.06 -2.21 0.00 0.00 0.01 0.00 0.00 46.19 44.05 1d2c s LEU 136 CO -0.19 -0.47 0.00 0.61 1.01 0.00 0.00 176.35 177.31 1d2c n GLY 137 N -1.46 0.90 3.01 -3.19 0.00 -1.26 -4.01 105.19 99.18 1d2c n GLY 137 Ca 0.00 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 1d2c n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d2c n ASN 138 N 1.11 -5.23 0.10 1.61 5.15 -1.26 -4.89 115.26 111.86 1d2c n ASN 138 Ca 0.00 -0.25 -0.03 0.00 -0.60 0.00 0.00 54.58 53.70 1d2c n ASN 138 Cb 0.16 -4.27 0.02 0.00 -0.53 0.00 0.00 39.78 35.16 1d2c n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1d2c h SER 139 N -1.03 0.00 0.40 1.20 0.02 -1.81 -3.21 113.55 109.12 1d2c h SER 139 Ca -0.48 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.42 1d2c h SER 139 Cb 1.33 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.86 1d2c h SER 139 CO 0.54 0.77 -0.24 0.15 -1.14 0.00 0.00 176.83 176.91 1d2c h PHE 140 N 0.00 0.00 0.00 3.45 3.57 -1.85 -2.67 116.94 119.44 1d2c h PHE 140 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1d2c h PHE 140 Cb 1.45 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.19 1d2c h PHE 140 CO 0.00 0.24 0.00 0.00 -2.23 0.00 0.00 178.31 176.32 1d2c n ALA 141 N -2.38 1.20 0.07 2.41 0.00 -1.21 -2.40 120.51 118.20 1d2c n ALA 141 Ca -0.02 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1d2c n ALA 141 Cb 0.33 -1.11 0.04 0.00 0.00 0.00 0.00 19.45 18.71 1d2c n ALA 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1d2c h HIS 142 N 0.00 0.44 -2.05 0.00 3.86 -1.67 0.15 115.15 115.87 1d2c h HIS 142 Ca 0.00 -0.20 -0.54 0.00 -1.16 0.00 0.00 60.37 58.47 1d2c h HIS 142 Cb 0.08 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.47 1d2c h HIS 142 CO 0.00 0.95 1.46 -1.17 0.86 0.00 0.00 177.93 180.03 1d2c s LEU 143 N -7.82 3.43 1.06 2.43 2.96 -1.01 -4.81 118.68 114.92 1d2c s LEU 143 Ca -0.05 1.36 -0.15 0.00 -0.22 0.00 0.00 54.13 55.08 1d2c s LEU 143 Cb 0.11 -3.14 0.22 0.00 0.50 0.00 0.00 46.19 43.88 1d2c s LEU 143 CO 0.83 -2.19 1.11 -2.16 -1.32 0.00 0.00 176.35 172.62 1d2c s PRO 144 N 6.77 -0.11 -0.52 0.98 0.04 -1.26 -4.71 135.00 136.20 1d2c s PRO 144 Ca 0.91 0.23 -0.00 0.00 0.04 0.00 0.00 61.00 62.18 1d2c s PRO 144 Cb -0.24 -1.70 0.14 0.00 0.04 0.00 0.00 34.50 32.74 1d2c s PRO 144 CO 0.31 -3.03 0.30 0.34 0.04 0.00 0.00 177.00 174.96 1d2c s ASP 145 N -3.74 4.96 0.08 6.66 3.68 -1.26 -4.83 116.67 122.22 1d2c s ASP 145 Ca 0.68 -2.64 -0.07 0.00 2.13 0.00 0.00 52.55 52.64 1d2c s ASP 145 Cb -0.14 -1.77 -0.25 0.00 -1.45 0.00 0.00 42.92 39.30 1d2c s ASP 145 CO 0.56 -0.37 1.16 0.28 0.13 0.00 0.00 175.17 176.93 1d2c h SER 146 N 7.18 0.57 0.31 -0.34 0.02 -1.95 -3.34 113.55 115.99 1d2c h SER 146 Ca -0.06 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1d2c h SER 146 Cb 0.96 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1d2c h SER 146 CO 0.68 1.41 0.00 0.29 -1.14 0.00 0.00 176.83 178.07 1d2c n LYS 147 N -3.64 0.64 0.00 3.45 5.02 -1.26 -4.94 118.16 117.44 1d2c n LYS 147 Ca -0.10 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1d2c n LYS 147 Cb 0.99 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.50 1d2c n LYS 147 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1d2c n GLY 148 N 1.05 2.48 3.88 0.72 0.00 -1.26 -4.95 105.19 107.11 1d2c n GLY 148 Ca 0.18 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 1d2c n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1d2c s ASP 149 N 0.00 4.27 -0.57 1.61 3.84 -1.26 -4.93 116.67 119.63 1d2c s ASP 149 Ca 0.00 0.79 -0.02 0.00 -0.00 0.00 0.00 52.55 53.33 1d2c s ASP 149 Cb 0.00 -1.28 0.34 0.00 -1.38 0.00 0.00 42.92 40.59 1d2c s ASP 149 CO 0.00 -2.06 2.09 0.00 -0.00 0.00 0.00 175.17 175.21 1d2c n GLN 150 N -3.42 2.41 0.24 2.11 6.02 -1.26 -4.64 117.38 118.83 1d2c n GLN 150 Ca 0.08 -2.72 -0.16 0.00 -0.01 0.00 0.00 57.00 54.19 1d2c n GLN 150 Cb 0.61 -2.07 -0.08 0.00 1.02 0.00 0.00 30.24 29.71 1d2c n GLN 150 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1d2c h SER 151 N 2.03 -1.13 -0.99 1.08 4.64 -1.95 0.37 113.55 117.60 1d2c h SER 151 Ca 0.49 0.10 0.19 0.00 -0.47 0.00 0.00 61.79 62.10 1d2c h SER 151 Cb 0.75 0.38 -0.10 0.00 -0.31 0.00 0.00 62.40 63.12 1d2c h SER 151 CO 1.27 -0.55 0.61 -0.33 -0.87 0.00 0.00 176.83 176.96 1d2c h GLU 152 N -0.82 0.71 0.07 4.77 5.08 -1.94 0.81 114.58 123.27 1d2c h GLU 152 Ca -0.03 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1d2c h GLU 152 Cb 0.74 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1d2c h GLU 152 CO -0.08 0.47 -0.03 0.45 -1.00 0.00 0.00 179.01 178.81 1d2c h HIS 153 N 0.73 -0.09 -0.14 4.33 3.86 -1.63 -1.72 115.15 120.49 1d2c h HIS 153 Ca 0.56 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.75 1d2c h HIS 153 Cb 0.91 0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 1d2c h HIS 153 CO -0.00 0.02 -0.00 0.00 0.86 0.00 0.00 177.93 178.80 1d2c h ARG 154 N -0.18 0.20 -0.18 2.45 3.08 0.85 -2.20 114.38 118.41 1d2c h ARG 154 Ca -0.01 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1d2c h ARG 154 Cb 0.15 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1d2c h ARG 154 CO 0.02 0.23 -0.14 1.25 -1.07 0.00 0.00 179.97 180.26 1d2c h LEU 155 N 0.20 0.44 -0.49 3.04 5.85 -0.56 -2.08 115.31 121.71 1d2c h LEU 155 Ca 0.05 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.28 1d2c h LEU 155 Cb 0.15 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1d2c h LEU 155 CO 0.00 0.80 0.17 0.00 -0.34 0.00 0.00 178.44 179.07 1d2c h ALA 156 N 0.65 0.64 -0.21 1.25 0.00 -1.01 -1.94 119.26 118.63 1d2c h ALA 156 Ca 0.03 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1d2c h ALA 156 Cb 0.66 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1d2c h ALA 156 CO 0.04 0.27 -0.20 -0.07 0.00 0.00 0.00 179.25 179.29 1d2c h LEU 157 N 0.65 0.37 -0.15 0.00 4.07 -1.45 0.76 115.31 119.56 1d2c h LEU 157 Ca 0.16 -0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.96 1d2c h LEU 157 Cb 0.24 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 41.88 1d2c h LEU 157 CO -0.01 0.58 -0.12 0.50 -1.08 0.00 0.00 178.44 178.31 1d2c h LYS 158 N 0.34 0.35 -0.66 1.13 3.64 -1.12 -0.54 116.57 119.71 1d2c h LYS 158 Ca 0.06 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1d2c h LYS 158 Cb 0.55 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1d2c h LYS 158 CO 0.04 0.71 0.30 -0.91 -2.27 0.00 0.00 179.45 177.31 1d2c h ASN 159 N -0.01 0.88 -0.57 4.20 -0.26 -1.18 -0.99 115.58 117.65 1d2c h ASN 159 Ca 0.03 -0.15 -0.01 0.00 -0.56 0.00 0.00 56.30 55.61 1d2c h ASN 159 Cb 0.63 -0.23 -0.03 0.00 -1.06 0.00 0.00 38.32 37.64 1d2c h ASN 159 CO 0.03 0.79 0.31 0.40 -1.06 0.00 0.00 177.43 177.90 1d2c h ILE 160 N 0.92 1.18 0.00 2.81 2.04 -0.77 -1.05 117.51 122.65 1d2c h ILE 160 Ca 0.22 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 1d2c h ILE 160 Cb 0.15 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 1d2c h ILE 160 CO -0.02 0.20 -0.17 0.00 0.00 0.00 0.00 178.15 178.15 1d2c h ALA 161 N 1.14 1.52 -0.67 1.87 0.00 -0.70 -2.93 119.26 119.50 1d2c h ALA 161 Ca 0.20 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.04 1d2c h ALA 161 Cb 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1d2c h ALA 161 CO -0.03 0.21 0.44 0.77 0.00 0.00 0.00 179.25 180.64 1d2c h SER 162 N 0.00 0.53 0.83 0.00 0.02 0.18 -2.09 113.55 113.02 1d2c h SER 162 Ca -0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1d2c h SER 162 Cb 0.34 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1d2c h SER 162 CO 0.02 0.33 0.00 0.23 -1.14 0.00 0.00 176.83 176.27 1d2c n MET 163 N -4.48 0.08 -2.86 3.45 2.81 -1.10 -4.74 117.12 110.27 1d2c n MET 163 Ca 0.10 0.04 -0.42 0.00 -1.81 0.00 0.00 57.70 55.61 1d2c n MET 163 Cb 0.29 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.26 1d2c n MET 163 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1d2c s VAL 164 N -2.91 4.73 0.59 2.03 1.01 -0.79 0.73 120.40 125.79 1d2c s VAL 164 Ca 0.16 1.38 -0.18 0.00 0.00 0.00 0.00 61.98 63.34 1d2c s VAL 164 Cb 0.18 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1d2c s VAL 164 CO 0.47 -0.27 1.11 -0.60 0.00 0.00 0.00 175.10 175.81 1d2c s ARG 165 N 3.10 3.17 0.22 2.72 3.52 -0.01 -4.71 118.95 126.96 1d2c s ARG 165 Ca 0.36 1.49 -0.32 0.00 -0.13 0.00 0.00 55.73 57.13 1d2c s ARG 165 Cb -0.14 -1.99 -0.14 0.00 -1.56 0.00 0.00 34.95 31.12 1d2c s ARG 165 CO 0.12 -0.98 1.34 -2.30 -0.81 0.00 0.00 175.30 172.68 1d2c n PRO 166 N -1.75 1.80 -0.99 5.12 -0.02 -1.26 0.10 135.00 138.00 1d2c n PRO 166 Ca 0.11 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1d2c n PRO 166 Cb 0.52 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1d2c n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2c n GLY 167 N 2.11 0.95 3.02 -1.23 0.00 0.25 -4.99 105.19 105.30 1d2c n GLY 167 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1d2c n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d2c n GLY 168 N -2.04 -0.62 3.37 -0.02 0.00 0.28 -4.70 105.19 101.47 1d2c n GLY 168 Ca 0.00 -1.82 -0.22 0.00 0.00 0.00 0.00 46.02 43.98 1d2c n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d2c s LEU 169 N 0.00 2.50 -0.09 0.99 1.02 0.15 -0.24 118.68 123.01 1d2c s LEU 169 Ca 0.56 -0.94 -0.02 0.00 0.02 0.00 0.00 54.13 53.75 1d2c s LEU 169 Cb -0.02 -0.87 0.04 0.00 0.02 0.00 0.00 46.19 45.36 1d2c s LEU 169 CO 0.39 -0.04 0.04 -0.22 0.02 0.00 0.00 176.35 176.53 1d2c s LEU 170 N -3.01 0.48 -0.35 1.79 2.96 0.24 -1.46 118.68 119.34 1d2c s LEU 170 Ca 0.21 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1d2c s LEU 170 Cb -0.04 -0.33 0.09 0.00 0.50 0.00 0.00 46.19 46.40 1d2c s LEU 170 CO 0.09 -0.24 0.07 -0.69 -1.32 0.00 0.00 176.35 174.25 1d2c s VAL 171 N 2.05 2.75 -0.00 1.68 1.01 -0.07 -0.90 120.40 126.91 1d2c s VAL 171 Ca 0.04 -1.98 0.04 0.00 0.00 0.00 0.00 61.98 60.08 1d2c s VAL 171 Cb -0.13 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 1d2c s VAL 171 CO -0.05 -0.47 -0.12 -0.51 0.00 0.00 0.00 175.10 173.95 1d2c s ILE 172 N 1.07 0.94 0.38 2.22 2.07 -0.58 -0.37 121.20 126.93 1d2c s ILE 172 Ca 0.05 -0.58 0.04 0.00 -1.41 0.00 0.00 60.65 58.74 1d2c s ILE 172 Cb -0.21 -0.80 -0.04 0.00 0.13 0.00 0.00 42.46 41.55 1d2c s ILE 172 CO -0.05 0.21 0.10 1.51 -1.91 0.00 0.00 174.94 174.80 1d2c s ASP 173 N -0.42 2.61 0.04 4.50 3.84 -1.04 -0.58 116.67 125.62 1d2c s ASP 173 Ca 0.04 -1.57 -0.22 0.00 -0.00 0.00 0.00 52.55 50.80 1d2c s ASP 173 Cb -0.05 0.31 0.05 0.00 -1.38 0.00 0.00 42.92 41.85 1d2c s ASP 173 CO -0.00 -0.82 0.50 -1.38 -0.00 0.00 0.00 175.17 173.47 1d2c s HIS 174 N -3.26 -0.40 0.84 2.11 -3.43 -0.70 -4.41 115.29 106.05 1d2c s HIS 174 Ca 0.28 0.45 -0.12 0.00 -0.80 0.00 0.00 55.06 54.87 1d2c s HIS 174 Cb 0.05 0.31 0.10 0.00 -1.43 0.00 0.00 32.58 31.60 1d2c s HIS 174 CO 0.14 -0.62 1.10 0.50 -2.00 0.00 0.00 174.74 173.86 1d2c s ARG 175 N -2.34 1.72 -1.26 -0.38 6.06 -1.26 -0.40 118.95 121.09 1d2c s ARG 175 Ca -0.06 0.68 -0.19 0.00 -2.50 0.00 0.00 55.73 53.66 1d2c s ARG 175 Cb -0.01 -1.87 0.07 0.00 0.06 0.00 0.00 34.95 33.20 1d2c s ARG 175 CO -0.01 -1.89 1.69 1.21 -2.50 0.00 0.00 175.30 173.80 1d2c s ASN 176 N -3.74 6.79 0.10 -2.12 3.04 0.26 -4.65 114.94 114.62 1d2c s ASN 176 Ca 0.62 -2.30 0.24 0.00 0.04 0.00 0.00 52.86 51.46 1d2c s ASN 176 Cb -0.16 -2.58 0.95 0.00 -1.54 0.00 0.00 41.25 37.92 1d2c s ASN 176 CO 0.55 -1.22 1.75 -1.22 -3.04 0.00 0.00 177.10 173.93 1d2c n TYR 177 N 8.45 0.41 -0.11 0.43 4.01 -1.26 -2.27 117.16 126.81 1d2c n TYR 177 Ca 0.46 0.13 -0.07 0.00 -0.16 0.00 0.00 57.90 58.27 1d2c n TYR 177 Cb 0.47 -0.72 0.10 0.00 -0.31 0.00 0.00 39.34 38.89 1d2c n TYR 177 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1d2c h ASP 178 N 0.00 0.82 0.19 7.72 3.32 -1.85 0.23 116.42 126.86 1d2c h ASP 178 Ca 0.00 -0.25 -0.34 0.00 0.02 0.00 0.00 57.03 56.45 1d2c h ASP 178 Cb 0.49 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.83 1d2c h ASP 178 CO 0.00 0.95 -1.69 0.22 -1.72 0.00 0.00 179.24 177.00 1d2c h TYR 179 N 0.74 0.74 -0.56 4.55 5.03 -1.89 -3.19 116.97 122.39 1d2c h TYR 179 Ca 0.12 -0.54 -0.01 0.00 2.58 0.00 0.00 58.73 60.89 1d2c h TYR 179 Cb 0.61 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.84 1d2c h TYR 179 CO 0.03 1.66 0.32 0.82 -1.32 0.00 0.00 178.16 179.67 1d2c h ILE 180 N 0.08 1.18 -0.19 1.81 2.04 -1.41 -1.40 117.51 119.61 1d2c h ILE 180 Ca -0.33 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 1d2c h ILE 180 Cb 2.08 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.59 1d2c h ILE 180 CO 0.18 0.19 -0.03 -0.07 0.00 0.00 0.00 178.15 178.42 1d2c h LEU 181 N 0.75 0.26 0.00 1.44 4.07 -1.07 0.70 115.31 121.47 1d2c h LEU 181 Ca 0.20 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.12 1d2c h LEU 181 Cb 0.02 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.69 1d2c h LEU 181 CO -0.03 0.34 -0.56 -1.20 -1.08 0.00 0.00 178.44 175.90 1d2c n SER 182 N -4.35 0.64 -0.05 -0.43 7.64 -0.95 -4.10 113.62 112.02 1d2c n SER 182 Ca -0.00 0.08 -0.04 0.00 1.01 0.00 0.00 58.87 59.92 1d2c n SER 182 Cb 0.20 0.12 -0.09 0.00 -1.01 0.00 0.00 64.21 63.44 1d2c n SER 182 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1d2c n THR 183 N -1.98 0.67 -0.97 0.44 -1.04 -0.57 -4.98 114.28 105.85 1d2c n THR 183 Ca 0.04 -0.44 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 1d2c n THR 183 Cb 0.42 -0.63 0.00 0.00 -1.82 0.00 0.00 70.33 68.30 1d2c n THR 183 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1d2c n GLY 184 N 2.29 0.97 3.09 3.41 0.00 0.24 -5.00 105.19 110.20 1d2c n GLY 184 Ca -0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1d2c n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2c s ALA 186 N 0.33 3.46 -0.00 0.00 0.00 -1.26 -4.55 121.76 119.73 1d2c s ALA 186 Ca -0.10 -2.92 -0.38 0.00 0.00 0.00 0.00 51.96 48.56 1d2c s ALA 186 Cb -0.14 -2.68 -0.17 0.00 0.00 0.00 0.00 23.12 20.13 1d2c s ALA 186 CO 0.03 -1.99 1.36 -0.35 0.00 0.00 0.00 175.76 174.82 1d2c n PRO 187 N 4.11 0.91 -2.15 0.00 -0.04 -1.26 -4.89 135.00 131.69 1d2c n PRO 187 Ca 0.02 0.33 -0.27 0.00 -0.04 0.00 0.00 63.50 63.55 1d2c n PRO 187 Cb 0.40 -1.95 0.08 0.00 -0.04 0.00 0.00 33.50 32.00 1d2c n PRO 187 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1d2c s PRO 188 N 0.94 2.00 0.00 0.54 0.04 -1.26 -3.87 135.00 133.38 1d2c s PRO 188 Ca 0.88 -0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.67 1d2c s PRO 188 Cb -1.05 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 31.38 1d2c s PRO 188 CO 0.53 -1.41 0.00 0.41 0.04 0.00 0.00 177.00 176.56 1d2c n GLY 189 N -3.06 0.06 3.45 0.56 0.00 -1.26 -4.86 105.19 100.07 1d2c n GLY 189 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 1d2c n GLY 189 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2c s LYS 190 N -0.71 3.42 0.07 1.61 1.02 -1.25 -4.87 119.74 119.03 1d2c s LYS 190 Ca 0.00 -1.46 0.02 0.00 0.02 0.00 0.00 55.97 54.55 1d2c s LYS 190 Cb 0.00 -4.68 -0.03 0.00 -0.52 0.00 0.00 37.83 32.59 1d2c s LYS 190 CO 0.00 -1.78 -0.08 1.21 -0.92 0.00 0.00 175.35 173.79 1d2c s ASN 191 N 3.66 1.01 -0.00 2.83 3.84 -1.26 -5.04 114.94 119.98 1d2c s ASN 191 Ca 0.28 -0.74 0.02 0.00 0.21 0.00 0.00 52.86 52.63 1d2c s ASN 191 Cb -0.09 0.06 -0.02 0.00 -0.55 0.00 0.00 41.25 40.64 1d2c s ASN 191 CO -0.03 -0.30 0.03 2.30 -2.79 0.00 0.00 177.10 176.31 1d2c n ILE 192 N 0.84 0.02 0.06 -5.21 -5.35 -1.26 -4.76 119.36 103.71 1d2c n ILE 192 Ca -0.18 -0.04 -0.23 0.00 -0.27 0.00 0.00 62.75 62.03 1d2c n ILE 192 Cb 0.57 0.18 -0.15 0.00 -1.74 0.00 0.00 39.64 38.50 1d2c n ILE 192 CO 0.00 0.00 0.00 1.88 -1.76 0.00 0.00 176.55 176.67 1d2c h TYR 193 N 0.00 0.66 -3.67 4.28 -1.99 -1.96 -3.40 116.97 110.89 1d2c h TYR 193 Ca -0.01 -0.48 -0.29 0.00 2.00 0.00 0.00 58.73 59.95 1d2c h TYR 193 Cb 0.28 -0.03 -0.30 0.00 2.00 0.00 0.00 36.73 38.68 1d2c h TYR 193 CO 0.00 1.60 -0.73 0.71 -0.00 0.00 0.00 178.16 179.74 1d2c s TYR 194 N -2.54 0.17 -0.16 4.88 1.51 -1.26 -1.30 117.35 118.65 1d2c s TYR 194 Ca -0.16 0.01 -0.29 0.00 -1.01 0.00 0.00 57.07 55.61 1d2c s TYR 194 Cb 0.05 -0.19 -0.01 0.00 -0.11 0.00 0.00 41.96 41.69 1d2c s TYR 194 CO 0.84 -0.05 1.18 0.21 -1.11 0.00 0.00 175.55 176.62 1d2c s LYS 195 N 0.39 4.27 -0.21 -0.62 2.20 -0.33 -4.74 119.74 120.69 1d2c s LYS 195 Ca -0.04 1.57 -0.21 0.00 -0.36 0.00 0.00 55.97 56.93 1d2c s LYS 195 Cb -0.06 -3.68 -0.02 0.00 -1.51 0.00 0.00 37.83 32.56 1d2c s LYS 195 CO -0.01 -0.62 0.65 -1.12 -0.36 0.00 0.00 175.35 173.90 1d2c s SER 196 N 1.64 6.68 0.00 1.43 0.01 -1.26 -4.40 113.70 117.80 1d2c s SER 196 Ca 0.52 0.83 0.23 0.00 1.31 0.00 0.00 55.95 58.84 1d2c s SER 196 Cb -0.20 -2.36 0.17 0.00 0.21 0.00 0.00 66.02 63.84 1d2c s SER 196 CO 0.14 -0.32 1.18 0.47 0.41 0.00 0.00 173.24 175.12 1d2c n ASP 197 N 5.30 0.73 -4.88 2.44 8.00 -1.26 -4.90 116.55 121.98 1d2c n ASP 197 Ca -0.00 -0.59 -0.31 0.00 0.71 0.00 0.00 54.79 54.60 1d2c n ASP 197 Cb 0.49 0.59 -0.05 0.00 -0.02 0.00 0.00 41.12 42.14 1d2c n ASP 197 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1d2c s LEU 198 N -3.01 4.13 -0.10 0.64 2.96 -1.26 -5.08 118.68 116.95 1d2c s LEU 198 Ca 0.10 0.91 -0.02 0.00 -0.22 0.00 0.00 54.13 54.89 1d2c s LEU 198 Cb 0.17 -3.69 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 1d2c s LEU 198 CO 0.78 -0.11 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.80 1d2c s THR 199 N -1.89 4.24 0.14 3.68 2.01 -1.26 -4.99 115.64 117.57 1d2c s THR 199 Ca 0.47 -0.27 -0.17 0.00 0.31 0.00 0.00 61.69 62.04 1d2c s THR 199 Cb -0.11 -2.80 0.04 0.00 0.01 0.00 0.00 72.50 69.64 1d2c s THR 199 CO 0.23 0.58 0.44 -1.59 -0.69 0.00 0.00 174.62 173.59 1d2c s LYS 200 N -0.63 1.15 0.16 4.92 -2.85 -1.26 -1.23 119.74 120.00 1d2c s LYS 200 Ca 0.10 -0.73 0.10 0.00 -1.00 0.00 0.00 55.97 54.43 1d2c s LYS 200 Cb -0.12 0.49 -0.04 0.00 -2.06 0.00 0.00 37.83 36.10 1d2c s LYS 200 CO 0.02 -0.46 -0.16 0.34 0.10 0.00 0.00 175.35 175.19 1d2c s ASP 201 N -2.82 3.92 -0.09 0.03 3.68 -1.07 -4.83 116.67 115.49 1d2c s ASP 201 Ca 0.04 -0.64 -0.01 0.00 2.13 0.00 0.00 52.55 54.07 1d2c s ASP 201 Cb 0.01 -0.54 0.03 0.00 -1.45 0.00 0.00 42.92 40.96 1d2c s ASP 201 CO -0.10 0.13 -0.04 -0.63 0.13 0.00 0.00 175.17 174.66 1d2c s ILE 202 N -1.50 0.73 -0.30 4.11 1.01 -1.26 -2.43 121.20 121.56 1d2c s ILE 202 Ca 0.21 -0.12 -0.13 0.00 0.00 0.00 0.00 60.65 60.62 1d2c s ILE 202 Cb -0.09 -0.80 -0.03 0.00 0.01 0.00 0.00 42.46 41.54 1d2c s ILE 202 CO 0.12 0.31 0.25 -0.89 0.00 0.00 0.00 174.94 174.74 1d2c s THR 203 N 1.69 5.26 -0.27 2.92 2.01 -1.01 -4.87 115.64 121.38 1d2c s THR 203 Ca 0.03 0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.01 1d2c s THR 203 Cb -0.13 -3.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 1d2c s THR 203 CO -0.06 0.12 0.22 -0.89 -0.69 0.00 0.00 174.62 173.32 1d2c s THR 204 N 1.83 5.30 -0.10 -0.82 2.01 -1.26 -1.89 115.64 120.71 1d2c s THR 204 Ca 0.09 0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.35 1d2c s THR 204 Cb -0.16 -3.56 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 1d2c s THR 204 CO 0.11 0.26 -0.15 -0.44 -0.69 0.00 0.00 174.62 173.70 1d2c s SER 205 N 1.57 3.87 -0.12 3.53 0.01 0.22 -4.90 113.70 117.88 1d2c s SER 205 Ca 0.09 -0.32 0.03 0.00 1.31 0.00 0.00 55.95 57.05 1d2c s SER 205 Cb -0.15 -1.32 0.01 0.00 0.21 0.00 0.00 66.02 64.76 1d2c s SER 205 CO 0.09 0.22 -0.21 -0.69 0.41 0.00 0.00 173.24 173.06 1d2c s VAL 206 N 0.01 1.96 -0.28 3.43 1.01 -1.26 0.24 120.40 125.49 1d2c s VAL 206 Ca -0.05 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.91 1d2c s VAL 206 Cb -0.14 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1d2c s VAL 206 CO 0.04 0.53 0.14 -0.22 0.00 0.00 0.00 175.10 175.60 1d2c s LEU 207 N 0.71 3.90 -0.38 3.92 2.96 0.03 -5.01 118.68 124.82 1d2c s LEU 207 Ca -0.10 -0.28 -0.07 0.00 -0.22 0.00 0.00 54.13 53.46 1d2c s LEU 207 Cb -0.16 -2.02 0.06 0.00 0.50 0.00 0.00 46.19 44.57 1d2c s LEU 207 CO 0.01 -0.11 0.17 -0.89 -1.32 0.00 0.00 176.35 174.22 1d2c s THR 208 N 1.66 3.86 0.00 3.68 2.01 -1.26 -1.11 115.64 124.48 1d2c s THR 208 Ca 0.06 -1.35 0.00 0.00 0.31 0.00 0.00 61.69 60.71 1d2c s THR 208 Cb -0.16 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 69.04 1d2c s THR 208 CO 0.07 -0.36 0.00 0.52 -0.69 0.00 0.00 174.62 174.16 1d2c n VAL 209 N 4.82 0.00 0.00 3.82 0.31 -1.15 -4.67 118.33 121.46 1d2c n VAL 209 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1d2c n VAL 209 Cb 0.44 -0.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 1d2c n VAL 209 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1d2c n ASN 210 N -0.69 0.00 -0.00 4.52 4.13 -1.26 -3.45 115.26 118.50 1d2c n ASN 210 Ca 0.00 0.14 0.00 0.00 1.68 0.00 0.00 54.58 56.40 1d2c n ASN 210 Cb 0.00 -0.07 0.00 0.00 -1.54 0.00 0.00 39.78 38.17 1d2c n ASN 210 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1d2c n ASN 211 N -2.13 0.00 -4.34 6.41 4.05 -1.26 -5.08 115.26 112.92 1d2c n ASN 211 Ca 0.00 -1.00 -0.34 0.00 0.45 0.00 0.00 54.58 53.69 1d2c n ASN 211 Cb 0.00 -0.00 -0.14 0.00 1.23 0.00 0.00 39.78 40.87 1d2c n ASN 211 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1d2c s LYS 212 N 0.00 3.38 -0.09 1.20 0.00 -1.22 -5.06 119.74 117.96 1d2c s LYS 212 Ca 0.00 -0.65 -0.40 0.00 0.00 0.00 0.00 55.97 54.92 1d2c s LYS 212 Cb 0.00 -2.85 -0.19 0.00 0.00 0.00 0.00 37.83 34.79 1d2c s LYS 212 CO 0.00 -0.02 1.28 0.00 0.00 0.00 0.00 175.35 176.61 1d2c n ALA 213 N 4.24 -2.35 0.00 0.59 0.00 -1.26 -2.95 120.51 118.77 1d2c n ALA 213 Ca -0.18 0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1d2c n ALA 213 Cb 0.52 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1d2c n ALA 213 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1d2c n HIS 214 N 2.48 0.00 -3.61 0.00 -0.00 -0.27 -4.86 115.22 108.95 1d2c n HIS 214 Ca 0.22 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.32 1d2c n HIS 214 Cb 0.09 0.00 -0.06 0.00 -0.12 0.00 0.00 29.99 29.90 1d2c n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1d2c s MET 215 N -1.94 0.41 -0.17 1.57 0.00 -1.05 -4.68 119.30 113.45 1d2c s MET 215 Ca 0.00 0.22 0.01 0.00 0.00 0.00 0.00 55.69 55.92 1d2c s MET 215 Cb 0.00 0.20 0.02 0.00 0.00 0.00 0.00 34.83 35.05 1d2c s MET 215 CO 0.00 -0.10 -0.19 0.08 0.00 0.00 0.00 175.02 174.81 1d2c s VAL 216 N -0.65 1.92 -0.13 10.11 1.01 0.36 -0.79 120.40 132.24 1d2c s VAL 216 Ca 0.02 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 1d2c s VAL 216 Cb -0.02 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 1d2c s VAL 216 CO -0.04 0.52 -0.05 -0.89 0.00 0.00 0.00 175.10 174.64 1d2c s THR 217 N 1.30 3.79 -0.08 3.92 2.01 0.14 -0.48 115.64 126.24 1d2c s THR 217 Ca 0.04 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.65 1d2c s THR 217 Cb -0.13 -2.63 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 1d2c s THR 217 CO -0.11 0.52 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.44 1d2c s LEU 218 N 0.07 2.73 -0.26 4.42 1.02 0.04 -0.61 118.68 126.09 1d2c s LEU 218 Ca -0.01 -0.25 -0.03 0.00 0.02 0.00 0.00 54.13 53.86 1d2c s LEU 218 Cb -0.14 -1.57 0.02 0.00 0.02 0.00 0.00 46.19 44.52 1d2c s LEU 218 CO 0.03 0.28 -0.02 -1.81 0.02 0.00 0.00 176.35 174.84 1d2c s ASP 219 N -0.32 4.53 -0.34 2.29 1.01 -0.79 -1.73 116.67 121.30 1d2c s ASP 219 Ca 0.03 -0.79 -0.14 0.00 0.71 0.00 0.00 52.55 52.35 1d2c s ASP 219 Cb -0.13 -1.73 -0.01 0.00 1.01 0.00 0.00 42.92 42.06 1d2c s ASP 219 CO 0.02 -0.14 0.30 -0.31 0.21 0.00 0.00 175.17 175.26 1d2c s TYR 220 N 1.38 3.22 -0.70 4.23 1.51 0.69 -2.39 117.35 125.30 1d2c s TYR 220 Ca 0.01 -0.13 -0.16 0.00 -1.01 0.00 0.00 57.07 55.79 1d2c s TYR 220 Cb -0.17 -2.58 0.17 0.00 -0.11 0.00 0.00 41.96 39.27 1d2c s TYR 220 CO -0.03 -0.40 0.67 0.99 -1.11 0.00 0.00 175.55 175.68 1d2c s THR 221 N 1.87 5.33 0.07 -0.71 2.01 -1.02 -1.81 115.64 121.39 1d2c s THR 221 Ca 0.09 -1.90 -0.25 0.00 0.31 0.00 0.00 61.69 59.94 1d2c s THR 221 Cb -0.17 -4.44 -0.06 0.00 0.01 0.00 0.00 72.50 67.84 1d2c s THR 221 CO 0.11 -1.00 0.77 -0.69 -0.69 0.00 0.00 174.62 173.12 1d2c s VAL 222 N 1.11 4.65 -0.50 3.82 1.01 0.03 -2.61 120.40 127.90 1d2c s VAL 222 Ca 0.12 1.66 -0.22 0.00 0.00 0.00 0.00 61.98 63.54 1d2c s VAL 222 Cb -0.19 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.10 1d2c s VAL 222 CO -0.03 0.40 0.77 -1.58 0.00 0.00 0.00 175.10 174.66 1d2c s GLN 223 N -0.29 3.28 -0.34 2.72 0.74 -0.36 -1.81 119.66 123.59 1d2c s GLN 223 Ca 0.38 -0.43 -0.22 0.00 0.05 0.00 0.00 55.36 55.14 1d2c s GLN 223 Cb -0.21 -4.03 0.00 0.00 1.10 0.00 0.00 33.01 29.87 1d2c s GLN 223 CO 0.24 -1.27 0.72 0.54 -0.55 0.00 0.00 175.29 174.97 1d2c s VAL 224 N 3.27 4.83 0.02 1.34 0.11 0.19 -4.49 120.40 125.66 1d2c s VAL 224 Ca 0.25 0.87 -0.04 0.00 -2.93 0.00 0.00 61.98 60.12 1d2c s VAL 224 Cb -0.15 -4.12 -0.01 0.00 -1.53 0.00 0.00 36.38 30.57 1d2c s VAL 224 CO 0.18 -0.31 0.22 -2.65 -3.33 0.00 0.00 175.10 169.21 1d2c n PRO 225 N 6.17 -0.06 -2.60 1.54 -0.02 -1.26 0.21 135.00 138.98 1d2c n PRO 225 Ca 0.01 0.21 -0.17 0.00 -2.02 0.00 0.00 63.50 61.54 1d2c n PRO 225 Cb 0.48 -0.31 0.02 0.00 -0.02 0.00 0.00 33.50 33.67 1d2c n PRO 225 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2c n GLY 226 N -1.04 3.46 1.47 -1.23 0.00 -1.26 -3.37 105.19 103.22 1d2c n GLY 226 Ca 0.00 -1.93 0.08 0.00 0.00 0.00 0.00 46.02 44.18 1d2c n GLY 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2c n ALA 227 N -0.23 3.31 -2.69 4.61 0.00 -1.22 -4.94 120.51 119.35 1d2c n ALA 227 Ca 0.22 -1.87 0.00 0.00 0.00 0.00 0.00 53.44 51.79 1d2c n ALA 227 Cb 0.75 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1d2c n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d2c n GLY 228 N 0.49 4.70 0.00 0.00 0.00 0.48 -4.52 105.19 106.35 1d2c n GLY 228 Ca 0.25 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1d2c n GLY 228 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1d2c n ARG 229 N -0.08 0.00 -1.16 1.61 3.00 -1.26 -4.49 116.66 114.29 1d2c n ARG 229 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.85 57.67 1d2c n ARG 229 Cb 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 32.46 32.17 1d2c n ARG 229 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1d2c n ASP 230 N -0.14 5.92 0.00 6.15 10.43 -1.26 -4.57 116.55 133.08 1d2c n ASP 230 Ca 0.00 -2.65 0.00 0.00 2.57 0.00 0.00 54.79 54.71 1d2c n ASP 230 Cb 0.00 -1.40 0.00 0.00 1.84 0.00 0.00 41.12 41.56 1d2c n ASP 230 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1d2c n GLY 231 N 2.27 3.05 3.43 0.44 0.00 -1.26 -5.05 105.19 108.08 1d2c n GLY 231 Ca 0.48 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.13 1d2c n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2c n ALA 232 N -0.46 -1.66 -1.94 4.61 0.00 -1.26 -4.51 120.51 115.29 1d2c n ALA 232 Ca 0.00 -0.17 -0.25 0.00 0.00 0.00 0.00 53.44 53.02 1d2c n ALA 232 Cb 0.00 -1.78 0.07 0.00 0.00 0.00 0.00 19.45 17.73 1d2c n ALA 232 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1d2c s PRO 233 N -2.38 2.19 0.38 0.00 0.04 -1.22 -0.38 135.00 133.63 1d2c s PRO 233 Ca 0.65 -0.40 0.08 0.00 0.04 0.00 0.00 61.00 61.37 1d2c s PRO 233 Cb -0.38 -2.22 -0.06 0.00 0.04 0.00 0.00 34.50 31.87 1d2c s PRO 233 CO 0.58 -1.19 0.07 0.20 0.04 0.00 0.00 177.00 176.71 1d2c s GLY 234 N -4.52 2.28 -0.27 0.56 0.00 0.13 -4.24 107.32 101.25 1d2c s GLY 234 Ca 0.60 -2.10 0.00 0.00 0.00 0.00 0.00 44.72 43.22 1d2c s GLY 234 CO 0.44 -1.95 0.02 -1.36 0.00 0.00 0.00 173.10 170.25 1d2c s PHE 235 N -2.60 2.23 0.21 1.90 0.40 -1.26 0.53 117.98 119.39 1d2c s PHE 235 Ca 0.37 -1.84 0.06 0.00 -0.60 0.00 0.00 56.93 54.92 1d2c s PHE 235 Cb 0.04 -1.77 -0.04 0.00 0.51 0.00 0.00 43.02 41.76 1d2c s PHE 235 CO 0.20 -0.82 0.20 -1.12 0.70 0.00 0.00 175.22 174.39 1d2c s SER 236 N 1.44 5.69 0.08 1.36 0.01 -0.75 -4.93 113.70 116.61 1d2c s SER 236 Ca 0.03 -0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.22 1d2c s SER 236 Cb -0.18 -1.52 -0.03 0.00 0.21 0.00 0.00 66.02 64.50 1d2c s SER 236 CO -0.13 0.01 -0.18 -0.75 0.41 0.00 0.00 173.24 172.60 1d2c s LYS 237 N -3.52 0.99 0.07 12.44 2.20 -1.26 -0.79 119.74 129.86 1d2c s LYS 237 Ca 0.32 -1.05 -0.16 0.00 -0.36 0.00 0.00 55.97 54.72 1d2c s LYS 237 Cb -0.09 -1.12 0.03 0.00 -1.51 0.00 0.00 37.83 35.14 1d2c s LYS 237 CO 0.25 0.26 0.38 -0.59 -0.36 0.00 0.00 175.35 175.29 1d2c s PHE 238 N -1.19 -0.20 0.06 4.03 -0.71 -0.75 -4.47 117.98 114.75 1d2c s PHE 238 Ca 0.02 0.04 0.05 0.00 -1.04 0.00 0.00 56.93 56.01 1d2c s PHE 238 Cb -0.10 0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 41.88 1d2c s PHE 238 CO 0.03 -0.60 -0.15 0.50 -1.34 0.00 0.00 175.22 173.66 1d2c s ARG 239 N -2.98 0.91 0.04 1.99 3.52 -1.26 -0.22 118.95 120.95 1d2c s ARG 239 Ca -0.02 -0.90 -0.04 0.00 -0.13 0.00 0.00 55.73 54.64 1d2c s ARG 239 Cb 0.00 -0.95 -0.02 0.00 -1.56 0.00 0.00 34.95 32.42 1d2c s ARG 239 CO -0.06 0.22 0.05 -1.17 -0.81 0.00 0.00 175.30 173.53 1d2c s LEU 240 N -1.50 2.02 0.11 -0.88 2.96 -0.71 -5.01 118.68 115.66 1d2c s LEU 240 Ca 0.01 -0.64 0.07 0.00 -0.22 0.00 0.00 54.13 53.35 1d2c s LEU 240 Cb -0.09 0.45 -0.03 0.00 0.50 0.00 0.00 46.19 47.01 1d2c s LEU 240 CO 0.02 -0.51 -0.18 -0.44 -1.32 0.00 0.00 176.35 173.92 1d2c s SER 241 N -2.24 2.31 0.04 3.68 0.01 -1.26 -0.78 113.70 115.46 1d2c s SER 241 Ca -0.03 -0.71 -0.02 0.00 1.31 0.00 0.00 55.95 56.50 1d2c s SER 241 Cb -0.00 -0.11 -0.03 0.00 0.21 0.00 0.00 66.02 66.09 1d2c s SER 241 CO -0.06 -0.00 0.01 -0.31 0.41 0.00 0.00 173.24 173.29 1d2c s TYR 242 N -1.40 0.37 -0.32 2.43 2.02 0.37 -4.66 117.35 116.17 1d2c s TYR 242 Ca 0.06 -0.80 -0.18 0.00 -0.37 0.00 0.00 57.07 55.78 1d2c s TYR 242 Cb -0.09 -0.27 -0.01 0.00 -0.40 0.00 0.00 41.96 41.18 1d2c s TYR 242 CO 0.04 -0.34 0.51 -0.47 -1.57 0.00 0.00 175.55 173.72 1d2c s TYR 243 N -3.05 3.21 -1.00 2.71 5.04 0.04 -0.48 117.35 123.81 1d2c s TYR 243 Ca -0.01 0.33 -0.26 0.00 -2.44 0.00 0.00 57.07 54.70 1d2c s TYR 243 Cb 0.02 -2.85 -0.17 0.00 0.35 0.00 0.00 41.96 39.31 1d2c s TYR 243 CO -0.07 -0.44 2.15 -1.25 -1.34 0.00 0.00 175.55 174.60 1d2c s PRO 244 N 2.36 1.60 -0.08 4.97 0.04 -1.26 -4.85 135.00 137.78 1d2c s PRO 244 Ca 0.19 -0.28 -0.30 0.00 0.04 0.00 0.00 61.00 60.65 1d2c s PRO 244 Cb -0.15 -4.97 -0.02 0.00 0.04 0.00 0.00 34.50 29.39 1d2c s PRO 244 CO 0.12 -4.83 1.09 -1.01 0.04 0.00 0.00 177.00 172.42 1d2c s HIS 245 N 14.98 3.38 0.28 0.56 3.76 -1.26 -4.99 115.29 131.99 1d2c s HIS 245 Ca 0.82 1.43 -0.10 0.00 -0.15 0.00 0.00 55.06 57.06 1d2c s HIS 245 Cb -0.07 -3.29 -0.07 0.00 1.11 0.00 0.00 32.58 30.26 1d2c s HIS 245 CO 0.13 -0.71 0.61 0.00 -0.85 0.00 0.00 174.74 173.92 1d2c h LEU 247 N 2.17 0.38 0.15 0.00 5.85 -1.96 -0.99 115.31 120.91 1d2c h LEU 247 Ca -0.47 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 1d2c h LEU 247 Cb 1.18 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1d2c h LEU 247 CO 0.67 0.23 -0.07 0.00 -0.34 0.00 0.00 178.44 178.93 1d2c h ALA 248 N 1.38 -0.19 0.46 1.25 0.00 -1.98 -1.27 119.26 118.90 1d2c h ALA 248 Ca 0.30 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1d2c h ALA 248 Cb 0.30 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1d2c h ALA 248 CO -0.25 -0.50 -0.22 0.66 0.00 0.00 0.00 179.25 178.94 1d2c h SER 249 N -0.41 -0.52 -0.83 0.00 4.64 -1.94 -2.19 113.55 112.30 1d2c h SER 249 Ca -0.02 -0.06 0.18 0.00 -0.47 0.00 0.00 61.79 61.42 1d2c h SER 249 Cb 0.33 0.13 -0.11 0.00 -0.31 0.00 0.00 62.40 62.44 1d2c h SER 249 CO 0.03 -0.26 0.36 0.15 -0.87 0.00 0.00 176.83 176.24 1d2c h PHE 250 N -0.77 0.61 -0.60 4.77 3.57 -1.25 0.63 116.94 123.89 1d2c h PHE 250 Ca -0.06 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1d2c h PHE 250 Cb 0.54 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 1d2c h PHE 250 CO -0.01 0.03 0.40 1.15 -2.23 0.00 0.00 178.31 177.65 1d2c h THR 251 N 0.45 1.05 -0.23 4.41 2.02 -1.03 0.85 112.91 120.43 1d2c h THR 251 Ca 0.48 -0.23 -0.16 0.00 0.77 0.00 0.00 66.41 67.28 1d2c h THR 251 Cb 0.81 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1d2c h THR 251 CO -0.46 0.12 -0.48 1.05 0.37 0.00 0.00 175.52 176.13 1d2c h GLU 252 N 0.66 0.73 0.80 6.66 4.11 0.83 -3.09 114.58 125.28 1d2c h GLU 252 Ca 0.25 -0.48 -0.04 0.00 0.07 0.00 0.00 59.36 59.16 1d2c h GLU 252 Cb 0.16 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.48 1d2c h GLU 252 CO -0.07 1.10 -0.39 -0.07 0.07 0.00 0.00 179.01 179.66 1d2c h LEU 253 N 0.45 -0.91 -1.14 3.06 4.07 0.15 -1.24 115.31 119.75 1d2c h LEU 253 Ca 0.00 0.03 0.15 0.00 0.08 0.00 0.00 57.88 58.14 1d2c h LEU 253 Cb 1.09 0.24 -0.08 0.00 1.08 0.00 0.00 40.66 42.98 1d2c h LEU 253 CO 0.11 -0.58 0.61 1.62 -1.08 0.00 0.00 178.44 179.12 1d2c h VAL 254 N -1.23 0.83 -0.36 1.22 3.04 -1.02 -0.92 116.25 117.81 1d2c h VAL 254 Ca -0.11 -0.28 -0.14 0.00 -1.01 0.00 0.00 66.70 65.17 1d2c h VAL 254 Cb 0.83 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.05 1d2c h VAL 254 CO 0.18 0.15 -0.30 1.56 -1.01 0.00 0.00 177.57 178.15 1d2c h GLN 255 N 0.81 0.84 0.00 4.17 4.20 -1.53 -2.87 115.11 120.73 1d2c h GLN 255 Ca 0.50 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1d2c h GLN 255 Cb 0.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.48 1d2c h GLN 255 CO -0.26 1.06 0.00 1.49 -0.67 0.00 0.00 178.83 180.45 1d2c h GLU 256 N 0.64 0.00 0.00 1.46 4.81 0.05 -1.73 114.58 119.81 1d2c h GLU 256 Ca 0.06 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 1d2c h GLU 256 Cb 0.88 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.25 1d2c h GLU 256 CO 0.08 0.00 -0.30 0.00 -0.73 0.00 0.00 179.01 178.06 1d2c h ALA 257 N 2.02 0.86 -0.06 2.92 0.00 -1.02 -2.79 119.26 121.19 1d2c h ALA 257 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1d2c h ALA 257 Cb 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1d2c h ALA 257 CO 0.00 0.37 0.00 1.19 0.00 0.00 0.00 179.25 180.81 1d2c n PHE 258 N -3.25 0.06 -0.95 0.00 3.72 -0.67 -4.73 117.46 111.64 1d2c n PHE 258 Ca 0.02 -0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1d2c n PHE 258 Cb 0.58 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.12 1d2c n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1d2c n GLY 259 N 1.23 0.37 0.00 1.37 0.00 -1.05 -2.57 105.19 104.55 1d2c n GLY 259 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1d2c n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d2c n GLY 260 N -1.54 2.96 3.57 -0.02 0.00 -1.08 -4.99 105.19 104.09 1d2c n GLY 260 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1d2c n GLY 260 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1d2c s ARG 261 N -0.40 3.92 0.15 1.61 0.52 -1.06 -4.87 118.95 118.81 1d2c s ARG 261 Ca 0.00 -1.86 -0.25 0.00 -0.52 0.00 0.00 55.73 53.10 1d2c s ARG 261 Cb 0.00 -5.49 0.06 0.00 0.52 0.00 0.00 34.95 30.04 1d2c s ARG 261 CO 0.00 -2.24 0.86 0.00 0.02 0.00 0.00 175.30 173.94 1d2c s GLN 263 N -3.42 2.80 -0.12 0.00 -0.21 0.64 -4.82 119.66 114.52 1d2c s GLN 263 Ca 0.09 -1.03 -0.03 0.00 0.02 0.00 0.00 55.36 54.42 1d2c s GLN 263 Cb -0.02 -3.18 -0.03 0.00 1.00 0.00 0.00 33.01 30.78 1d2c s GLN 263 CO -0.01 -0.48 -0.00 -1.58 -2.12 0.00 0.00 175.29 171.10 1d2c s HIS 264 N 1.36 3.13 -0.20 0.91 2.46 -1.26 -1.27 115.29 120.42 1d2c s HIS 264 Ca -0.01 0.05 -0.10 0.00 0.47 0.00 0.00 55.06 55.47 1d2c s HIS 264 Cb -0.18 -1.87 0.07 0.00 -0.13 0.00 0.00 32.58 30.47 1d2c s HIS 264 CO -0.01 0.30 0.47 -1.54 -2.47 0.00 0.00 174.74 171.48 1d2c s SER 265 N -0.40 -0.59 -0.19 9.88 1.04 -1.17 -5.05 113.70 117.22 1d2c s SER 265 Ca 0.07 1.03 -0.02 0.00 0.48 0.00 0.00 55.95 57.51 1d2c s SER 265 Cb -0.12 0.96 -0.01 0.00 0.10 0.00 0.00 66.02 66.95 1d2c s SER 265 CO 0.02 -0.21 -0.08 0.54 0.98 0.00 0.00 173.24 174.50 1d2c s VAL 266 N 1.56 3.23 0.23 5.02 0.11 -1.26 -1.88 120.40 127.41 1d2c s VAL 266 Ca -0.09 -0.56 -0.12 0.00 -2.93 0.00 0.00 61.98 58.28 1d2c s VAL 266 Cb -0.08 -2.43 -0.07 0.00 -1.53 0.00 0.00 36.38 32.27 1d2c s VAL 266 CO -0.14 0.47 0.59 -0.76 -3.33 0.00 0.00 175.10 171.92 1d2c s LEU 267 N 1.06 4.18 0.00 2.54 1.02 0.09 -3.14 118.68 124.44 1d2c s LEU 267 Ca 0.00 1.03 0.00 0.00 0.02 0.00 0.00 54.13 55.18 1d2c s LEU 267 Cb -0.15 -3.68 0.00 0.00 0.02 0.00 0.00 46.19 42.39 1d2c s LEU 267 CO -0.01 -0.06 0.00 0.61 0.02 0.00 0.00 176.35 176.91 1d2c n GLY 268 N 0.02 -1.16 0.02 -3.19 0.00 0.37 -2.75 105.19 98.50 1d2c n GLY 268 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1d2c n GLY 268 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1d2c h ASP 269 N 0.00 0.00 0.00 1.61 3.32 -1.88 -3.35 116.42 116.13 1d2c h ASP 269 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d2c h ASP 269 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1d2c h ASP 269 CO 0.00 0.21 -0.15 0.49 -1.72 0.00 0.00 179.24 178.07 1d2c n PHE 270 N -2.96 0.00 -2.88 4.55 0.99 -1.26 -4.66 117.46 111.24 1d2c n PHE 270 Ca -0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 57.45 57.19 1d2c n PHE 270 Cb 0.05 0.00 0.01 0.00 -1.00 0.00 0.00 39.48 38.54 1d2c n PHE 270 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1d2c s LYS 271 N -0.67 3.14 1.08 -1.08 1.02 -1.26 -5.01 119.74 116.96 1d2c s LYS 271 Ca 0.00 -0.30 -0.13 0.00 0.02 0.00 0.00 55.97 55.56 1d2c s LYS 271 Cb 0.00 -2.50 0.20 0.00 -0.52 0.00 0.00 37.83 35.01 1d2c s LYS 271 CO 0.00 -0.30 0.83 -2.30 -0.92 0.00 0.00 175.35 172.66 1d2c n PRO 272 N -2.16 -1.59 -4.68 -1.68 -0.02 -1.26 0.14 135.00 123.75 1d2c n PRO 272 Ca 0.01 -0.42 -0.24 0.00 -2.02 0.00 0.00 63.50 60.82 1d2c n PRO 272 Cb 0.57 -2.12 -0.16 0.00 -0.02 0.00 0.00 33.50 31.77 1d2c n PRO 272 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1d2c s TYR 273 N -2.44 1.49 -0.04 6.00 5.04 -1.19 -3.58 117.35 122.64 1d2c s TYR 273 Ca 0.65 -0.45 -0.02 0.00 -2.44 0.00 0.00 57.07 54.81 1d2c s TYR 273 Cb -0.22 -1.03 0.03 0.00 0.35 0.00 0.00 41.96 41.08 1d2c s TYR 273 CO 0.64 -0.18 0.04 1.03 -1.34 0.00 0.00 175.55 175.74 1d2c s ARG 274 N 0.22 0.05 0.35 4.97 0.52 -1.26 -4.91 118.95 118.88 1d2c s ARG 274 Ca -0.06 0.30 -0.27 0.00 -0.52 0.00 0.00 55.73 55.17 1d2c s ARG 274 Cb -0.12 -0.55 -0.12 0.00 0.52 0.00 0.00 34.95 34.68 1d2c s ARG 274 CO 0.02 -0.29 1.17 -0.35 0.02 0.00 0.00 175.30 175.87 1d2c n PRO 275 N 5.07 1.80 -0.00 3.54 -0.04 -1.26 -2.03 135.00 142.07 1d2c n PRO 275 Ca -0.08 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.01 1d2c n PRO 275 Cb 0.50 -2.17 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 1d2c n PRO 275 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1d2c n GLY 276 N 0.95 0.14 3.75 0.55 0.00 -1.26 -5.06 105.19 104.27 1d2c n GLY 276 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1d2c n GLY 276 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1d2c s GLN 277 N -0.97 4.50 0.18 1.61 -2.07 -0.86 -4.93 119.66 117.12 1d2c s GLN 277 Ca 0.00 1.94 -0.13 0.00 -1.82 0.00 0.00 55.36 55.35 1d2c s GLN 277 Cb 0.00 -3.19 0.18 0.00 -1.09 0.00 0.00 33.01 28.92 1d2c s GLN 277 CO 0.00 -0.03 1.73 0.00 -1.32 0.00 0.00 175.29 175.67 1d2c h ALA 278 N 4.45 0.57 -2.49 2.60 0.00 -1.97 -3.41 119.26 119.00 1d2c h ALA 278 Ca -0.46 0.09 -0.53 0.00 0.00 0.00 0.00 54.91 54.01 1d2c h ALA 278 Cb 1.22 0.11 0.04 0.00 0.00 0.00 0.00 17.79 19.15 1d2c h ALA 278 CO 0.71 -0.28 1.14 0.98 0.00 0.00 0.00 179.25 181.79 1d2c n TYR 279 N -5.08 2.63 -3.77 0.00 4.19 -1.26 -4.98 117.16 108.88 1d2c n TYR 279 Ca 0.05 -0.19 -0.37 0.00 3.31 0.00 0.00 57.90 60.70 1d2c n TYR 279 Cb 0.23 -2.75 -0.13 0.00 0.49 0.00 0.00 39.34 37.18 1d2c n TYR 279 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 1d2c s VAL 280 N 2.97 3.94 0.57 2.97 -7.23 -1.26 -5.06 120.40 117.30 1d2c s VAL 280 Ca 0.83 -0.62 -0.15 0.00 -1.81 0.00 0.00 61.98 60.24 1d2c s VAL 280 Cb -0.47 -2.99 -0.05 0.00 0.56 0.00 0.00 36.38 33.43 1d2c s VAL 280 CO 0.38 0.14 1.01 -2.16 -0.31 0.00 0.00 175.10 174.16 1d2c s PRO 281 N 1.51 3.67 0.04 4.82 0.04 -1.26 -4.97 135.00 138.84 1d2c s PRO 281 Ca 0.03 0.95 0.09 0.00 0.04 0.00 0.00 61.00 62.11 1d2c s PRO 281 Cb -0.17 -2.09 -0.22 0.00 0.04 0.00 0.00 34.50 32.06 1d2c s PRO 281 CO 0.02 -0.50 0.96 0.00 0.04 0.00 0.00 177.00 177.52 1d2c s TYR 283 N -2.65 1.59 -0.24 0.00 1.51 -1.26 -0.58 117.35 115.72 1d2c s TYR 283 Ca -0.02 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 1d2c s TYR 283 Cb 0.09 -0.89 0.04 0.00 -0.11 0.00 0.00 41.96 41.09 1d2c s TYR 283 CO 0.82 0.14 -0.11 -0.06 -1.11 0.00 0.00 175.55 175.24 1d2c s PHE 284 N -1.14 3.07 -0.15 2.71 0.40 0.47 -3.94 117.98 119.41 1d2c s PHE 284 Ca 0.04 -1.83 -0.07 0.00 -0.60 0.00 0.00 56.93 54.47 1d2c s PHE 284 Cb -0.10 -1.99 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 1d2c s PHE 284 CO 0.03 -0.80 0.09 0.42 0.70 0.00 0.00 175.22 175.66 1d2c s ILE 285 N 1.24 5.03 -0.16 0.64 1.01 -1.11 -1.71 121.20 126.14 1d2c s ILE 285 Ca -0.02 0.04 -0.00 0.00 0.00 0.00 0.00 60.65 60.67 1d2c s ILE 285 Cb -0.17 -3.22 -0.00 0.00 0.01 0.00 0.00 42.46 39.08 1d2c s ILE 285 CO -0.06 0.53 -0.13 -1.00 0.00 0.00 0.00 174.94 174.27 1d2c s HIS 286 N -0.30 2.82 -0.24 3.97 3.76 0.25 -0.73 115.29 124.81 1d2c s HIS 286 Ca 0.09 -1.02 0.02 0.00 -0.15 0.00 0.00 55.06 54.00 1d2c s HIS 286 Cb -0.12 -1.92 0.05 0.00 1.11 0.00 0.00 32.58 31.70 1d2c s HIS 286 CO 0.01 -0.48 -0.12 0.54 -0.85 0.00 0.00 174.74 173.85 1d2c s VAL 287 N 0.90 2.30 -0.09 -0.90 0.11 -0.79 -1.53 120.40 120.41 1d2c s VAL 287 Ca -0.03 -1.38 0.01 0.00 -2.93 0.00 0.00 61.98 57.65 1d2c s VAL 287 Cb -0.15 -2.24 -0.02 0.00 -1.53 0.00 0.00 36.38 32.43 1d2c s VAL 287 CO -0.01 0.12 -0.10 -0.76 -3.33 0.00 0.00 175.10 171.02 1d2c s LEU 288 N 1.18 2.94 -0.09 2.54 2.01 -0.08 -3.03 118.68 124.16 1d2c s LEU 288 Ca -0.04 -0.16 -0.01 0.00 0.01 0.00 0.00 54.13 53.93 1d2c s LEU 288 Cb -0.18 -1.64 -0.03 0.00 0.01 0.00 0.00 46.19 44.35 1d2c s LEU 288 CO -0.06 0.29 -0.04 -0.75 1.01 0.00 0.00 176.35 176.80 1d2c s LYS 289 N -0.38 3.00 -0.66 1.70 2.20 -0.40 -0.59 119.74 124.61 1d2c s LYS 289 Ca 0.05 -0.49 -0.24 0.00 -0.36 0.00 0.00 55.97 54.92 1d2c s LYS 289 Cb -0.12 -2.72 0.05 0.00 -1.51 0.00 0.00 37.83 33.53 1d2c s LYS 289 CO 0.02 0.60 1.06 0.21 -0.36 0.00 0.00 175.35 176.88 1d2c s LYS 290 N -0.62 3.19 -1.14 4.03 2.20 0.66 -0.26 119.74 127.80 1d2c s LYS 290 Ca 0.10 -0.51 -0.04 0.00 -0.36 0.00 0.00 55.97 55.15 1d2c s LYS 290 Cb -0.12 -4.17 0.26 0.00 -1.51 0.00 0.00 37.83 32.29 1d2c s LYS 290 CO 0.02 -1.85 1.80 0.25 -0.36 0.00 0.00 175.35 175.21 1d2c n THR 291 N 6.14 5.39 0.00 3.43 -2.24 -1.19 0.87 114.28 126.68 1d2c n THR 291 Ca -0.00 -5.44 0.00 0.00 -2.27 0.00 0.00 64.05 56.33 1d2c n THR 291 Cb 0.47 -1.97 0.00 0.00 -2.10 0.00 0.00 70.33 66.73 1d2c n THR 291 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11