#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 5.57 -0.09 4.52 1.11 -1.26 -5.14 116.67 121.38 1d2c s ASP 2 Ca 0.00 -0.43 -0.30 0.00 0.18 0.00 0.00 52.55 52.00 1d2c s ASP 2 Cb 0.00 -0.87 0.08 0.00 1.07 0.00 0.00 42.92 43.20 1d2c s ASP 2 CO 0.00 -0.57 0.73 -0.44 1.18 0.00 0.00 175.17 176.07 1d2c s SER 3 N -4.19 -0.63 -0.01 0.27 0.01 -1.26 -5.18 113.70 102.71 1d2c s SER 3 Ca 0.48 0.77 0.05 0.00 1.31 0.00 0.00 55.95 58.56 1d2c s SER 3 Cb -0.08 0.62 -0.01 0.00 0.21 0.00 0.00 66.02 66.76 1d2c s SER 3 CO 0.30 -0.53 -0.17 0.54 0.41 0.00 0.00 173.24 173.80 1d2c s VAL 4 N -0.97 1.31 -0.15 3.43 0.11 -1.26 -5.14 120.40 117.74 1d2c s VAL 4 Ca -0.08 -0.72 0.02 0.00 -2.93 0.00 0.00 61.98 58.27 1d2c s VAL 4 Cb -0.01 -1.09 0.01 0.00 -1.53 0.00 0.00 36.38 33.76 1d2c s VAL 4 CO 0.08 0.36 -0.20 -0.31 -3.33 0.00 0.00 175.10 171.69 1d2c s TYR 5 N -0.40 2.70 0.07 1.54 4.12 -1.26 -5.12 117.35 119.00 1d2c s TYR 5 Ca 0.06 -1.30 0.05 0.00 0.02 0.00 0.00 57.07 55.90 1d2c s TYR 5 Cb -0.06 -1.84 -0.04 0.00 -1.52 0.00 0.00 41.96 38.50 1d2c s TYR 5 CO -0.01 -0.60 -0.03 -0.98 0.02 0.00 0.00 175.55 173.95 1d2c s ARG 6 N 0.84 2.46 0.12 -0.62 1.70 -1.26 -5.02 118.95 117.17 1d2c s ARG 6 Ca -0.06 -0.85 -0.21 0.00 -0.47 0.00 0.00 55.73 54.14 1d2c s ARG 6 Cb -0.15 -2.49 -0.07 0.00 -0.57 0.00 0.00 34.95 31.67 1d2c s ARG 6 CO -0.02 0.55 1.74 1.15 -1.08 0.00 0.00 175.30 177.64 1d2c h THR 7 N 3.14 0.96 -3.83 4.99 2.02 -2.07 -3.45 112.91 114.67 1d2c h THR 7 Ca -0.48 -0.04 -0.11 0.00 0.77 0.00 0.00 66.41 66.55 1d2c h THR 7 Cb 1.17 0.84 -0.16 0.00 -1.74 0.00 0.00 68.15 68.25 1d2c h THR 7 CO 0.57 0.02 -0.48 0.00 0.37 0.00 0.00 175.52 176.00 1d2c s ARG 8 N -6.18 0.69 0.77 6.66 1.70 -1.26 -5.15 118.95 116.18 1d2c s ARG 8 Ca -0.13 -0.87 -0.13 0.00 -0.47 0.00 0.00 55.73 54.13 1d2c s ARG 8 Cb 0.08 0.27 0.06 0.00 -0.57 0.00 0.00 34.95 34.80 1d2c s ARG 8 CO 0.68 -0.19 1.17 -1.12 -1.08 0.00 0.00 175.30 174.76 1d2c s SER 9 N -2.47 4.02 -0.20 -2.89 0.01 -1.26 -4.91 113.70 106.00 1d2c s SER 9 Ca -0.00 2.21 -0.29 0.00 1.31 0.00 0.00 55.95 59.18 1d2c s SER 9 Cb 0.02 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.65 1d2c s SER 9 CO -0.07 -2.37 1.59 -0.76 0.41 0.00 0.00 173.24 172.03 1d2c s LEU 10 N -5.58 3.97 0.00 2.44 1.02 -1.26 -2.88 118.68 116.40 1d2c s LEU 10 Ca 0.70 1.69 0.00 0.00 0.02 0.00 0.00 54.13 56.54 1d2c s LEU 10 Cb -0.25 -3.53 0.00 0.00 0.02 0.00 0.00 46.19 42.43 1d2c s LEU 10 CO 0.49 -1.18 0.00 0.61 0.02 0.00 0.00 176.35 176.30 1d2c n GLY 11 N 4.51 0.70 3.86 -3.19 0.00 -1.26 -5.11 105.19 104.71 1d2c n GLY 11 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.00 4.67 0.21 1.61 -7.23 -1.14 -5.11 120.40 111.41 1d2c s VAL 12 Ca 0.00 -1.29 0.07 0.00 -1.81 0.00 0.00 61.98 58.95 1d2c s VAL 12 Cb 0.00 -3.53 -0.05 0.00 0.56 0.00 0.00 36.38 33.36 1d2c s VAL 12 CO 0.00 -0.34 -0.12 0.00 -0.31 0.00 0.00 175.10 174.33 1d2c s ALA 13 N -2.09 1.96 0.01 1.32 0.00 -1.26 -4.71 121.76 117.00 1d2c s ALA 13 Ca 0.33 -1.67 0.01 0.00 0.00 0.00 0.00 51.96 50.63 1d2c s ALA 13 Cb -0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1d2c s ALA 13 CO 0.26 0.01 -0.04 0.00 0.00 0.00 0.00 175.76 175.99 1d2c s ALA 14 N -3.05 0.32 0.00 0.00 0.00 -1.26 -5.11 121.76 112.66 1d2c s ALA 14 Ca 0.23 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.81 1d2c s ALA 14 Cb 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.12 1d2c s ALA 14 CO 0.07 0.01 0.76 0.39 0.00 0.00 0.00 175.76 176.98 1d2c n GLU 15 N 2.38 0.00 0.00 0.00 4.71 -1.26 -2.81 120.64 123.65 1d2c n GLU 15 Ca -0.17 0.64 0.03 0.00 -0.01 0.00 0.00 57.16 57.65 1d2c n GLU 15 Cb 0.57 -1.26 0.17 0.00 -1.01 0.00 0.00 31.44 29.91 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 -0.94 -0.48 3.34 0.62 0.00 -1.26 -4.80 105.19 101.67 1d2c n GLY 16 Ca 0.00 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.52 2.05 0.43 -0.61 -4.36 -1.12 -5.12 121.20 109.95 1d2c s ILE 17 Ca 0.07 -1.56 -0.26 0.00 -0.26 0.00 0.00 60.65 58.63 1d2c s ILE 17 Cb 0.05 -1.80 -0.09 0.00 1.25 0.00 0.00 42.46 41.86 1d2c s ILE 17 CO 0.10 0.14 1.46 -2.84 0.24 0.00 0.00 174.94 174.04 1d2c s PRO 18 N -1.73 3.80 1.01 0.37 0.02 -1.26 -4.53 135.00 132.68 1d2c s PRO 18 Ca 0.11 2.49 -0.12 0.00 0.02 0.00 0.00 61.00 63.51 1d2c s PRO 18 Cb -0.10 -2.75 0.18 0.00 0.02 0.00 0.00 34.50 31.85 1d2c s PRO 18 CO 0.04 -0.75 0.97 -0.25 -0.33 0.00 0.00 177.00 176.68 1d2c n ASP 19 N -0.01 -0.69 0.00 2.53 8.00 -1.26 -4.93 116.55 120.18 1d2c n ASP 19 Ca 0.04 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.74 1d2c n ASP 19 Cb 0.41 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 1d2c n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1d2c n GLN 20 N -4.12 0.00 -1.26 -1.24 3.00 -1.26 -3.00 117.38 109.50 1d2c n GLN 20 Ca 0.08 0.15 -0.27 0.00 -0.01 0.00 0.00 57.00 56.96 1d2c n GLN 20 Cb 0.53 -0.44 0.14 0.00 0.00 0.00 0.00 30.24 30.47 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 -0.42 2.97 0.23 1.08 4.02 -1.26 -4.64 117.16 119.15 1d2c n TYR 21 Ca 0.00 -2.29 0.10 0.00 -0.01 0.00 0.00 57.90 55.70 1d2c n TYR 21 Cb 0.00 -1.08 0.57 0.00 -0.02 0.00 0.00 39.34 38.81 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 1.41 1.22 -0.11 -0.72 0.00 -1.90 -3.24 119.26 115.93 1d2c h ALA 22 Ca 0.59 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 55.26 1d2c h ALA 22 Cb 1.97 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.70 1d2c h ALA 22 CO 1.22 0.26 -0.26 -3.47 0.00 0.00 0.00 179.25 177.00 1d2c n ASP 23 N -3.66 2.19 -4.81 0.00 -0.08 -1.26 -4.74 116.55 104.19 1d2c n ASP 23 Ca -0.01 -3.66 -0.31 0.00 -1.51 0.00 0.00 54.79 49.30 1d2c n ASP 23 Cb 0.33 -0.54 0.06 0.00 2.34 0.00 0.00 41.12 43.31 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 -2.89 1.66 0.24 0.27 0.00 -1.22 -4.86 107.32 100.53 1d2c s GLY 24 Ca 0.39 0.09 -0.04 0.00 0.00 0.00 0.00 44.72 45.16 1d2c s GLY 24 CO -0.02 0.42 1.76 -2.09 0.00 0.00 0.00 173.10 173.17 1d2c h GLU 25 N -0.85 0.57 -0.27 2.90 4.81 -1.96 -1.42 114.58 118.35 1d2c h GLU 25 Ca -0.44 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 58.61 1d2c h GLU 25 Cb 1.22 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 1d2c h GLU 25 CO 0.56 0.37 -0.42 0.00 -0.73 0.00 0.00 179.01 178.79 1d2c h ALA 26 N 1.50 0.74 0.00 2.92 0.00 -1.92 -2.90 119.26 119.60 1d2c h ALA 26 Ca 0.41 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1d2c h ALA 26 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1d2c h ALA 26 CO -0.33 0.66 -0.37 0.00 0.00 0.00 0.00 179.25 179.21 1d2c h ALA 27 N 0.98 1.25 -0.14 0.00 0.00 -1.64 -1.12 119.26 118.58 1d2c h ALA 27 Ca 0.04 -0.33 -0.19 0.00 0.00 0.00 0.00 54.91 54.43 1d2c h ALA 27 Cb 0.96 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1d2c h ALA 27 CO 0.09 0.46 -0.67 0.00 0.00 0.00 0.00 179.25 179.13 1d2c h ARG 28 N 0.00 0.56 0.04 0.00 -0.00 -1.15 -2.30 114.38 111.53 1d2c h ARG 28 Ca -0.00 -0.42 -0.22 0.00 -0.50 0.00 0.00 59.98 58.83 1d2c h ARG 28 Cb 0.71 0.07 -0.01 0.00 0.00 0.00 0.00 29.97 30.74 1d2c h ARG 28 CO 0.05 1.04 -1.03 0.28 0.00 0.00 0.00 179.97 180.31 1d2c h VAL 29 N 0.40 1.58 -0.55 2.04 2.07 -1.35 -3.24 116.25 117.20 1d2c h VAL 29 Ca -0.02 -3.05 -0.06 0.00 0.82 0.00 0.00 66.70 64.39 1d2c h VAL 29 Cb 1.25 2.75 -0.02 0.00 -1.52 0.00 0.00 31.29 33.75 1d2c h VAL 29 CO 0.13 0.88 0.10 -0.25 0.02 0.00 0.00 177.57 178.45 1d2c h TRP 30 N 0.05 0.95 -0.85 1.57 7.01 -1.16 -1.51 115.95 122.01 1d2c h TRP 30 Ca -0.06 -0.13 0.04 0.00 2.11 0.00 0.00 58.89 60.86 1d2c h TRP 30 Cb 1.74 -0.26 -0.05 0.00 -2.10 0.00 0.00 29.16 28.48 1d2c h TRP 30 CO 0.03 0.84 0.53 1.96 -2.79 0.00 0.00 178.44 179.01 1d2c h GLN 31 N 0.79 0.98 0.14 2.65 4.20 -1.46 -1.26 115.11 121.15 1d2c h GLN 31 Ca 0.17 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1d2c h GLN 31 Cb 0.39 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1d2c h GLN 31 CO 0.01 0.65 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.68 1d2c h LEU 32 N 1.01 -0.16 -0.11 1.46 4.07 -1.52 -0.45 115.31 119.62 1d2c h LEU 32 Ca 0.35 -0.00 0.04 0.00 0.08 0.00 0.00 57.88 58.35 1d2c h LEU 32 Cb 0.08 0.04 -0.06 0.00 1.08 0.00 0.00 40.66 41.79 1d2c h LEU 32 CO -0.14 -0.11 -0.41 0.22 -1.08 0.00 0.00 178.44 176.92 1d2c h TYR 33 N -0.19 -1.17 0.00 1.13 5.03 -0.55 0.20 116.97 121.41 1d2c h TYR 33 Ca -0.02 0.05 -0.00 0.00 2.58 0.00 0.00 58.73 61.33 1d2c h TYR 33 Cb 0.15 0.53 -0.00 0.00 1.55 0.00 0.00 36.73 38.96 1d2c h TYR 33 CO -0.07 -0.47 -0.01 -0.84 -1.32 0.00 0.00 178.16 175.45 1d2c h ILE 34 N -0.50 0.04 -0.00 1.81 3.07 -1.19 -1.98 117.51 118.75 1d2c h ILE 34 Ca 0.07 -0.46 0.00 0.00 1.55 0.00 0.00 64.86 66.02 1d2c h ILE 34 Cb 0.62 1.44 0.00 0.00 -0.27 0.00 0.00 36.82 38.62 1d2c h ILE 34 CO -0.38 0.01 -0.34 0.61 -1.05 0.00 0.00 178.15 177.00 1d2c n GLY 35 N -0.14 -1.02 1.76 0.16 0.00 -0.19 -3.73 105.19 102.03 1d2c n GLY 35 Ca -0.00 -0.34 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 1d2c n GLY 35 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1d2c n ASP 36 N -1.16 4.09 -2.71 1.61 -0.08 0.57 -4.60 116.55 114.27 1d2c n ASP 36 Ca 0.09 -3.69 -0.09 0.00 -1.51 0.00 0.00 54.79 49.58 1d2c n ASP 36 Cb 0.33 -0.38 0.05 0.00 2.34 0.00 0.00 41.12 43.46 1d2c n ASP 36 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1d2c n THR 37 N -0.78 0.67 0.00 5.18 5.66 -1.17 -4.10 114.28 119.73 1d2c n THR 37 Ca 0.37 -2.79 0.00 0.00 -3.05 0.00 0.00 64.05 58.58 1d2c n THR 37 Cb 0.91 0.69 0.00 0.00 -1.55 0.00 0.00 70.33 70.38 1d2c n THR 37 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1d2c n ARG 38 N -0.14 2.83 -1.61 1.09 0.00 -1.26 -4.96 116.66 112.60 1d2c n ARG 38 Ca 0.08 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.78 1d2c n ARG 38 Cb 0.81 -0.74 -0.08 0.00 -0.00 0.00 0.00 32.46 32.45 1d2c n ARG 38 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1d2c s SER 39 N -1.20 3.85 0.51 2.89 1.04 -1.26 -4.87 113.70 114.66 1d2c s SER 39 Ca 0.00 -0.28 -0.22 0.00 0.48 0.00 0.00 55.95 55.92 1d2c s SER 39 Cb 0.00 -2.56 -0.07 0.00 0.10 0.00 0.00 66.02 63.49 1d2c s SER 39 CO 0.00 -4.05 1.21 -1.14 0.98 0.00 0.00 173.24 170.24 1d2c n ARG 40 N 8.65 1.55 -3.67 4.02 0.63 -1.26 -0.41 116.66 126.17 1d2c n ARG 40 Ca 0.45 0.57 -0.36 0.00 -0.92 0.00 0.00 57.85 57.58 1d2c n ARG 40 Cb 0.44 -2.37 -0.06 0.00 0.45 0.00 0.00 32.46 30.92 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 -1.31 5.23 0.24 5.15 2.01 -0.41 -4.74 115.64 121.80 1d2c s THR 41 Ca 0.68 0.47 -0.06 0.00 0.31 0.00 0.00 61.69 63.09 1d2c s THR 41 Cb -0.46 -3.59 0.20 0.00 0.01 0.00 0.00 72.50 68.67 1d2c s THR 41 CO 0.52 0.50 1.83 0.00 -0.69 0.00 0.00 174.62 176.78 1d2c h ALA 42 N 4.46 1.13 -0.74 7.40 0.00 -1.92 -1.65 119.26 127.94 1d2c h ALA 42 Ca -0.52 0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.49 1d2c h ALA 42 Cb 1.21 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 1d2c h ALA 42 CO 0.62 0.19 0.39 0.93 0.00 0.00 0.00 179.25 181.38 1d2c h GLU 43 N 0.87 0.65 0.54 0.00 3.07 -1.95 0.03 114.58 117.79 1d2c h GLU 43 Ca 0.37 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.16 1d2c h GLU 43 Cb 0.23 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 27.99 1d2c h GLU 43 CO -0.19 0.43 -0.26 -0.92 -1.40 0.00 0.00 179.01 176.66 1d2c h TYR 44 N 0.67 -0.67 -0.25 4.33 3.20 -1.65 -0.21 116.97 122.39 1d2c h TYR 44 Ca 0.36 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.27 1d2c h TYR 44 Cb 0.35 0.22 -0.08 0.00 1.54 0.00 0.00 36.73 38.77 1d2c h TYR 44 CO -0.09 -0.34 -0.33 -0.22 -1.64 0.00 0.00 178.16 175.53 1d2c h LYS 45 N -0.98 -0.33 0.24 1.82 3.64 -1.00 0.28 116.57 120.24 1d2c h LYS 45 Ca -0.07 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1d2c h LYS 45 Cb 0.63 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1d2c h LYS 45 CO 0.12 -0.22 -0.11 0.00 -2.27 0.00 0.00 179.45 176.97 1d2c h ALA 46 N 0.54 -0.32 -0.04 5.00 0.00 -1.06 -0.53 119.26 122.86 1d2c h ALA 46 Ca 0.13 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1d2c h ALA 46 Cb 0.55 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1d2c h ALA 46 CO -0.44 -0.66 -0.32 2.35 0.00 0.00 0.00 179.25 180.18 1d2c h TRP 47 N -0.35 -0.87 0.45 0.00 7.01 -0.48 0.26 115.95 121.97 1d2c h TRP 47 Ca -0.03 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 60.98 1d2c h TRP 47 Cb 0.27 0.39 0.00 0.00 -2.10 0.00 0.00 29.16 27.72 1d2c h TRP 47 CO -0.05 -0.40 -0.22 1.25 -2.79 0.00 0.00 178.44 176.23 1d2c h LEU 48 N -0.44 -0.51 -0.36 0.65 5.85 -0.43 -1.12 115.31 118.94 1d2c h LEU 48 Ca 0.07 -0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.82 1d2c h LEU 48 Cb 0.55 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 1d2c h LEU 48 CO -0.29 -0.30 0.03 -0.07 -0.34 0.00 0.00 178.44 177.47 1d2c h LEU 49 N -0.70 -0.08 -0.09 2.25 4.07 -0.97 -1.97 115.31 117.82 1d2c h LEU 49 Ca -0.06 0.07 0.03 0.00 0.08 0.00 0.00 57.88 58.01 1d2c h LEU 49 Cb 0.51 0.12 -0.04 0.00 1.08 0.00 0.00 40.66 42.33 1d2c h LEU 49 CO 0.10 -0.01 -0.13 1.23 -1.08 0.00 0.00 178.44 178.55 1d2c h GLY 50 N 0.13 -0.08 0.74 0.83 0.00 -0.39 -1.37 103.07 102.93 1d2c h GLY 50 Ca 0.17 0.16 0.06 0.00 0.00 0.00 0.00 47.33 47.73 1d2c h GLY 50 CO -0.26 -0.14 0.62 -2.00 0.00 0.00 0.00 176.54 174.76 1d2c h LEU 51 N -0.18 0.99 -0.46 3.11 5.85 -0.86 0.23 115.31 124.00 1d2c h LEU 51 Ca 0.08 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 1d2c h LEU 51 Cb 0.29 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1d2c h LEU 51 CO -0.20 0.64 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.34 1d2c h LEU 52 N 1.13 0.90 -0.13 2.25 4.07 -0.99 -2.53 115.31 120.01 1d2c h LEU 52 Ca 0.42 -0.37 -0.24 0.00 0.08 0.00 0.00 57.88 57.78 1d2c h LEU 52 Cb 0.16 -0.25 0.01 0.00 1.08 0.00 0.00 40.66 41.66 1d2c h LEU 52 CO -0.17 1.06 -0.98 0.03 -1.08 0.00 0.00 178.44 177.30 1d2c h ARG 53 N 0.73 0.45 -0.14 1.13 3.08 -0.93 0.25 114.38 118.94 1d2c h ARG 53 Ca 0.11 -0.49 0.04 0.00 0.07 0.00 0.00 59.98 59.71 1d2c h ARG 53 Cb 0.67 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1d2c h ARG 53 CO 0.05 1.15 0.11 0.37 -1.07 0.00 0.00 179.97 180.57 1d2c h GLN 54 N 0.24 0.00 -0.50 0.04 4.15 -0.50 0.22 115.11 118.77 1d2c h GLN 54 Ca -0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1d2c h GLN 54 Cb 1.62 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.31 1d2c h GLN 54 CO 0.17 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.79 1d2c n HIS 55 N -4.43 0.66 -3.65 3.99 8.25 -0.96 -4.99 115.22 114.10 1d2c n HIS 55 Ca 0.00 -0.43 -0.29 0.00 -0.26 0.00 0.00 57.72 56.75 1d2c n HIS 55 Cb 0.23 -0.01 0.04 0.00 1.12 0.00 0.00 29.99 31.37 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 1.18 -1.04 3.88 -1.41 0.00 0.78 -4.97 105.19 103.62 1d2c n GLY 56 Ca 0.18 0.47 -0.36 0.00 0.00 0.00 0.00 46.02 46.32 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 1.50 0.00 -3.44 0.00 8.25 -1.26 -4.77 115.22 115.50 1d2c n HIS 58 Ca -0.15 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 56.91 1d2c n HIS 58 Cb 0.54 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.55 1d2c n HIS 58 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1d2c s ARG 59 N -1.26 3.68 0.09 -0.41 0.52 -1.26 0.42 118.95 120.73 1d2c s ARG 59 Ca 0.00 -0.35 0.10 0.00 -0.52 0.00 0.00 55.73 54.96 1d2c s ARG 59 Cb 0.00 -3.76 -0.04 0.00 0.52 0.00 0.00 34.95 31.67 1d2c s ARG 59 CO 0.00 -0.43 -0.26 0.08 0.02 0.00 0.00 175.30 174.72 1d2c s VAL 60 N 1.96 2.28 -0.13 3.52 1.01 0.22 -0.96 120.40 128.31 1d2c s VAL 60 Ca 0.11 -1.56 0.02 0.00 0.00 0.00 0.00 61.98 60.55 1d2c s VAL 60 Cb -0.16 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.26 1d2c s VAL 60 CO 0.11 0.21 -0.19 -0.22 0.00 0.00 0.00 175.10 175.01 1d2c s LEU 61 N -1.70 1.95 -0.38 3.92 2.96 -0.58 -2.16 118.68 122.69 1d2c s LEU 61 Ca 0.13 -0.53 -0.10 0.00 -0.22 0.00 0.00 54.13 53.41 1d2c s LEU 61 Cb -0.10 -1.30 0.04 0.00 0.50 0.00 0.00 46.19 45.32 1d2c s LEU 61 CO 0.05 0.05 0.20 -0.62 -1.32 0.00 0.00 176.35 174.71 1d2c s ASP 62 N 0.89 5.67 0.00 3.68 -1.08 -0.87 -1.19 116.67 123.76 1d2c s ASP 62 Ca -0.07 -1.08 0.26 0.00 -0.52 0.00 0.00 52.55 51.14 1d2c s ASP 62 Cb -0.15 -2.00 0.72 0.00 -1.46 0.00 0.00 42.92 40.03 1d2c s ASP 62 CO -0.02 -0.40 1.56 1.33 0.52 0.00 0.00 175.17 178.16 1d2c n VAL 63 N 4.96 0.00 -2.64 1.11 0.24 -0.92 -1.13 118.33 119.95 1d2c n VAL 63 Ca -0.12 -0.01 -0.26 0.00 -2.04 0.00 0.00 64.34 61.91 1d2c n VAL 63 Cb 0.45 0.09 -0.01 0.00 -1.47 0.00 0.00 33.84 32.90 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 -1.40 4.80 -0.32 2.33 0.00 -1.23 -4.42 120.51 120.26 1d2c n ALA 64 Ca 0.07 -4.36 -0.10 0.00 0.00 0.00 0.00 53.44 49.04 1d2c n ALA 64 Cb 0.33 -0.63 -0.09 0.00 0.00 0.00 0.00 19.45 19.07 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 -1.24 1.90 0.00 0.00 0.00 -1.26 -2.01 105.19 102.58 1d2c n GLY 66 Ca 0.01 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.57 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 0.06 -0.03 2.61 -2.24 -1.26 -4.00 114.28 109.42 1d2c n THR 67 Ca 0.00 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1d2c n THR 67 Cb 0.00 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 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 0.73 0.80 0.34 3.38 0.00 -0.85 -3.27 105.19 106.32 1d2c n GLY 68 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 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 0.08 -0.33 1.61 -1.51 -1.90 0.56 116.25 114.75 1d2c h VAL 69 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.43 1d2c h VAL 69 Cb 0.00 0.08 -0.01 0.00 -2.13 0.00 0.00 31.29 29.22 1d2c h VAL 69 CO 0.00 0.00 0.05 0.44 -1.23 0.00 0.00 177.57 176.83 1d2c h ASP 70 N -0.00 0.53 -0.52 4.19 3.45 -1.94 -3.13 116.42 119.01 1d2c h ASP 70 Ca 0.44 -0.26 -0.10 0.00 0.43 0.00 0.00 57.03 57.54 1d2c h ASP 70 Cb 0.67 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.28 1d2c h ASP 70 CO -0.95 0.66 -0.06 0.28 -1.57 0.00 0.00 179.24 177.60 1d2c h SER 71 N 0.38 0.96 -0.44 6.45 0.02 -1.15 -2.98 113.55 116.79 1d2c h SER 71 Ca 0.10 -0.34 0.08 0.00 -0.84 0.00 0.00 61.79 60.79 1d2c h SER 71 Cb 0.36 -0.26 -0.07 0.00 0.14 0.00 0.00 62.40 62.57 1d2c h SER 71 CO 0.01 1.07 0.05 0.40 -1.14 0.00 0.00 176.83 177.21 1d2c h ILE 72 N 0.83 0.72 -0.99 3.27 2.04 -0.03 0.22 117.51 123.57 1d2c h ILE 72 Ca 0.14 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 66.03 1d2c h ILE 72 Cb 0.61 0.53 -0.07 0.00 -0.74 0.00 0.00 36.82 37.15 1d2c h ILE 72 CO 0.04 0.03 0.63 -0.03 0.00 0.00 0.00 178.15 178.82 1d2c h MET 73 N 0.17 1.04 -0.07 2.37 4.05 -1.48 0.20 114.93 121.21 1d2c h MET 73 Ca 0.22 -0.06 -0.21 0.00 -0.28 0.00 0.00 59.70 59.36 1d2c h MET 73 Cb 0.30 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 30.87 1d2c h MET 73 CO -0.32 0.69 -0.83 -0.07 0.23 0.00 0.00 176.91 176.61 1d2c h LEU 74 N 1.07 0.67 -0.85 3.39 3.38 -0.96 -2.42 115.31 119.58 1d2c h LEU 74 Ca 0.45 -0.47 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1d2c h LEU 74 Cb 0.31 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1d2c h LEU 74 CO -0.21 1.25 -0.11 0.58 0.09 0.00 0.00 178.44 180.03 1d2c h VAL 75 N 0.35 1.25 -0.03 1.22 2.07 -0.05 -2.07 116.25 118.99 1d2c h VAL 75 Ca -0.06 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.26 1d2c h VAL 75 Cb 1.44 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 1d2c h VAL 75 CO 0.15 0.39 -0.25 -0.33 0.02 0.00 0.00 177.57 177.56 1d2c h GLU 76 N 0.67 0.06 -1.13 1.57 5.08 -0.50 -2.96 114.58 117.37 1d2c h GLU 76 Ca 0.12 -0.02 -0.52 0.00 -1.00 0.00 0.00 59.36 57.94 1d2c h GLU 76 Cb 0.57 -0.01 -0.24 0.00 0.50 0.00 0.00 28.75 29.58 1d2c h GLU 76 CO 0.04 0.30 0.67 0.39 -1.00 0.00 0.00 179.01 179.41 1d2c n GLU 77 N -4.23 2.28 -0.65 2.33 -0.58 -0.88 -4.91 120.64 114.00 1d2c n GLU 77 Ca -0.02 -2.62 0.00 0.00 -0.42 0.00 0.00 57.16 54.10 1d2c n GLU 77 Cb 0.31 -2.03 0.00 0.00 -0.57 0.00 0.00 31.44 29.16 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 -0.58 0.27 3.79 0.62 0.00 -1.12 -4.98 105.19 103.19 1d2c n GLY 78 Ca 0.51 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.80 2.84 -0.82 1.61 0.40 -0.83 -4.97 117.98 114.40 1d2c s PHE 79 Ca 0.00 1.53 -0.18 0.00 -0.60 0.00 0.00 56.93 57.68 1d2c s PHE 79 Cb 0.00 -3.08 0.14 0.00 0.51 0.00 0.00 43.02 40.59 1d2c s PHE 79 CO 0.00 -1.35 0.96 0.45 0.70 0.00 0.00 175.22 175.98 1d2c s SER 80 N -2.68 6.53 -0.14 1.36 0.15 0.17 -4.54 113.70 114.56 1d2c s SER 80 Ca 0.65 -1.97 -0.01 0.00 0.70 0.00 0.00 55.95 55.33 1d2c s SER 80 Cb -0.18 -2.34 -0.01 0.00 -1.71 0.00 0.00 66.02 61.77 1d2c s SER 80 CO 0.38 -1.01 -0.12 0.54 1.20 0.00 0.00 173.24 174.24 1d2c s VAL 81 N 2.30 3.10 -0.17 4.45 0.11 -1.26 -0.61 120.40 128.32 1d2c s VAL 81 Ca 0.25 -0.64 -0.03 0.00 -2.93 0.00 0.00 61.98 58.63 1d2c s VAL 81 Cb -0.10 -2.31 -0.02 0.00 -1.53 0.00 0.00 36.38 32.41 1d2c s VAL 81 CO -0.05 0.51 -0.05 0.42 -3.33 0.00 0.00 175.10 172.61 1d2c s THR 82 N 0.47 3.65 -0.11 5.04 -4.23 -0.92 -3.10 115.64 116.45 1d2c s THR 82 Ca -0.09 -0.43 0.01 0.00 -1.18 0.00 0.00 61.69 60.00 1d2c s THR 82 Cb -0.16 -2.61 -0.02 0.00 1.34 0.00 0.00 72.50 71.06 1d2c s THR 82 CO 0.04 0.48 -0.13 -0.44 -0.54 0.00 0.00 174.62 174.03 1d2c s SER 83 N 0.64 4.08 0.09 3.99 0.01 0.57 -2.06 113.70 121.03 1d2c s SER 83 Ca -0.03 -0.27 0.05 0.00 1.31 0.00 0.00 55.95 57.00 1d2c s SER 83 Cb -0.15 -1.41 -0.03 0.00 0.21 0.00 0.00 66.02 64.64 1d2c s SER 83 CO 0.02 0.22 -0.12 0.68 0.41 0.00 0.00 173.24 174.45 1d2c s VAL 84 N 0.03 1.07 0.11 3.43 -7.23 -0.29 0.43 120.40 117.96 1d2c s VAL 84 Ca -0.04 -1.52 -0.21 0.00 -1.81 0.00 0.00 61.98 58.39 1d2c s VAL 84 Cb -0.14 -1.27 0.05 0.00 0.56 0.00 0.00 36.38 35.58 1d2c s VAL 84 CO 0.04 -0.41 0.52 -0.62 -0.31 0.00 0.00 175.10 174.32 1d2c s ASP 85 N -2.18 -0.44 0.00 4.85 3.68 -1.20 -1.42 116.67 119.96 1d2c s ASP 85 Ca 0.03 -0.02 0.23 0.00 2.13 0.00 0.00 52.55 54.92 1d2c s ASP 85 Cb -0.06 0.53 0.15 0.00 -1.45 0.00 0.00 42.92 42.09 1d2c s ASP 85 CO 0.02 -0.85 1.20 0.00 0.13 0.00 0.00 175.17 175.66 1d2c n ALA 86 N -0.08 3.31 -2.77 3.66 0.00 -1.05 -2.24 120.51 121.34 1d2c n ALA 86 Ca -0.17 -0.62 -0.40 0.00 0.00 0.00 0.00 53.44 52.25 1d2c n ALA 86 Cb 0.63 -0.85 -0.11 0.00 0.00 0.00 0.00 19.45 19.12 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 -2.40 5.75 0.09 0.00 0.15 -1.26 -4.95 113.70 111.08 1d2c s SER 87 Ca 0.21 -0.82 -0.18 0.00 0.70 0.00 0.00 55.95 55.86 1d2c s SER 87 Cb 0.19 -2.04 -0.08 0.00 -1.71 0.00 0.00 66.02 62.38 1d2c s SER 87 CO 0.52 -0.33 1.53 0.44 1.20 0.00 0.00 173.24 176.59 1d2c h ASP 88 N 8.44 0.44 -0.39 5.45 3.32 -1.98 0.15 116.42 131.86 1d2c h ASP 88 Ca -0.28 -0.30 0.11 0.00 0.02 0.00 0.00 57.03 56.58 1d2c h ASP 88 Cb 1.12 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 1d2c h ASP 88 CO 0.66 0.63 0.51 0.50 -1.72 0.00 0.00 179.24 179.83 1d2c h LYS 89 N 0.23 0.00 0.00 3.56 3.64 -2.01 0.11 116.57 122.10 1d2c h LYS 89 Ca 0.07 0.00 -0.39 0.00 -1.27 0.00 0.00 60.65 59.07 1d2c h LYS 89 Cb 0.40 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 1d2c h LYS 89 CO 0.01 0.00 -2.39 -1.33 -2.27 0.00 0.00 179.45 173.48 1d2c n MET 90 N -3.48 0.58 -0.27 1.90 2.81 -1.03 -4.36 117.12 113.27 1d2c n MET 90 Ca 0.07 0.18 0.19 0.00 -1.81 0.00 0.00 57.70 56.32 1d2c n MET 90 Cb 0.68 -1.45 0.48 0.00 -0.71 0.00 0.00 33.22 32.22 1d2c n MET 90 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1d2c h LEU 91 N -0.35 0.47 -1.98 4.03 5.85 -0.07 0.25 115.31 123.52 1d2c h LEU 91 Ca -0.58 0.05 0.22 0.00 0.84 0.00 0.00 57.88 58.42 1d2c h LEU 91 Cb 1.73 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.70 1d2c h LEU 91 CO -0.20 0.18 0.59 0.50 -0.34 0.00 0.00 178.44 179.16 1d2c h LYS 92 N 0.46 0.00 0.00 1.25 3.11 -1.19 -0.83 116.57 119.37 1d2c h LYS 92 Ca 0.50 0.00 -0.18 0.00 -2.81 0.00 0.00 60.65 58.16 1d2c h LYS 92 Cb 1.17 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.37 1d2c h LYS 92 CO -0.22 0.00 -0.87 1.88 -2.81 0.00 0.00 179.45 177.44 1d2c h TYR 93 N 0.00 0.00 0.15 1.91 0.05 -0.73 -2.91 116.97 115.44 1d2c h TYR 93 Ca 0.36 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.85 1d2c h TYR 93 Cb 1.53 0.00 0.01 0.00 1.01 0.00 0.00 36.73 39.28 1d2c h TYR 93 CO 0.00 0.87 -1.36 0.00 -1.05 0.00 0.00 178.16 176.62 1d2c h ALA 94 N 1.13 0.10 0.43 3.88 0.00 -1.16 -3.07 119.26 120.58 1d2c h ALA 94 Ca -0.01 -0.94 -0.02 0.00 0.00 0.00 0.00 54.91 53.94 1d2c h ALA 94 Cb 1.57 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1d2c h ALA 94 CO 0.11 0.97 -0.21 -0.07 0.00 0.00 0.00 179.25 180.06 1d2c h LEU 95 N 0.08 -0.49 -0.46 0.00 -0.00 -1.42 -1.23 115.31 111.78 1d2c h LEU 95 Ca -0.18 0.01 0.09 0.00 -0.00 0.00 0.00 57.88 57.80 1d2c h LEU 95 Cb 2.02 0.13 -0.09 0.00 -0.00 0.00 0.00 40.66 42.71 1d2c h LEU 95 CO 0.20 -0.34 -0.13 0.50 -0.00 0.00 0.00 178.44 178.68 1d2c h LYS 96 N -0.60 -0.01 -0.84 1.13 3.64 -1.61 0.11 116.57 118.39 1d2c h LYS 96 Ca -0.06 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1d2c h LYS 96 Cb 0.45 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.22 1d2c h LYS 96 CO 0.10 -0.01 0.55 1.49 -2.27 0.00 0.00 179.45 179.31 1d2c h GLU 97 N -0.01 0.88 -0.52 1.90 4.57 -1.40 -1.64 114.58 118.36 1d2c h GLU 97 Ca 0.22 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.27 1d2c h GLU 97 Cb 0.35 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 1d2c h GLU 97 CO -0.48 0.59 0.03 -0.09 -1.18 0.00 0.00 179.01 177.87 1d2c h ARG 98 N 0.91 0.90 0.25 1.92 2.43 0.23 -2.97 114.38 118.04 1d2c h ARG 98 Ca 0.37 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1d2c h ARG 98 Cb 0.25 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1d2c h ARG 98 CO -0.13 0.91 -0.12 2.35 -1.51 0.00 0.00 179.97 181.46 1d2c h TRP 99 N 0.77 -0.31 -0.13 2.20 2.91 -0.47 0.27 115.95 121.19 1d2c h TRP 99 Ca 0.15 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.20 1d2c h TRP 99 Cb 0.49 0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.23 1d2c h TRP 99 CO 0.04 -0.13 0.30 -0.91 -1.03 0.00 0.00 178.44 176.71 1d2c h ASN 100 N -0.43 0.00 -0.01 2.65 2.35 -1.32 -0.55 115.58 118.27 1d2c h ASN 100 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1d2c h ASN 100 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1d2c h ASN 100 CO 0.06 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.38 1d2c n ARG 101 N -3.28 2.43 0.00 0.81 1.74 -0.97 -4.77 116.66 112.63 1d2c n ARG 101 Ca 0.01 -1.88 0.00 0.00 -0.77 0.00 0.00 57.85 55.21 1d2c n ARG 101 Cb 0.39 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.66 1d2c n ARG 101 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1d2c n ARG 102 N -0.79 0.00 0.15 5.56 1.85 0.93 -1.21 116.66 123.15 1d2c n ARG 102 Ca 0.06 0.37 0.12 0.00 -1.00 0.00 0.00 57.85 57.39 1d2c n ARG 102 Cb 0.39 -1.60 0.16 0.00 -1.05 0.00 0.00 32.46 30.36 1d2c n ARG 102 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 1d2c h LYS 103 N 0.00 0.00 -5.83 2.89 6.56 -1.86 -3.39 116.57 114.95 1d2c h LYS 103 Ca 0.00 0.00 -0.60 0.00 -1.06 0.00 0.00 60.65 58.99 1d2c h LYS 103 Cb 0.20 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 31.75 1d2c h LYS 103 CO 0.00 0.00 0.43 -1.21 -2.06 0.00 0.00 179.45 176.61 1d2c s GLU 104 N -3.23 3.92 0.30 3.15 2.02 -0.35 -4.93 118.70 119.58 1d2c s GLU 104 Ca 0.05 0.56 0.17 0.00 0.02 0.00 0.00 54.97 55.77 1d2c s GLU 104 Cb 0.09 -3.75 1.11 0.00 0.10 0.00 0.00 34.13 31.68 1d2c s GLU 104 CO 0.70 -0.75 1.30 -0.35 0.02 0.00 0.00 175.26 176.18 1d2c n PRO 105 N 6.33 -0.05 -0.07 0.39 -0.04 -1.26 0.27 135.00 140.56 1d2c n PRO 105 Ca 0.04 1.13 -0.11 0.00 -0.04 0.00 0.00 63.50 64.53 1d2c n PRO 105 Cb 0.48 -2.04 -0.04 0.00 -0.04 0.00 0.00 33.50 31.86 1d2c n PRO 105 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d2c h ALA 106 N 1.64 0.30 0.00 0.55 0.00 -1.91 -2.52 119.26 117.31 1d2c h ALA 106 Ca 0.70 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1d2c h ALA 106 Cb 1.85 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1d2c h ALA 106 CO -0.63 -0.04 0.00 1.19 0.00 0.00 0.00 179.25 179.77 1d2c n PHE 107 N -4.73 0.38 0.07 0.00 3.01 0.14 -2.18 117.46 114.15 1d2c n PHE 107 Ca -0.04 0.14 -0.05 0.00 1.01 0.00 0.00 57.45 58.52 1d2c n PHE 107 Cb 0.19 -0.73 -0.09 0.00 -0.01 0.00 0.00 39.48 38.84 1d2c n PHE 107 CO 0.00 0.00 0.00 0.22 1.01 0.00 0.00 176.76 177.99 1d2c h ASP 108 N 0.00 0.00 -0.54 4.37 3.58 -0.97 -3.28 116.42 119.58 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 0.35 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.40 1d2c h ASP 108 CO 0.00 0.86 0.00 0.29 -2.88 0.00 0.00 179.24 177.51 1d2c n LYS 109 N -3.27 2.79 -3.00 0.28 4.01 -0.93 -4.90 118.16 113.14 1d2c n LYS 109 Ca -0.02 -2.16 -0.42 0.00 -0.51 0.00 0.00 58.31 55.21 1d2c n LYS 109 Cb 0.90 -1.62 -0.06 0.00 -0.51 0.00 0.00 35.03 33.74 1d2c n LYS 109 CO 0.00 0.00 0.00 -0.46 -1.11 0.00 0.00 177.40 175.83 1d2c s TRP 110 N -1.55 3.12 -0.21 2.13 -0.00 -1.20 -4.80 118.94 116.42 1d2c s TRP 110 Ca 0.39 0.48 -0.19 0.00 -0.00 0.00 0.00 56.10 56.78 1d2c s TRP 110 Cb 0.23 -3.34 -0.03 0.00 -0.00 0.00 0.00 33.47 30.33 1d2c s TRP 110 CO 0.22 -0.72 0.56 0.08 -0.00 0.00 0.00 176.95 177.10 1d2c s VAL 111 N 3.00 5.06 -0.26 5.86 1.01 -1.18 -4.98 120.40 128.91 1d2c s VAL 111 Ca 0.29 1.04 0.03 0.00 0.00 0.00 0.00 61.98 63.34 1d2c s VAL 111 Cb -0.13 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.43 1d2c s VAL 111 CO 0.17 0.13 -0.10 -0.63 0.00 0.00 0.00 175.10 174.66 1d2c s ILE 112 N 1.87 2.15 0.41 2.22 1.01 -1.26 0.21 121.20 127.81 1d2c s ILE 112 Ca 0.25 -1.65 0.06 0.00 0.00 0.00 0.00 60.65 59.32 1d2c s ILE 112 Cb -0.16 -2.28 -0.08 0.00 0.01 0.00 0.00 42.46 39.96 1d2c s ILE 112 CO 0.10 -0.05 0.02 -0.70 0.00 0.00 0.00 174.94 174.30 1d2c s GLU 113 N 1.10 1.94 -0.17 2.79 2.56 0.17 -4.96 118.70 122.14 1d2c s GLU 113 Ca -0.08 -2.10 -0.07 0.00 0.00 0.00 0.00 54.97 52.71 1d2c s GLU 113 Cb -0.20 -1.55 -0.04 0.00 2.00 0.00 0.00 34.13 34.34 1d2c s GLU 113 CO -0.05 -0.08 0.08 -1.21 -0.56 0.00 0.00 175.26 173.44 1d2c s GLU 114 N -3.74 3.84 0.08 4.30 2.02 -1.26 -3.22 118.70 120.73 1d2c s GLU 114 Ca 0.34 -0.29 -0.26 0.00 0.02 0.00 0.00 54.97 54.78 1d2c s GLU 114 Cb 0.09 -3.21 0.08 0.00 0.10 0.00 0.00 34.13 31.20 1d2c s GLU 114 CO 0.17 0.40 0.69 0.00 0.02 0.00 0.00 175.26 176.54 1d2c s ALA 115 N 0.02 -1.68 -0.10 5.21 0.00 -0.95 -4.89 121.76 119.36 1d2c s ALA 115 Ca 0.07 0.76 0.02 0.00 0.00 0.00 0.00 51.96 52.81 1d2c s ALA 115 Cb -0.12 0.61 0.01 0.00 0.00 0.00 0.00 23.12 23.62 1d2c s ALA 115 CO 0.00 -0.68 -0.17 1.21 0.00 0.00 0.00 175.76 176.12 1d2c s ASN 116 N -2.42 2.51 0.32 0.00 3.04 -1.26 -2.54 114.94 114.59 1d2c s ASN 116 Ca 0.00 -0.45 0.10 0.00 0.04 0.00 0.00 52.86 52.55 1d2c s ASN 116 Cb -0.01 -1.14 0.89 0.00 -1.54 0.00 0.00 41.25 39.45 1d2c s ASN 116 CO -0.08 0.06 1.72 -0.50 -3.04 0.00 0.00 177.10 175.26 1d2c h TRP 117 N 7.13 1.01 -0.29 0.43 6.55 -1.93 0.99 115.95 129.84 1d2c h TRP 117 Ca -0.28 0.04 0.08 0.00 0.95 0.00 0.00 58.89 59.67 1d2c h TRP 117 Cb 1.20 -0.29 -0.01 0.00 -0.86 0.00 0.00 29.16 29.20 1d2c h TRP 117 CO 0.48 0.05 0.21 -0.07 -1.05 0.00 0.00 178.44 178.06 1d2c h LEU 118 N 0.57 0.04 -2.61 -4.49 -0.00 -1.89 -2.45 115.31 104.47 1d2c h LEU 118 Ca 0.65 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.52 1d2c h LEU 118 Cb 1.24 -0.01 -0.03 0.00 -0.00 0.00 0.00 40.66 41.87 1d2c h LEU 118 CO -0.48 0.02 -0.32 0.35 -0.00 0.00 0.00 178.44 178.01 1d2c n THR 119 N -4.46 1.03 -0.30 0.22 -2.24 0.60 -4.84 114.28 104.29 1d2c n THR 119 Ca 0.04 -1.37 0.14 0.00 -2.27 0.00 0.00 64.05 60.59 1d2c n THR 119 Cb 0.35 0.14 0.31 0.00 -2.10 0.00 0.00 70.33 69.03 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 0.16 -0.01 -2.05 3.22 5.85 0.14 0.21 115.31 122.83 1d2c h LEU 120 Ca -0.02 0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.95 1d2c h LEU 120 Cb 1.23 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.53 1d2c h LEU 120 CO 0.01 -0.18 0.11 -2.24 -0.34 0.00 0.00 178.44 175.80 1d2c h ASP 121 N 0.19 0.00 0.89 1.25 2.03 -1.84 -2.07 116.42 116.86 1d2c h ASP 121 Ca 0.57 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.69 1d2c h ASP 121 Cb 1.18 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.65 1d2c h ASP 121 CO -0.68 0.00 -1.20 0.11 -1.03 0.00 0.00 179.24 176.44 1d2c h LYS 122 N 0.00 0.00 0.02 4.15 1.57 -0.98 -3.38 116.57 117.94 1d2c h LYS 122 Ca 0.07 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.55 1d2c h LYS 122 Cb 0.29 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1d2c h LYS 122 CO -0.00 0.49 -1.72 -0.44 -0.57 0.00 0.00 179.45 177.21 1d2c h ASP 123 N 0.00 0.07 -3.30 0.86 3.32 -1.07 -3.46 116.42 112.83 1d2c h ASP 123 Ca -0.13 -0.15 -0.68 0.00 0.02 0.00 0.00 57.03 56.10 1d2c h ASP 123 Cb 1.66 -0.02 -0.33 0.00 0.22 0.00 0.00 39.33 40.85 1d2c h ASP 123 CO 0.07 1.13 -0.88 -0.69 -1.72 0.00 0.00 179.24 177.16 1d2c s VAL 124 N -2.60 2.05 -0.89 -1.35 1.01 -0.82 -5.00 120.40 112.80 1d2c s VAL 124 Ca -0.07 -1.00 -0.22 0.00 0.00 0.00 0.00 61.98 60.69 1d2c s VAL 124 Cb 0.08 -1.79 0.08 0.00 0.00 0.00 0.00 36.38 34.75 1d2c s VAL 124 CO 0.82 0.56 1.23 -2.16 0.00 0.00 0.00 175.10 175.54 1d2c s PRO 125 N 0.49 3.46 0.39 2.72 0.05 -1.26 -4.73 135.00 136.12 1d2c s PRO 125 Ca -0.15 -1.21 0.11 0.00 0.05 0.00 0.00 61.00 59.80 1d2c s PRO 125 Cb -0.17 -4.87 0.80 0.00 0.05 0.00 0.00 34.50 30.31 1d2c s PRO 125 CO 0.06 -1.97 1.90 0.00 0.05 0.00 0.00 177.00 177.04 1d2c h ALA 126 N 9.43 1.50 -0.45 8.56 0.00 -1.94 -3.47 119.26 132.89 1d2c h ALA 126 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1d2c h ALA 126 Cb 1.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1d2c h ALA 126 CO 1.25 0.36 0.00 0.41 0.00 0.00 0.00 179.25 181.27 1d2c n GLY 127 N -0.79 1.29 0.62 0.00 0.00 -1.26 -0.91 105.19 104.14 1d2c n GLY 127 Ca -0.01 0.25 0.06 0.00 0.00 0.00 0.00 46.02 46.31 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 7.02 2.75 0.00 1.61 8.00 -1.26 -5.09 116.55 129.58 1d2c n ASP 128 Ca 0.00 -1.89 0.00 0.00 0.71 0.00 0.00 54.79 53.61 1d2c n ASP 128 Cb 0.00 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 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 0.58 0.87 3.94 0.44 0.00 -0.09 -4.22 105.19 106.71 1d2c n GLY 129 Ca 0.11 -1.76 -0.24 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.97 3.50 0.11 1.61 0.40 0.22 -4.41 117.98 116.44 1d2c s PHE 130 Ca 0.00 0.37 -0.15 0.00 -0.60 0.00 0.00 56.93 56.54 1d2c s PHE 130 Cb 0.00 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.58 1d2c s PHE 130 CO 0.00 0.15 1.53 -0.44 0.70 0.00 0.00 175.22 177.16 1d2c h ASP 131 N 0.92 0.65 -4.81 1.36 3.45 -1.36 -1.46 116.42 115.16 1d2c h ASP 131 Ca -0.49 -0.34 -0.24 0.00 0.43 0.00 0.00 57.03 56.39 1d2c h ASP 131 Cb 1.21 -0.18 -0.20 0.00 -0.56 0.00 0.00 39.33 39.61 1d2c h ASP 131 CO 0.62 0.83 -0.72 0.00 -1.57 0.00 0.00 179.24 178.40 1d2c s ALA 132 N -4.89 0.52 -0.05 3.45 0.00 -1.10 0.07 121.76 119.76 1d2c s ALA 132 Ca -0.13 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1d2c s ALA 132 Cb 0.09 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.32 1d2c s ALA 132 CO 0.79 -0.08 -0.05 0.08 0.00 0.00 0.00 175.76 176.50 1d2c s VAL 133 N -1.70 0.60 0.13 0.00 1.01 -1.07 -1.53 120.40 117.84 1d2c s VAL 133 Ca -0.08 -0.14 0.10 0.00 0.00 0.00 0.00 61.98 61.86 1d2c s VAL 133 Cb -0.08 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 1d2c s VAL 133 CO -0.01 0.25 -0.24 0.27 0.00 0.00 0.00 175.10 175.37 1d2c s ILE 134 N 1.04 2.06 -0.44 2.22 -4.36 -0.33 -0.42 121.20 120.96 1d2c s ILE 134 Ca -0.09 -1.73 0.07 0.00 -0.26 0.00 0.00 60.65 58.64 1d2c s ILE 134 Cb -0.14 -1.86 0.28 0.00 1.25 0.00 0.00 42.46 41.99 1d2c s ILE 134 CO -0.01 -0.01 0.86 0.00 0.24 0.00 0.00 174.94 176.02 1d2c s LEU 136 N -1.48 3.20 0.00 0.00 1.02 -1.26 -3.13 118.68 117.03 1d2c s LEU 136 Ca 0.31 -0.08 0.00 0.00 0.02 0.00 0.00 54.13 54.38 1d2c s LEU 136 Cb 0.25 -2.69 0.00 0.00 0.02 0.00 0.00 46.19 43.77 1d2c s LEU 136 CO -0.14 -1.29 0.00 0.61 0.02 0.00 0.00 176.35 175.55 1d2c n GLY 137 N -2.44 0.72 2.61 -3.19 0.00 -1.26 -3.93 105.19 97.70 1d2c n GLY 137 Ca 0.09 -0.25 -0.19 0.00 0.00 0.00 0.00 46.02 45.68 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 0.45 -5.52 0.14 1.61 5.15 -1.26 -4.91 115.26 110.91 1d2c n ASN 138 Ca 0.00 -0.13 0.00 0.00 -0.60 0.00 0.00 54.58 53.85 1d2c n ASN 138 Cb 0.00 -4.47 0.17 0.00 -0.53 0.00 0.00 39.78 34.95 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 -0.61 0.00 -0.10 1.20 0.02 -1.80 -3.15 113.55 109.12 1d2c h SER 139 Ca -0.46 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.44 1d2c h SER 139 Cb 1.33 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 1d2c h SER 139 CO 0.52 0.59 -0.07 0.15 -1.14 0.00 0.00 176.83 176.87 1d2c h PHE 140 N 0.00 0.39 -0.05 3.45 3.57 -1.83 -2.21 116.94 120.25 1d2c h PHE 140 Ca -0.01 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.47 1d2c h PHE 140 Cb 1.15 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 1d2c h PHE 140 CO 0.00 0.45 0.36 0.00 -2.23 0.00 0.00 178.31 176.88 1d2c h ALA 141 N 1.58 1.45 -0.36 2.41 0.00 -1.85 -2.01 119.26 120.47 1d2c h ALA 141 Ca 0.07 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1d2c h ALA 141 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1d2c h ALA 141 CO 0.02 -0.38 -0.15 0.45 0.00 0.00 0.00 179.25 179.18 1d2c h HIS 142 N 0.00 0.72 -2.72 0.00 3.86 -1.58 0.23 115.15 115.65 1d2c h HIS 142 Ca 0.03 -0.13 -0.56 0.00 -1.16 0.00 0.00 60.37 58.54 1d2c h HIS 142 Cb 0.74 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 1d2c h HIS 142 CO 0.00 0.77 1.15 -1.17 0.86 0.00 0.00 177.93 179.54 1d2c s LEU 143 N -8.90 3.89 0.82 2.43 2.96 -0.76 -4.80 118.68 114.32 1d2c s LEU 143 Ca -0.08 1.67 -0.12 0.00 -0.22 0.00 0.00 54.13 55.37 1d2c s LEU 143 Cb 0.14 -3.53 0.09 0.00 0.50 0.00 0.00 46.19 43.38 1d2c s LEU 143 CO 0.81 -1.28 1.17 -2.16 -1.32 0.00 0.00 176.35 173.56 1d2c s PRO 144 N 4.75 1.87 -0.62 0.98 0.04 -1.26 -4.61 135.00 136.14 1d2c s PRO 144 Ca 0.73 0.18 -0.09 0.00 0.04 0.00 0.00 61.00 61.86 1d2c s PRO 144 Cb -0.26 -1.93 0.16 0.00 0.04 0.00 0.00 34.50 32.51 1d2c s PRO 144 CO 0.30 -1.67 0.50 0.34 0.04 0.00 0.00 177.00 176.51 1d2c s ASP 145 N -4.45 5.85 0.06 6.66 3.68 -1.26 -4.83 116.67 122.39 1d2c s ASP 145 Ca 0.62 -2.45 -0.02 0.00 2.13 0.00 0.00 52.55 52.83 1d2c s ASP 145 Cb -0.12 -2.02 -0.27 0.00 -1.45 0.00 0.00 42.92 39.06 1d2c s ASP 145 CO 0.50 -0.55 1.09 0.28 0.13 0.00 0.00 175.17 176.62 1d2c h SER 146 N 7.79 0.36 1.33 -0.34 0.02 -1.96 -3.35 113.55 117.41 1d2c h SER 146 Ca -0.06 -0.41 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1d2c h SER 146 Cb 1.02 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1d2c h SER 146 CO 0.78 1.32 -0.17 0.29 -1.14 0.00 0.00 176.83 177.92 1d2c n LYS 147 N -3.48 0.28 0.00 3.45 5.02 -1.26 -4.95 118.16 117.22 1d2c n LYS 147 Ca -0.09 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1d2c n LYS 147 Cb 1.02 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 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 1.31 2.83 3.72 0.72 0.00 -1.26 -4.97 105.19 107.54 1d2c n GLY 148 Ca 0.05 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 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 6.42 0.00 1.61 -4.77 -1.26 -4.95 116.67 113.72 1d2c s ASP 149 Ca 0.00 0.48 -0.01 0.00 -3.30 0.00 0.00 52.55 49.72 1d2c s ASP 149 Cb 0.00 -2.18 -0.05 0.00 -1.09 0.00 0.00 42.92 39.60 1d2c s ASP 149 CO 0.00 0.09 1.04 0.00 0.70 0.00 0.00 175.17 177.00 1d2c n GLN 150 N 3.65 0.39 0.32 2.11 6.02 -1.26 -4.34 117.38 124.27 1d2c n GLN 150 Ca -0.12 -0.18 -0.17 0.00 -0.01 0.00 0.00 57.00 56.52 1d2c n GLN 150 Cb 0.52 -1.57 -0.09 0.00 1.02 0.00 0.00 30.24 30.12 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 5.05 -0.66 -0.67 1.08 4.64 -1.96 -1.32 113.55 119.70 1d2c h SER 151 Ca 0.03 0.01 0.09 0.00 -0.47 0.00 0.00 61.79 61.45 1d2c h SER 151 Cb 0.30 0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 62.50 1d2c h SER 151 CO 0.37 -0.45 0.32 -0.33 -0.87 0.00 0.00 176.83 175.87 1d2c h GLU 152 N -0.82 0.53 -0.83 4.77 5.08 -1.94 0.20 114.58 121.58 1d2c h GLU 152 Ca -0.08 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1d2c h GLU 152 Cb 0.62 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.69 1d2c h GLU 152 CO 0.13 0.35 0.51 0.45 -1.00 0.00 0.00 179.01 179.45 1d2c h HIS 153 N 0.55 0.93 -0.08 4.33 3.86 -1.83 0.10 115.15 123.01 1d2c h HIS 153 Ca 0.33 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.56 1d2c h HIS 153 Cb 0.35 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 1d2c h HIS 153 CO -0.12 0.47 0.00 0.00 0.86 0.00 0.00 177.93 179.14 1d2c h ARG 154 N 0.92 0.14 0.05 2.45 3.08 0.09 -2.05 114.38 119.06 1d2c h ARG 154 Ca 0.36 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.38 1d2c h ARG 154 Cb 0.17 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1d2c h ARG 154 CO -0.17 0.40 -0.14 1.25 -1.07 0.00 0.00 179.97 180.23 1d2c h LEU 155 N -0.14 -0.40 -0.33 3.04 5.85 -0.12 -0.72 115.31 122.50 1d2c h LEU 155 Ca 0.02 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.87 1d2c h LEU 155 Cb 0.33 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 1d2c h LEU 155 CO 0.00 -0.21 -0.31 0.00 -0.34 0.00 0.00 178.44 177.58 1d2c h ALA 156 N 0.63 -0.21 0.00 1.25 0.00 -0.81 -0.81 119.26 119.31 1d2c h ALA 156 Ca 0.03 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1d2c h ALA 156 Cb 0.30 0.66 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1d2c h ALA 156 CO -0.10 -0.73 -0.04 -0.07 0.00 0.00 0.00 179.25 178.31 1d2c h LEU 157 N -0.28 0.00 0.14 0.00 4.07 -1.03 -1.78 115.31 116.44 1d2c h LEU 157 Ca 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.11 1d2c h LEU 157 Cb 0.53 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1d2c h LEU 157 CO -0.49 0.04 -0.07 0.50 -1.08 0.00 0.00 178.44 177.34 1d2c h LYS 158 N 0.00 -0.19 -0.55 1.13 3.64 0.27 -2.71 116.57 118.16 1d2c h LYS 158 Ca -0.00 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1d2c h LYS 158 Cb 0.16 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 31.94 1d2c h LYS 158 CO 0.00 0.14 0.11 -0.91 -2.27 0.00 0.00 179.45 176.53 1d2c h ASN 159 N -0.98 -0.00 -0.68 4.20 -0.26 -1.17 -0.93 115.58 115.75 1d2c h ASN 159 Ca -0.02 0.10 0.04 0.00 -0.56 0.00 0.00 56.30 55.86 1d2c h ASN 159 Cb 0.41 0.14 -0.05 0.00 -1.06 0.00 0.00 38.32 37.77 1d2c h ASN 159 CO 0.03 0.02 0.41 0.40 -1.06 0.00 0.00 177.43 177.23 1d2c h ILE 160 N 0.25 1.04 -0.58 2.81 2.04 -1.43 -2.25 117.51 119.40 1d2c h ILE 160 Ca 0.28 -0.27 -0.08 0.00 1.00 0.00 0.00 64.86 65.79 1d2c h ILE 160 Cb 0.40 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1d2c h ILE 160 CO -0.37 0.14 0.04 0.00 0.00 0.00 0.00 178.15 177.96 1d2c h ALA 161 N 1.32 0.97 0.00 1.87 0.00 -0.96 -2.85 119.26 119.62 1d2c h ALA 161 Ca 0.29 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1d2c h ALA 161 Cb 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1d2c h ALA 161 CO -0.14 0.63 0.00 -1.13 0.00 0.00 0.00 179.25 178.62 1d2c n SER 162 N -4.20 0.59 0.05 0.00 3.41 -0.45 -1.14 113.62 111.88 1d2c n SER 162 Ca 0.03 0.74 0.13 0.00 -0.26 0.00 0.00 58.87 59.52 1d2c n SER 162 Cb 0.31 -0.83 0.47 0.00 -0.26 0.00 0.00 64.21 63.90 1d2c n SER 162 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1d2c n MET 163 N -2.26 0.14 -2.84 4.33 2.81 -1.07 -4.78 117.12 113.45 1d2c n MET 163 Ca -0.01 0.10 -0.42 0.00 -1.81 0.00 0.00 57.70 55.57 1d2c n MET 163 Cb 0.08 -1.65 -0.04 0.00 -0.71 0.00 0.00 33.22 30.91 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 -3.06 4.81 0.54 2.03 1.01 -0.29 0.68 120.40 126.12 1d2c s VAL 164 Ca 0.12 1.68 -0.18 0.00 0.00 0.00 0.00 61.98 63.60 1d2c s VAL 164 Cb 0.16 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1d2c s VAL 164 CO 0.58 -0.08 1.06 0.00 0.00 0.00 0.00 175.10 176.67 1d2c s ARG 165 N 2.78 3.53 0.40 2.72 1.70 -0.55 -4.76 118.95 124.77 1d2c s ARG 165 Ca 0.38 1.34 -0.26 0.00 -0.47 0.00 0.00 55.73 56.72 1d2c s ARG 165 Cb -0.15 -2.05 -0.11 0.00 -0.57 0.00 0.00 34.95 32.06 1d2c s ARG 165 CO 0.08 -0.65 1.17 -2.30 -1.08 0.00 0.00 175.30 172.52 1d2c n PRO 166 N -1.44 1.73 -0.77 3.89 -0.02 -1.26 0.41 135.00 137.54 1d2c n PRO 166 Ca 0.09 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1d2c n PRO 166 Cb 0.52 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 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 0.95 1.23 3.96 -1.23 0.00 0.16 -4.99 105.19 105.28 1d2c n GLY 167 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1d2c n GLY 167 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1d2c s GLY 168 N -2.00 1.76 0.37 -0.02 0.00 0.17 -4.81 107.32 102.78 1d2c s GLY 168 Ca 0.00 -1.41 0.08 0.00 0.00 0.00 0.00 44.72 43.38 1d2c s GLY 168 CO 0.00 -0.81 0.19 1.08 0.00 0.00 0.00 173.10 173.56 1d2c s LEU 169 N -5.40 3.27 -0.23 0.66 1.02 0.11 -1.47 118.68 116.64 1d2c s LEU 169 Ca 0.68 -0.82 -0.03 0.00 0.02 0.00 0.00 54.13 53.97 1d2c s LEU 169 Cb -0.06 -1.74 0.12 0.00 0.02 0.00 0.00 46.19 44.53 1d2c s LEU 169 CO 0.47 -0.40 0.34 -0.22 0.02 0.00 0.00 176.35 176.56 1d2c s LEU 170 N -3.90 -0.50 -0.22 1.79 2.96 -0.86 -2.60 118.68 115.34 1d2c s LEU 170 Ca 0.40 0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 54.44 1d2c s LEU 170 Cb -0.01 0.95 -0.02 0.00 0.50 0.00 0.00 46.19 47.60 1d2c s LEU 170 CO 0.24 -0.30 0.01 -0.69 -1.32 0.00 0.00 176.35 174.28 1d2c s VAL 171 N 2.49 3.89 -0.13 1.68 1.01 0.43 -0.90 120.40 128.88 1d2c s VAL 171 Ca 0.10 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 1d2c s VAL 171 Cb -0.15 -2.78 0.05 0.00 0.00 0.00 0.00 36.38 33.50 1d2c s VAL 171 CO -0.14 0.41 0.33 -0.51 0.00 0.00 0.00 175.10 175.18 1d2c s ILE 172 N 1.27 -0.03 0.47 2.22 2.07 0.22 -1.15 121.20 126.27 1d2c s ILE 172 Ca 0.04 0.09 0.03 0.00 -1.41 0.00 0.00 60.65 59.40 1d2c s ILE 172 Cb -0.15 -0.48 -0.03 0.00 0.13 0.00 0.00 42.46 41.93 1d2c s ILE 172 CO 0.01 0.04 0.02 1.51 -1.91 0.00 0.00 174.94 174.61 1d2c s ASP 173 N 1.06 3.87 0.12 4.50 3.84 -1.18 -0.40 116.67 128.47 1d2c s ASP 173 Ca -0.07 -1.57 -0.24 0.00 -0.00 0.00 0.00 52.55 50.67 1d2c s ASP 173 Cb -0.08 0.24 0.07 0.00 -1.38 0.00 0.00 42.92 41.77 1d2c s ASP 173 CO -0.08 -0.74 0.61 -1.38 -0.00 0.00 0.00 175.17 173.58 1d2c s HIS 174 N -2.88 -0.55 0.89 2.11 -3.43 -0.87 -4.37 115.29 106.19 1d2c s HIS 174 Ca 0.17 0.47 -0.12 0.00 -0.80 0.00 0.00 55.06 54.77 1d2c s HIS 174 Cb 0.04 0.52 0.13 0.00 -1.43 0.00 0.00 32.58 31.84 1d2c s HIS 174 CO 0.09 -0.80 1.15 0.50 -2.00 0.00 0.00 174.74 173.68 1d2c s ARG 175 N -3.25 1.29 -1.30 -0.38 3.52 -1.26 -0.59 118.95 116.97 1d2c s ARG 175 Ca -0.01 0.22 -0.18 0.00 -0.13 0.00 0.00 55.73 55.63 1d2c s ARG 175 Cb -0.01 -1.86 0.05 0.00 -1.56 0.00 0.00 34.95 31.57 1d2c s ARG 175 CO -0.08 -2.08 1.80 -1.71 -0.81 0.00 0.00 175.30 172.42 1d2c n ASN 176 N -3.67 4.69 0.14 -2.12 4.05 -0.31 -4.65 115.26 113.39 1d2c n ASN 176 Ca 0.07 -2.90 -0.01 0.00 0.45 0.00 0.00 54.58 52.20 1d2c n ASN 176 Cb 0.60 -1.73 0.19 0.00 1.23 0.00 0.00 39.78 40.06 1d2c n ASN 176 CO 0.00 0.00 0.00 1.88 -3.05 0.00 0.00 177.26 176.09 1d2c h TYR 177 N 7.55 0.00 -0.22 1.20 0.05 -1.90 -2.49 116.97 121.16 1d2c h TYR 177 Ca 0.45 0.00 0.06 0.00 0.05 0.00 0.00 58.73 59.28 1d2c h TYR 177 Cb 0.85 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.53 1d2c h TYR 177 CO 1.42 0.59 -0.16 -0.44 -1.05 0.00 0.00 178.16 178.53 1d2c h ASP 178 N 0.00 -0.51 -0.67 3.88 3.32 -1.85 0.88 116.42 121.47 1d2c h ASP 178 Ca -0.01 0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1d2c h ASP 178 Cb 1.06 0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.84 1d2c h ASP 178 CO 0.08 -0.20 0.22 0.22 -1.72 0.00 0.00 179.24 177.84 1d2c h TYR 179 N -0.15 1.07 0.69 4.55 5.03 -1.94 -2.41 116.97 123.81 1d2c h TYR 179 Ca 0.13 -0.10 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 1d2c h TYR 179 Cb 0.34 -0.31 0.01 0.00 1.55 0.00 0.00 36.73 38.32 1d2c h TYR 179 CO -0.32 0.86 -0.33 0.82 -1.32 0.00 0.00 178.16 177.87 1d2c h ILE 180 N 0.97 0.31 -1.03 1.81 2.04 -0.74 -2.08 117.51 118.78 1d2c h ILE 180 Ca 0.22 -0.06 0.26 0.00 1.00 0.00 0.00 64.86 66.27 1d2c h ILE 180 Cb 0.29 0.33 -0.09 0.00 -0.74 0.00 0.00 36.82 36.60 1d2c h ILE 180 CO -0.01 0.01 0.67 -0.07 0.00 0.00 0.00 178.15 178.75 1d2c h LEU 181 N -0.97 0.43 0.00 1.44 4.07 0.81 1.58 115.31 122.66 1d2c h LEU 181 Ca -0.09 0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.94 1d2c h LEU 181 Cb 0.72 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.46 1d2c h LEU 181 CO 0.15 0.10 -0.53 0.77 -1.08 0.00 0.00 178.44 177.85 1d2c h SER 182 N 0.38 0.00 0.00 -0.43 4.64 -1.27 -3.32 113.55 113.55 1d2c h SER 182 Ca 0.58 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.79 1d2c h SER 182 Cb 1.48 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1d2c h SER 182 CO -0.27 0.05 -1.70 0.41 -0.87 0.00 0.00 176.83 174.45 1d2c n THR 183 N -2.43 0.02 -0.86 2.95 -1.04 -0.05 -4.96 114.28 107.91 1d2c n THR 183 Ca 0.03 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 1d2c n THR 183 Cb 0.48 0.14 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 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 1.66 0.34 3.07 3.41 0.00 0.52 -4.95 105.19 109.24 1d2c n GLY 184 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.13 3.01 0.18 0.00 0.00 -1.26 -4.46 121.76 119.10 1d2c s ALA 186 Ca 0.02 -2.65 -0.32 0.00 0.00 0.00 0.00 51.96 49.01 1d2c s ALA 186 Cb -0.07 -2.08 -0.16 0.00 0.00 0.00 0.00 23.12 20.81 1d2c s ALA 186 CO 0.00 -1.76 1.05 -2.30 0.00 0.00 0.00 175.76 172.75 1d2c n PRO 187 N 4.14 0.96 -2.35 0.00 -0.02 -1.26 -4.92 135.00 131.55 1d2c n PRO 187 Ca 0.03 0.34 -0.24 0.00 -2.02 0.00 0.00 63.50 61.61 1d2c n PRO 187 Cb 0.41 -1.76 0.06 0.00 -0.02 0.00 0.00 33.50 32.19 1d2c n PRO 187 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1d2c s PRO 188 N -0.62 2.33 0.00 0.52 0.04 -1.26 -4.22 135.00 131.79 1d2c s PRO 188 Ca 0.71 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.33 1d2c s PRO 188 Cb -0.87 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1d2c s PRO 188 CO 0.54 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.94 1d2c n GLY 189 N -2.72 0.00 3.43 0.56 0.00 -1.26 -4.83 105.19 100.37 1d2c n GLY 189 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.77 4.09 0.11 1.61 1.02 -1.26 -4.82 119.74 119.73 1d2c s LYS 190 Ca 0.00 -2.68 0.09 0.00 0.02 0.00 0.00 55.97 53.39 1d2c s LYS 190 Cb 0.00 -4.94 -0.04 0.00 -0.52 0.00 0.00 37.83 32.33 1d2c s LYS 190 CO 0.00 -1.65 -0.17 1.21 -0.92 0.00 0.00 175.35 173.82 1d2c s ASN 191 N 2.53 3.92 -0.09 2.83 3.84 -1.26 -5.02 114.94 121.68 1d2c s ASN 191 Ca 0.39 -0.54 0.13 0.00 0.21 0.00 0.00 52.86 53.05 1d2c s ASN 191 Cb -0.05 -0.57 -0.19 0.00 -0.55 0.00 0.00 41.25 39.90 1d2c s ASN 191 CO -0.02 0.18 0.14 2.30 -2.79 0.00 0.00 177.10 176.91 1d2c n ILE 192 N 0.82 0.60 -0.02 -5.21 -5.35 -1.26 -4.67 119.36 104.27 1d2c n ILE 192 Ca -0.15 -0.49 -0.16 0.00 -0.27 0.00 0.00 62.75 61.68 1d2c n ILE 192 Cb 0.53 -0.36 -0.12 0.00 -1.74 0.00 0.00 39.64 37.95 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 0.30 -3.95 4.28 -1.99 -1.95 -3.41 116.97 110.24 1d2c h TYR 193 Ca -0.24 -0.18 -0.23 0.00 2.00 0.00 0.00 58.73 60.08 1d2c h TYR 193 Cb 1.42 -0.03 -0.19 0.00 2.00 0.00 0.00 36.73 39.93 1d2c h TYR 193 CO 0.00 1.04 -0.71 0.71 -0.00 0.00 0.00 178.16 179.19 1d2c s TYR 194 N -2.85 0.67 -0.38 4.88 2.02 -1.26 -1.29 117.35 119.14 1d2c s TYR 194 Ca -0.16 -0.68 -0.18 0.00 -0.37 0.00 0.00 57.07 55.69 1d2c s TYR 194 Cb 0.00 -0.41 0.00 0.00 -0.40 0.00 0.00 41.96 41.16 1d2c s TYR 194 CO 0.76 -0.14 0.48 -1.59 -1.57 0.00 0.00 175.55 173.49 1d2c s LYS 195 N -2.44 3.45 -0.24 -0.62 -2.85 0.45 -4.64 119.74 112.84 1d2c s LYS 195 Ca -0.03 -0.38 -0.29 0.00 -1.00 0.00 0.00 55.97 54.28 1d2c s LYS 195 Cb -0.04 -3.86 0.01 0.00 -2.06 0.00 0.00 37.83 31.88 1d2c s LYS 195 CO -0.02 -0.71 1.11 -1.12 0.10 0.00 0.00 175.35 174.71 1d2c s SER 196 N 1.80 7.00 0.00 0.03 0.01 -1.26 -4.48 113.70 116.79 1d2c s SER 196 Ca 0.16 1.36 0.28 0.00 1.31 0.00 0.00 55.95 59.07 1d2c s SER 196 Cb -0.16 -2.54 1.04 0.00 0.21 0.00 0.00 66.02 64.57 1d2c s SER 196 CO 0.14 -0.76 1.74 0.47 0.41 0.00 0.00 173.24 175.23 1d2c n ASP 197 N 6.60 0.73 -4.90 2.44 8.00 -1.26 -4.88 116.55 123.27 1d2c n ASP 197 Ca 0.13 -0.73 -0.29 0.00 0.71 0.00 0.00 54.79 54.60 1d2c n ASP 197 Cb 0.46 0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.54 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 -2.47 4.13 -0.26 0.64 2.96 -1.26 -5.08 118.68 117.35 1d2c s LEU 198 Ca 0.27 0.67 -0.07 0.00 -0.22 0.00 0.00 54.13 54.78 1d2c s LEU 198 Cb 0.20 -3.46 -0.02 0.00 0.50 0.00 0.00 46.19 43.41 1d2c s LEU 198 CO 0.49 -0.12 0.06 -0.89 -1.32 0.00 0.00 176.35 174.57 1d2c s THR 199 N -1.96 4.16 0.02 3.68 2.01 -1.26 -4.99 115.64 117.30 1d2c s THR 199 Ca 0.43 -0.30 -0.03 0.00 0.31 0.00 0.00 61.69 62.11 1d2c s THR 199 Cb -0.11 -2.98 -0.02 0.00 0.01 0.00 0.00 72.50 69.41 1d2c s THR 199 CO 0.28 0.30 0.03 -1.59 -0.69 0.00 0.00 174.62 172.95 1d2c s LYS 200 N 1.58 0.42 0.00 4.92 -2.85 -1.26 -1.92 119.74 120.63 1d2c s LYS 200 Ca 0.06 -0.63 0.03 0.00 -1.00 0.00 0.00 55.97 54.43 1d2c s LYS 200 Cb -0.15 0.16 -0.03 0.00 -2.06 0.00 0.00 37.83 35.74 1d2c s LYS 200 CO 0.03 -0.08 -0.06 0.34 0.10 0.00 0.00 175.35 175.67 1d2c s ASP 201 N -1.66 4.64 -0.08 0.03 -1.08 -0.55 -4.77 116.67 113.21 1d2c s ASP 201 Ca -0.12 -0.14 0.01 0.00 -0.52 0.00 0.00 52.55 51.78 1d2c s ASP 201 Cb -0.07 -1.09 0.02 0.00 -1.46 0.00 0.00 42.92 40.32 1d2c s ASP 201 CO -0.02 0.28 -0.08 -0.63 0.52 0.00 0.00 175.17 175.25 1d2c s ILE 202 N -0.99 0.91 -0.26 4.11 1.01 -1.26 -1.68 121.20 123.04 1d2c s ILE 202 Ca 0.17 -0.28 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 1d2c s ILE 202 Cb -0.11 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.41 1d2c s ILE 202 CO 0.07 0.33 0.14 -0.89 0.00 0.00 0.00 174.94 174.59 1d2c s THR 203 N 1.23 5.03 -0.18 2.92 2.01 -1.17 -4.91 115.64 120.58 1d2c s THR 203 Ca -0.05 0.07 -0.08 0.00 0.31 0.00 0.00 61.69 61.95 1d2c s THR 203 Cb -0.14 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1d2c s THR 203 CO -0.02 0.31 0.07 -0.89 -0.69 0.00 0.00 174.62 173.40 1d2c s THR 204 N 1.46 4.87 -0.09 -0.82 2.01 -1.26 -2.18 115.64 119.62 1d2c s THR 204 Ca 0.07 -0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.10 1d2c s THR 204 Cb -0.15 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.17 1d2c s THR 204 CO 0.07 0.47 -0.22 -0.44 -0.69 0.00 0.00 174.62 173.81 1d2c s SER 205 N 0.28 2.81 -0.19 3.53 0.01 -0.01 -4.93 113.70 115.19 1d2c s SER 205 Ca 0.04 -0.50 -0.02 0.00 1.31 0.00 0.00 55.95 56.78 1d2c s SER 205 Cb -0.12 -1.26 -0.00 0.00 0.21 0.00 0.00 66.02 64.85 1d2c s SER 205 CO 0.00 0.14 -0.10 -0.69 0.41 0.00 0.00 173.24 173.00 1d2c s VAL 206 N 0.38 2.95 -0.32 3.43 1.01 -1.26 -0.59 120.40 126.00 1d2c s VAL 206 Ca -0.17 -0.65 -0.14 0.00 0.00 0.00 0.00 61.98 61.02 1d2c s VAL 206 Cb -0.17 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 1d2c s VAL 206 CO 0.08 0.47 0.32 -0.22 0.00 0.00 0.00 175.10 175.75 1d2c s LEU 207 N 1.25 4.35 -0.41 3.92 2.96 -0.48 -4.99 118.68 125.28 1d2c s LEU 207 Ca 0.03 -0.17 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 1d2c s LEU 207 Cb -0.14 -2.29 0.10 0.00 0.50 0.00 0.00 46.19 44.36 1d2c s LEU 207 CO -0.05 -0.27 0.23 -0.89 -1.32 0.00 0.00 176.35 174.06 1d2c s THR 208 N 1.94 3.63 0.00 3.68 2.01 -1.26 -0.32 115.64 125.31 1d2c s THR 208 Ca 0.11 -1.83 0.00 0.00 0.31 0.00 0.00 61.69 60.28 1d2c s THR 208 Cb -0.17 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 68.96 1d2c s THR 208 CO 0.11 -0.63 0.00 0.52 -0.69 0.00 0.00 174.62 173.93 1d2c n VAL 209 N 4.72 0.00 0.00 3.82 0.31 -1.15 -4.68 118.33 121.35 1d2c n VAL 209 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1d2c n VAL 209 Cb 0.42 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 33.06 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 -1.26 0.00 -0.67 4.52 5.03 -1.26 -3.31 115.26 118.30 1d2c n ASN 210 Ca 0.00 0.13 0.00 0.00 0.87 0.00 0.00 54.58 55.58 1d2c n ASN 210 Cb 0.00 -0.05 -0.00 0.00 -1.02 0.00 0.00 39.78 38.71 1d2c n ASN 210 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1d2c n ASN 211 N -1.49 0.10 -4.08 6.41 4.05 -1.26 -5.06 115.26 113.93 1d2c n ASN 211 Ca 0.00 -1.80 -0.31 0.00 0.45 0.00 0.00 54.58 52.93 1d2c n ASN 211 Cb 0.00 -0.15 -0.16 0.00 1.23 0.00 0.00 39.78 40.70 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 2.55 -0.15 1.20 0.00 -1.21 -5.07 119.74 117.07 1d2c s LYS 212 Ca 0.05 -0.67 -0.39 0.00 0.00 0.00 0.00 55.97 54.96 1d2c s LYS 212 Cb 0.06 -2.21 -0.16 0.00 0.00 0.00 0.00 37.83 35.52 1d2c s LYS 212 CO -0.03 -0.14 1.56 0.00 0.00 0.00 0.00 175.35 176.74 1d2c n ALA 213 N 4.46 -0.69 0.04 0.59 0.00 -1.26 -2.93 120.51 120.72 1d2c n ALA 213 Ca -0.19 0.45 0.04 0.00 0.00 0.00 0.00 53.44 53.74 1d2c n ALA 213 Cb 0.51 -2.13 -0.06 0.00 0.00 0.00 0.00 19.45 17.76 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 4.11 0.00 -3.52 0.00 -0.00 0.56 -4.82 115.22 111.54 1d2c n HIS 214 Ca 0.24 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.31 1d2c n HIS 214 Cb 0.14 -0.16 -0.04 0.00 -0.12 0.00 0.00 29.99 29.81 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 -2.45 0.81 -0.08 1.57 1.75 -0.88 -4.63 119.30 115.40 1d2c s MET 215 Ca -0.02 -0.08 -0.01 0.00 -1.25 0.00 0.00 55.69 54.33 1d2c s MET 215 Cb 0.05 0.38 0.03 0.00 2.84 0.00 0.00 34.83 38.13 1d2c s MET 215 CO 0.33 -0.31 -0.02 0.08 -0.65 0.00 0.00 175.02 174.45 1d2c s VAL 216 N -2.18 0.56 -0.09 10.11 1.01 -0.17 -1.38 120.40 128.25 1d2c s VAL 216 Ca -0.00 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1d2c s VAL 216 Cb -0.01 -0.67 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1d2c s VAL 216 CO -0.03 0.29 -0.10 -0.89 0.00 0.00 0.00 175.10 174.37 1d2c s THR 217 N 1.87 3.39 -0.10 3.92 2.01 0.24 -0.02 115.64 126.95 1d2c s THR 217 Ca 0.05 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.51 1d2c s THR 217 Cb -0.12 -2.40 -0.00 0.00 0.01 0.00 0.00 72.50 69.99 1d2c s THR 217 CO -0.06 0.56 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.44 1d2c s LEU 218 N -0.30 2.14 -0.38 4.42 1.02 -0.27 -0.83 118.68 124.48 1d2c s LEU 218 Ca 0.03 -0.54 -0.07 0.00 0.02 0.00 0.00 54.13 53.57 1d2c s LEU 218 Cb -0.13 -1.43 0.07 0.00 0.02 0.00 0.00 46.19 44.73 1d2c s LEU 218 CO 0.03 0.16 0.19 -1.81 0.02 0.00 0.00 176.35 174.93 1d2c s ASP 219 N 0.34 5.43 -0.20 2.29 1.01 -0.93 -1.79 116.67 122.83 1d2c s ASP 219 Ca -0.18 -1.46 -0.25 0.00 0.71 0.00 0.00 52.55 51.36 1d2c s ASP 219 Cb -0.18 -1.91 -0.01 0.00 1.01 0.00 0.00 42.92 41.83 1d2c s ASP 219 CO 0.09 -0.46 0.84 -0.31 0.21 0.00 0.00 175.17 175.54 1d2c s TYR 220 N 1.36 3.38 -0.39 4.23 1.51 0.22 -3.04 117.35 124.62 1d2c s TYR 220 Ca 0.02 1.22 -0.08 0.00 -1.01 0.00 0.00 57.07 57.22 1d2c s TYR 220 Cb -0.22 -3.03 0.07 0.00 -0.11 0.00 0.00 41.96 38.66 1d2c s TYR 220 CO 0.01 -0.30 0.21 0.99 -1.11 0.00 0.00 175.55 175.35 1d2c s THR 221 N 2.43 4.07 -0.13 -0.71 2.01 -0.67 -0.99 115.64 121.64 1d2c s THR 221 Ca 0.37 -1.33 -0.09 0.00 0.31 0.00 0.00 61.69 60.95 1d2c s THR 221 Cb -0.16 -3.44 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1d2c s THR 221 CO 0.10 -0.41 0.18 -0.69 -0.69 0.00 0.00 174.62 173.12 1d2c s VAL 222 N 1.41 5.41 -0.76 3.82 1.01 0.74 -1.48 120.40 130.56 1d2c s VAL 222 Ca 0.02 0.31 -0.17 0.00 0.00 0.00 0.00 61.98 62.13 1d2c s VAL 222 Cb -0.22 -3.47 0.15 0.00 0.00 0.00 0.00 36.38 32.84 1d2c s VAL 222 CO 0.02 0.55 0.84 -1.58 0.00 0.00 0.00 175.10 174.93 1d2c s GLN 223 N -0.57 3.37 -0.29 2.72 0.74 -0.81 -1.69 119.66 123.13 1d2c s GLN 223 Ca 0.14 -1.81 -0.29 0.00 0.05 0.00 0.00 55.36 53.46 1d2c s GLN 223 Cb -0.12 -4.50 -0.01 0.00 1.10 0.00 0.00 33.01 29.47 1d2c s GLN 223 CO 0.04 -1.52 1.59 0.54 -0.55 0.00 0.00 175.29 175.38 1d2c s VAL 224 N 1.87 3.72 0.15 1.34 0.11 0.43 -4.68 120.40 123.34 1d2c s VAL 224 Ca 0.19 0.78 0.04 0.00 -2.93 0.00 0.00 61.98 60.07 1d2c s VAL 224 Cb -0.15 -3.83 0.17 0.00 -1.53 0.00 0.00 36.38 31.05 1d2c s VAL 224 CO -0.03 -0.43 0.68 -2.65 -3.33 0.00 0.00 175.10 169.35 1d2c n PRO 225 N 7.89 -0.03 -2.18 1.54 -0.02 -1.26 0.73 135.00 141.67 1d2c n PRO 225 Ca 0.19 0.63 0.01 0.00 -2.02 0.00 0.00 63.50 62.31 1d2c n PRO 225 Cb 0.46 -1.05 0.04 0.00 -0.02 0.00 0.00 33.50 32.93 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 -1.17 1.83 1.05 -1.23 0.00 -1.26 -3.76 105.19 100.64 1d2c n GLY 226 Ca 0.13 -1.07 0.06 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.19 2.76 -2.11 4.61 0.00 -1.14 -4.86 120.51 119.58 1d2c n ALA 227 Ca 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.57 1d2c n ALA 227 Cb 0.94 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.39 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 0.95 2.52 0.00 0.00 0.00 0.13 -4.34 105.19 104.45 1d2c n GLY 228 Ca 0.16 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.17 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 0.00 0.00 -1.61 1.61 3.00 -1.26 -4.58 116.66 113.82 1d2c n ARG 229 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.48 1d2c n ARG 229 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 32.46 32.28 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 -0.20 8.08 0.00 6.15 10.43 -1.26 -4.46 116.55 135.29 1d2c n ASP 230 Ca 0.00 -2.87 0.00 0.00 2.57 0.00 0.00 54.79 54.49 1d2c n ASP 230 Cb 0.00 -1.44 0.00 0.00 1.84 0.00 0.00 41.12 41.52 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 2.49 2.98 2.80 0.44 0.00 -1.26 -5.02 105.19 107.62 1d2c n GLY 231 Ca 0.67 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.36 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 -0.41 -3.21 -2.49 4.61 0.00 -1.26 -4.36 120.51 113.39 1d2c n ALA 232 Ca 0.00 -0.12 -0.35 0.00 0.00 0.00 0.00 53.44 52.96 1d2c n ALA 232 Cb 0.00 -1.19 -0.06 0.00 0.00 0.00 0.00 19.45 18.20 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 -1.01 3.86 0.69 0.00 0.04 -1.25 0.19 135.00 137.53 1d2c s PRO 233 Ca 0.47 0.32 -0.04 0.00 0.04 0.00 0.00 61.00 61.79 1d2c s PRO 233 Cb -0.39 -3.01 0.08 0.00 0.04 0.00 0.00 34.50 31.22 1d2c s PRO 233 CO 0.60 0.55 0.98 0.20 0.04 0.00 0.00 177.00 179.37 1d2c s GLY 234 N -1.64 1.74 -0.11 0.56 0.00 0.22 -4.45 107.32 103.64 1d2c s GLY 234 Ca 0.33 -1.19 -0.02 0.00 0.00 0.00 0.00 44.72 43.85 1d2c s GLY 234 CO 0.18 -0.75 -0.00 -1.36 0.00 0.00 0.00 173.10 171.16 1d2c s PHE 235 N -3.16 0.89 0.11 1.90 0.40 -1.26 -0.43 117.98 116.42 1d2c s PHE 235 Ca 0.62 -0.43 0.04 0.00 -0.60 0.00 0.00 56.93 56.55 1d2c s PHE 235 Cb -0.09 -0.93 -0.04 0.00 0.51 0.00 0.00 43.02 42.47 1d2c s PHE 235 CO 0.44 -0.43 -0.10 -1.12 0.70 0.00 0.00 175.22 174.71 1d2c s SER 236 N 1.90 1.47 0.07 1.36 0.01 -0.68 -4.98 113.70 112.85 1d2c s SER 236 Ca 0.03 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.41 1d2c s SER 236 Cb -0.14 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.07 1d2c s SER 236 CO -0.06 -0.31 -0.04 -1.59 0.41 0.00 0.00 173.24 171.64 1d2c s LYS 237 N -3.16 0.71 0.13 12.44 -2.85 -1.26 -0.18 119.74 125.57 1d2c s LYS 237 Ca 0.09 -1.27 -0.10 0.00 -1.00 0.00 0.00 55.97 53.69 1d2c s LYS 237 Cb -0.00 0.03 -0.00 0.00 -2.06 0.00 0.00 37.83 35.80 1d2c s LYS 237 CO -0.01 -0.07 0.27 -0.59 0.10 0.00 0.00 175.35 175.05 1d2c s PHE 238 N -3.80 0.24 0.11 1.78 -0.71 -0.16 -4.45 117.98 110.99 1d2c s PHE 238 Ca 0.09 -0.62 0.05 0.00 -1.04 0.00 0.00 56.93 55.41 1d2c s PHE 238 Cb 0.07 -0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.83 1d2c s PHE 238 CO -0.08 -0.66 -0.13 -0.98 -1.34 0.00 0.00 175.22 172.03 1d2c s ARG 239 N -3.91 0.98 -0.13 1.99 1.70 -1.26 0.72 118.95 119.03 1d2c s ARG 239 Ca 0.11 -1.20 -0.15 0.00 -0.47 0.00 0.00 55.73 54.02 1d2c s ARG 239 Cb 0.04 -0.84 0.04 0.00 -0.57 0.00 0.00 34.95 33.62 1d2c s ARG 239 CO -0.05 0.16 0.41 -1.17 -1.08 0.00 0.00 175.30 173.57 1d2c s LEU 240 N -2.39 0.44 0.26 -1.89 2.96 -0.74 -5.00 118.68 112.33 1d2c s LEU 240 Ca 0.07 0.71 0.09 0.00 -0.22 0.00 0.00 54.13 54.79 1d2c s LEU 240 Cb -0.05 1.44 -0.04 0.00 0.50 0.00 0.00 46.19 48.04 1d2c s LEU 240 CO 0.02 -0.21 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.40 1d2c s SER 241 N -0.08 4.54 0.05 3.68 0.01 -1.26 -1.11 113.70 119.53 1d2c s SER 241 Ca -0.03 -0.64 -0.03 0.00 1.31 0.00 0.00 55.95 56.56 1d2c s SER 241 Cb -0.03 -0.85 -0.02 0.00 0.21 0.00 0.00 66.02 65.33 1d2c s SER 241 CO 0.02 0.01 0.04 -0.31 0.41 0.00 0.00 173.24 173.40 1d2c s TYR 242 N -2.29 0.36 -0.22 2.43 2.02 0.97 -4.70 117.35 115.92 1d2c s TYR 242 Ca 0.31 -0.81 -0.16 0.00 -0.37 0.00 0.00 57.07 56.04 1d2c s TYR 242 Cb -0.07 -0.25 -0.04 0.00 -0.40 0.00 0.00 41.96 41.21 1d2c s TYR 242 CO 0.20 -0.40 0.43 -0.47 -1.57 0.00 0.00 175.55 173.74 1d2c s TYR 243 N -3.44 3.34 -0.71 2.71 5.04 0.80 -1.00 117.35 124.08 1d2c s TYR 243 Ca 0.02 0.61 -0.26 0.00 -2.44 0.00 0.00 57.07 55.01 1d2c s TYR 243 Cb 0.04 -2.58 -0.04 0.00 0.35 0.00 0.00 41.96 39.73 1d2c s TYR 243 CO -0.08 -0.09 1.97 -1.25 -1.34 0.00 0.00 175.55 174.75 1d2c s PRO 244 N 1.61 2.49 -0.14 4.97 0.04 -1.26 -4.79 135.00 137.93 1d2c s PRO 244 Ca 0.20 0.36 -0.18 0.00 0.04 0.00 0.00 61.00 61.41 1d2c s PRO 244 Cb -0.15 -4.66 -0.04 0.00 0.04 0.00 0.00 34.50 29.69 1d2c s PRO 244 CO 0.09 -3.11 0.49 -1.01 0.04 0.00 0.00 177.00 173.50 1d2c s HIS 245 N 10.05 3.48 0.04 0.56 3.76 -1.26 -4.99 115.29 126.93 1d2c s HIS 245 Ca 0.72 0.87 -0.06 0.00 -0.15 0.00 0.00 55.06 56.44 1d2c s HIS 245 Cb -0.11 -2.59 -0.05 0.00 1.11 0.00 0.00 32.58 30.94 1d2c s HIS 245 CO 0.13 0.10 0.30 0.00 -0.85 0.00 0.00 174.74 174.41 1d2c h LEU 247 N 3.75 -0.43 -0.19 0.00 5.85 -1.97 0.34 115.31 122.66 1d2c h LEU 247 Ca -0.49 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.42 1d2c h LEU 247 Cb 1.19 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 42.48 1d2c h LEU 247 CO 0.68 -0.15 -0.07 0.00 -0.34 0.00 0.00 178.44 178.55 1d2c h ALA 248 N 1.50 0.09 -0.02 1.25 0.00 -1.99 -1.28 119.26 118.81 1d2c h ALA 248 Ca 0.25 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 1d2c h ALA 248 Cb 0.38 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1d2c h ALA 248 CO -0.51 -0.50 -0.46 0.66 0.00 0.00 0.00 179.25 178.44 1d2c h SER 249 N -0.04 0.44 -0.50 0.00 4.64 -1.91 -3.05 113.55 113.13 1d2c h SER 249 Ca 0.10 -0.73 0.08 0.00 -0.47 0.00 0.00 61.79 60.76 1d2c h SER 249 Cb 0.19 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.11 1d2c h SER 249 CO -0.22 1.11 0.34 0.15 -0.87 0.00 0.00 176.83 177.35 1d2c h PHE 250 N -0.18 0.36 -0.63 4.77 3.57 -0.93 0.23 116.94 124.13 1d2c h PHE 250 Ca -0.05 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 1d2c h PHE 250 Cb 1.17 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1d2c h PHE 250 CO 0.15 0.19 0.10 1.15 -2.23 0.00 0.00 178.31 177.67 1d2c h THR 251 N 0.35 1.26 -0.27 4.41 2.02 -1.21 0.52 112.91 119.99 1d2c h THR 251 Ca 0.23 -1.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.25 1d2c h THR 251 Cb 0.43 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1d2c h THR 251 CO -0.05 0.37 -0.44 -0.08 0.37 0.00 0.00 175.52 175.69 1d2c h GLU 252 N 0.97 0.77 -0.43 6.66 4.22 -0.99 -3.01 114.58 122.77 1d2c h GLU 252 Ca 0.19 -0.47 0.00 0.00 0.08 0.00 0.00 59.36 59.16 1d2c h GLU 252 Cb 0.42 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1d2c h GLU 252 CO 0.01 1.10 0.28 -0.07 -2.18 0.00 0.00 179.01 178.16 1d2c h LEU 253 N 0.52 0.50 -0.84 1.64 4.07 -0.65 -0.97 115.31 119.58 1d2c h LEU 253 Ca 0.02 -0.02 -0.11 0.00 0.08 0.00 0.00 57.88 57.86 1d2c h LEU 253 Cb 1.04 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.64 1d2c h LEU 253 CO 0.10 0.37 -0.28 1.62 -1.08 0.00 0.00 178.44 179.17 1d2c h VAL 254 N 0.59 1.27 0.01 1.22 3.04 -0.92 -2.92 116.25 118.54 1d2c h VAL 254 Ca 0.16 -1.34 -0.26 0.00 -1.01 0.00 0.00 66.70 64.24 1d2c h VAL 254 Cb -0.06 1.37 0.02 0.00 -2.01 0.00 0.00 31.29 30.60 1d2c h VAL 254 CO -0.03 0.43 -1.05 1.56 -1.01 0.00 0.00 177.57 177.47 1d2c h GLN 255 N 0.47 0.62 -0.33 4.17 4.20 -1.44 -3.06 115.11 119.74 1d2c h GLN 255 Ca 0.06 -0.69 0.10 0.00 0.06 0.00 0.00 58.65 58.18 1d2c h GLN 255 Cb 0.73 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1d2c h GLN 255 CO 0.06 1.28 0.29 1.49 -0.67 0.00 0.00 178.83 181.28 1d2c h GLU 256 N 0.34 0.00 -0.02 1.46 4.81 -1.08 -0.68 114.58 119.42 1d2c h GLU 256 Ca -0.13 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 58.97 1d2c h GLU 256 Cb 1.70 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.06 1d2c h GLU 256 CO 0.20 0.00 -0.61 0.00 -0.73 0.00 0.00 179.01 177.87 1d2c h ALA 257 N 1.73 0.95 -0.43 2.92 0.00 -1.40 -2.73 119.26 120.31 1d2c h ALA 257 Ca 0.16 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1d2c h ALA 257 Cb 0.74 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1d2c h ALA 257 CO -0.00 0.76 0.00 1.19 0.00 0.00 0.00 179.25 181.20 1d2c n PHE 258 N -3.82 0.56 -1.36 0.00 3.72 -0.31 -4.80 117.46 111.45 1d2c n PHE 258 Ca -0.01 -0.28 -0.12 0.00 -0.05 0.00 0.00 57.45 56.98 1d2c n PHE 258 Cb 0.61 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.10 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 1.28 1.25 1.08 1.37 0.00 -1.03 -1.97 105.19 107.17 1d2c n GLY 259 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.59 3.08 3.57 -0.02 0.00 -0.91 -4.97 105.19 105.35 1d2c n GLY 260 Ca -0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.31 3.32 -0.07 1.61 0.52 -0.83 -4.84 118.95 118.36 1d2c s ARG 261 Ca 0.00 -1.18 -0.32 0.00 -0.52 0.00 0.00 55.73 53.72 1d2c s ARG 261 Cb 0.00 -5.33 0.12 0.00 0.52 0.00 0.00 34.95 30.26 1d2c s ARG 261 CO 0.00 -2.71 1.18 0.00 0.02 0.00 0.00 175.30 173.79 1d2c s GLN 263 N -2.58 3.28 -0.06 0.00 -0.21 0.25 -4.85 119.66 115.50 1d2c s GLN 263 Ca 0.11 -0.69 -0.00 0.00 0.02 0.00 0.00 55.36 54.80 1d2c s GLN 263 Cb 0.01 -3.00 -0.03 0.00 1.00 0.00 0.00 33.01 30.99 1d2c s GLN 263 CO -0.04 -0.24 -0.03 -1.58 -2.12 0.00 0.00 175.29 171.29 1d2c s HIS 264 N 1.45 3.05 -0.15 0.91 5.65 -1.26 -0.46 115.29 124.48 1d2c s HIS 264 Ca 0.05 0.10 -0.07 0.00 0.25 0.00 0.00 55.06 55.39 1d2c s HIS 264 Cb -0.15 -1.73 0.06 0.00 -1.18 0.00 0.00 32.58 29.59 1d2c s HIS 264 CO -0.04 0.41 0.34 -1.12 -0.65 0.00 0.00 174.74 173.69 1d2c s SER 265 N -1.00 -0.20 -0.20 9.88 0.01 -0.65 -5.02 113.70 116.52 1d2c s SER 265 Ca 0.14 0.76 -0.04 0.00 1.31 0.00 0.00 55.95 58.13 1d2c s SER 265 Cb -0.11 0.80 -0.02 0.00 0.21 0.00 0.00 66.02 66.90 1d2c s SER 265 CO 0.04 -0.21 -0.03 0.54 0.41 0.00 0.00 173.24 173.99 1d2c s VAL 266 N 1.87 3.64 0.22 3.43 0.11 -1.26 -1.03 120.40 127.37 1d2c s VAL 266 Ca -0.05 -0.42 -0.06 0.00 -2.93 0.00 0.00 61.98 58.52 1d2c s VAL 266 Cb -0.10 -2.63 -0.06 0.00 -1.53 0.00 0.00 36.38 32.05 1d2c s VAL 266 CO -0.11 0.44 0.48 -0.76 -3.33 0.00 0.00 175.10 171.83 1d2c s LEU 267 N 1.06 4.17 0.00 2.54 1.43 0.16 -3.51 118.68 124.53 1d2c s LEU 267 Ca 0.01 0.71 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 1d2c s LEU 267 Cb -0.15 -3.48 0.00 0.00 0.03 0.00 0.00 46.19 42.59 1d2c s LEU 267 CO 0.01 -0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.13 1d2c n GLY 268 N -0.35 -1.85 0.12 -3.19 0.00 0.41 -2.80 105.19 97.53 1d2c n GLY 268 Ca -0.01 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 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 0.52 0.00 1.61 3.32 -1.89 -3.34 116.42 116.64 1d2c h ASP 269 Ca 0.00 -0.95 0.00 0.00 0.02 0.00 0.00 57.03 56.10 1d2c h ASP 269 Cb 0.00 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.38 1d2c h ASP 269 CO 0.00 1.44 0.00 0.49 -1.72 0.00 0.00 179.24 179.45 1d2c n PHE 270 N -4.06 0.00 -2.48 4.55 0.99 -1.26 -4.79 117.46 110.40 1d2c n PHE 270 Ca -0.15 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.02 1d2c n PHE 270 Cb 0.86 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.35 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 -0.17 3.53 1.03 -1.08 1.02 -1.26 -5.00 119.74 117.82 1d2c s LYS 271 Ca 0.00 0.29 -0.12 0.00 0.02 0.00 0.00 55.97 56.16 1d2c s LYS 271 Cb 0.00 -2.32 0.18 0.00 -0.52 0.00 0.00 37.83 35.17 1d2c s LYS 271 CO 0.00 -0.29 0.90 -0.35 -0.92 0.00 0.00 175.35 174.69 1d2c n PRO 272 N -2.36 -1.26 -4.77 -1.68 -0.04 -1.26 0.16 135.00 123.78 1d2c n PRO 272 Ca 0.02 -0.32 -0.25 0.00 -0.04 0.00 0.00 63.50 62.91 1d2c n PRO 272 Cb 0.55 -2.18 -0.16 0.00 -0.04 0.00 0.00 33.50 31.68 1d2c n PRO 272 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1d2c s TYR 273 N -2.49 1.57 -0.04 0.54 5.04 -1.23 -3.88 117.35 116.86 1d2c s TYR 273 Ca 0.65 -0.41 -0.02 0.00 -2.44 0.00 0.00 57.07 54.85 1d2c s TYR 273 Cb -0.23 -1.05 0.03 0.00 0.35 0.00 0.00 41.96 41.06 1d2c s TYR 273 CO 0.63 -0.13 0.08 1.03 -1.34 0.00 0.00 175.55 175.82 1d2c s ARG 274 N -0.03 -0.01 0.62 4.97 3.00 -1.26 -4.93 118.95 121.31 1d2c s ARG 274 Ca -0.02 0.33 -0.18 0.00 0.00 0.00 0.00 55.73 55.86 1d2c s ARG 274 Cb -0.10 -0.29 -0.11 0.00 0.00 0.00 0.00 34.95 34.44 1d2c s ARG 274 CO 0.01 -0.22 0.06 -2.30 0.00 0.00 0.00 175.30 172.85 1d2c n PRO 275 N 4.59 0.17 0.00 3.54 -0.02 -1.26 -1.91 135.00 140.11 1d2c n PRO 275 Ca -0.19 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1d2c n PRO 275 Cb 0.50 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 1d2c n PRO 275 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2c n GLY 276 N 2.30 1.62 3.57 -1.23 0.00 -1.26 -4.96 105.19 105.24 1d2c n GLY 276 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1d2c n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d2c n GLN 277 N -1.80 1.15 -0.35 1.61 10.64 -0.80 -4.88 117.38 122.95 1d2c n GLN 277 Ca 0.00 0.41 0.01 0.00 -1.83 0.00 0.00 57.00 55.59 1d2c n GLN 277 Cb 0.00 -1.90 0.15 0.00 -0.86 0.00 0.00 30.24 27.62 1d2c n GLN 277 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1d2c h ALA 278 N 1.37 1.29 -2.30 2.61 0.00 -1.92 -3.42 119.26 116.88 1d2c h ALA 278 Ca -0.43 -0.03 -0.55 0.00 0.00 0.00 0.00 54.91 53.90 1d2c h ALA 278 Cb 1.35 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1d2c h ALA 278 CO 0.56 0.41 0.76 -0.47 0.00 0.00 0.00 179.25 180.51 1d2c s TYR 279 N -6.06 3.06 -0.36 0.00 6.14 -1.26 -5.01 117.35 113.85 1d2c s TYR 279 Ca -0.13 1.10 -0.16 0.00 0.64 0.00 0.00 57.07 58.52 1d2c s TYR 279 Cb 0.19 -3.48 -0.00 0.00 0.42 0.00 0.00 41.96 39.08 1d2c s TYR 279 CO 0.80 -1.61 0.38 0.14 0.64 0.00 0.00 175.55 175.90 1d2c s VAL 280 N 2.47 5.15 0.62 3.14 -7.23 -1.26 -5.07 120.40 118.21 1d2c s VAL 280 Ca 0.57 -0.06 -0.15 0.00 -1.81 0.00 0.00 61.98 60.53 1d2c s VAL 280 Cb -0.26 -3.88 -0.02 0.00 0.56 0.00 0.00 36.38 32.78 1d2c s VAL 280 CO 0.22 -0.18 1.07 -2.16 -0.31 0.00 0.00 175.10 173.74 1d2c s PRO 281 N 2.04 3.15 -0.02 4.82 0.04 -1.26 -4.96 135.00 138.80 1d2c s PRO 281 Ca 0.12 1.25 0.03 0.00 0.04 0.00 0.00 61.00 62.44 1d2c s PRO 281 Cb -0.17 -2.01 -0.25 0.00 0.04 0.00 0.00 34.50 32.12 1d2c s PRO 281 CO 0.12 -0.95 0.74 0.00 0.04 0.00 0.00 177.00 176.95 1d2c s TYR 283 N -2.61 1.37 -0.29 0.00 1.51 -1.26 -1.16 117.35 114.91 1d2c s TYR 283 Ca -0.09 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.42 1d2c s TYR 283 Cb 0.08 -0.71 0.08 0.00 -0.11 0.00 0.00 41.96 41.29 1d2c s TYR 283 CO 0.82 0.13 -0.03 -0.06 -1.11 0.00 0.00 175.55 175.31 1d2c s PHE 284 N -2.32 3.21 -0.15 2.71 0.40 0.24 -3.95 117.98 118.12 1d2c s PHE 284 Ca 0.10 -2.45 -0.17 0.00 -0.60 0.00 0.00 56.93 53.80 1d2c s PHE 284 Cb -0.04 -2.24 -0.04 0.00 0.51 0.00 0.00 43.02 41.21 1d2c s PHE 284 CO 0.03 -0.89 0.44 0.42 0.70 0.00 0.00 175.22 175.92 1d2c s ILE 285 N 1.11 5.20 -0.18 0.64 1.01 -1.12 -2.05 121.20 125.81 1d2c s ILE 285 Ca 0.00 0.86 -0.03 0.00 0.00 0.00 0.00 60.65 61.49 1d2c s ILE 285 Cb -0.19 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.48 1d2c s ILE 285 CO -0.08 0.30 -0.07 -1.00 0.00 0.00 0.00 174.94 174.10 1d2c s HIS 286 N 0.83 2.93 -0.20 3.97 3.76 0.46 0.40 115.29 127.44 1d2c s HIS 286 Ca 0.23 -0.69 -0.01 0.00 -0.15 0.00 0.00 55.06 54.44 1d2c s HIS 286 Cb -0.15 -1.99 0.01 0.00 1.11 0.00 0.00 32.58 31.55 1d2c s HIS 286 CO 0.09 -0.32 -0.12 0.54 -0.85 0.00 0.00 174.74 174.08 1d2c s VAL 287 N 0.88 2.73 -0.24 -0.90 0.11 -0.20 -0.61 120.40 122.17 1d2c s VAL 287 Ca -0.02 -0.71 0.02 0.00 -2.93 0.00 0.00 61.98 58.34 1d2c s VAL 287 Cb -0.15 -2.20 0.05 0.00 -1.53 0.00 0.00 36.38 32.55 1d2c s VAL 287 CO 0.01 0.48 -0.13 -0.76 -3.33 0.00 0.00 175.10 171.37 1d2c s LEU 288 N 1.35 3.05 -0.40 2.54 2.01 -0.07 -1.64 118.68 125.53 1d2c s LEU 288 Ca 0.05 -1.14 -0.22 0.00 0.01 0.00 0.00 54.13 52.83 1d2c s LEU 288 Cb -0.14 -1.54 0.01 0.00 0.01 0.00 0.00 46.19 44.54 1d2c s LEU 288 CO -0.08 -0.13 0.70 -0.75 1.01 0.00 0.00 176.35 177.10 1d2c s LYS 289 N 1.17 3.55 -0.26 1.70 2.20 0.39 -2.03 119.74 126.46 1d2c s LYS 289 Ca -0.04 -0.02 -0.29 0.00 -0.36 0.00 0.00 55.97 55.27 1d2c s LYS 289 Cb -0.18 -3.87 -0.03 0.00 -1.51 0.00 0.00 37.83 32.25 1d2c s LYS 289 CO -0.07 -0.90 1.85 0.21 -0.36 0.00 0.00 175.35 176.07 1d2c s LYS 290 N 2.94 3.45 -0.02 4.03 2.20 -0.54 -0.58 119.74 131.22 1d2c s LYS 290 Ca 0.27 1.67 0.12 0.00 -0.36 0.00 0.00 55.97 57.67 1d2c s LYS 290 Cb -0.14 -4.19 0.39 0.00 -1.51 0.00 0.00 37.83 32.38 1d2c s LYS 290 CO 0.18 -1.72 1.29 0.25 -0.36 0.00 0.00 175.35 174.99 1d2c n THR 291 N 7.15 0.72 0.00 3.43 -2.24 -1.16 0.39 114.28 122.57 1d2c n THR 291 Ca 0.23 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1d2c n THR 291 Cb 0.46 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 1d2c n THR 291 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11