#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c1y n THR 25 N -0.42 0.36 -0.05 0.00 -1.04 -1.26 -2.10 114.28 109.77 2c1y n THR 25 Ca 0.00 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 2c1y n THR 25 Cb 0.00 -1.94 0.00 0.00 -1.82 0.00 0.00 70.33 66.57 2c1y n THR 25 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c1y n GLY 26 N 4.11 0.91 3.54 3.41 0.00 -1.26 -4.48 105.19 111.42 2c1y n GLY 26 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2c1y n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c1y s VAL 28 N 2.05 4.41 -0.27 0.00 -7.23 0.13 -4.76 120.40 114.73 2c1y s VAL 28 Ca 0.12 1.82 -0.19 0.00 -1.81 0.00 0.00 61.98 61.92 2c1y s VAL 28 Cb -0.16 -4.17 -0.02 0.00 0.56 0.00 0.00 36.38 32.59 2c1y s VAL 28 CO 0.12 0.19 0.58 -0.62 -0.31 0.00 0.00 175.10 175.07 2c1y s ASP 29 N 0.66 6.50 0.26 4.85 2.15 -1.26 -0.81 116.67 129.02 2c1y s ASP 29 Ca 0.53 0.58 0.10 0.00 0.43 0.00 0.00 52.55 54.18 2c1y s ASP 29 Cb -0.25 -2.31 -0.04 0.00 -0.30 0.00 0.00 42.92 40.01 2c1y s ASP 29 CO 0.30 -0.36 -0.05 -0.76 -0.17 0.00 0.00 175.17 174.13 2c1y s LEU 30 N 2.44 3.06 0.36 -1.34 1.43 -0.83 -4.95 118.68 118.84 2c1y s LEU 30 Ca 0.24 -0.70 -0.03 0.00 -1.03 0.00 0.00 54.13 52.60 2c1y s LEU 30 Cb -0.15 -1.60 0.01 0.00 0.03 0.00 0.00 46.19 44.48 2c1y s LEU 30 CO 0.09 0.02 0.52 1.51 0.23 0.00 0.00 176.35 178.73 2c1y s ASP 31 N -3.53 0.90 0.26 2.29 1.47 -1.26 -4.55 116.67 112.25 2c1y s ASP 31 Ca 0.30 -1.49 -0.01 0.00 1.18 0.00 0.00 52.55 52.53 2c1y s ASP 31 Cb -0.06 0.70 0.49 0.00 -0.34 0.00 0.00 42.92 43.71 2c1y s ASP 31 CO 0.18 -1.37 1.80 -0.08 0.68 0.00 0.00 175.17 176.39 2c1y h GLU 32 N 2.07 0.79 -0.19 2.11 4.22 -1.99 0.11 114.58 121.70 2c1y h GLU 32 Ca -0.29 -0.05 -0.18 0.00 0.08 0.00 0.00 59.36 58.92 2c1y h GLU 32 Cb 1.24 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 2c1y h GLU 32 CO 0.39 0.52 -0.62 -0.07 -2.18 0.00 0.00 179.01 177.05 2c1y h LEU 33 N 0.81 0.75 0.00 1.64 3.38 -2.05 -3.36 115.31 116.49 2c1y h LEU 33 Ca 0.45 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2c1y h LEU 33 Cb 0.49 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2c1y h LEU 33 CO -0.29 1.19 -0.91 -1.54 0.09 0.00 0.00 178.44 176.99 2c1y n SER 34 N -3.95 0.72 0.15 -0.43 3.41 -1.09 -4.66 113.62 107.77 2c1y n SER 34 Ca -0.04 -0.55 -0.08 0.00 -0.26 0.00 0.00 58.87 57.93 2c1y n SER 34 Cb 0.65 0.78 -0.05 0.00 -0.26 0.00 0.00 64.21 65.34 2c1y n SER 34 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2c1y h PHE 35 N 0.00 -0.64 -0.58 7.33 3.57 -0.94 -2.77 116.94 122.92 2c1y h PHE 35 Ca 0.00 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2c1y h PHE 35 Cb 0.58 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 2c1y h PHE 35 CO 0.00 -0.31 0.06 1.49 -2.23 0.00 0.00 178.31 177.31 2c1y h GLU 36 N -0.48 0.98 -0.72 1.11 4.81 -1.84 -1.16 114.58 117.28 2c1y h GLU 36 Ca -0.03 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2c1y h GLU 36 Cb 0.41 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 2c1y h GLU 36 CO -0.02 0.95 0.45 0.87 -0.73 0.00 0.00 179.01 180.53 2c1y h LYS 37 N 0.88 0.97 -0.03 1.92 6.56 -1.83 -2.02 116.57 123.01 2c1y h LYS 37 Ca 0.17 -0.08 -0.20 0.00 -1.06 0.00 0.00 60.65 59.48 2c1y h LYS 37 Cb 0.47 -0.21 0.01 0.00 -0.57 0.00 0.00 32.23 31.93 2c1y h LYS 37 CO 0.02 0.68 -0.76 1.15 -2.06 0.00 0.00 179.45 178.48 2c1y h THR 38 N 0.98 1.35 -0.54 -0.16 2.02 -1.17 -3.17 112.91 112.22 2c1y h THR 38 Ca 0.26 -2.08 0.06 0.00 0.77 0.00 0.00 66.41 65.42 2c1y h THR 38 Cb -0.06 2.39 -0.05 0.00 -1.74 0.00 0.00 68.15 68.69 2c1y h THR 38 CO -0.05 0.63 0.25 0.58 0.37 0.00 0.00 175.52 177.30 2c1y h VAL 39 N 0.18 0.91 0.00 3.16 2.07 -1.18 -2.80 116.25 118.58 2c1y h VAL 39 Ca -0.08 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2c1y h VAL 39 Cb 1.43 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2c1y h VAL 39 CO 0.15 0.09 0.00 -0.62 0.02 0.00 0.00 177.57 177.21 2c1y n GLU 40 N -4.91 0.57 0.01 1.57 1.02 -0.77 -2.53 120.64 115.61 2c1y n GLU 40 Ca 0.06 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.32 2c1y n GLU 40 Cb 0.17 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.28 2c1y n GLU 40 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2c1y n ARG 41 N -1.21 0.06 -4.07 3.49 5.12 -1.06 -4.90 116.66 114.09 2c1y n ARG 41 Ca 0.17 0.01 -0.34 0.00 -1.93 0.00 0.00 57.85 55.75 2c1y n ARG 41 Cb 0.20 -1.53 -0.07 0.00 -1.16 0.00 0.00 32.46 29.91 2c1y n ARG 41 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2c1y s PHE 42 N -3.04 3.37 0.35 -1.55 0.40 -1.05 -5.02 117.98 111.43 2c1y s PHE 42 Ca 0.09 0.29 0.25 0.00 -0.60 0.00 0.00 56.93 56.97 2c1y s PHE 42 Cb 0.17 -1.80 1.26 0.00 0.51 0.00 0.00 43.02 43.15 2c1y s PHE 42 CO 0.73 0.59 1.99 -1.00 0.70 0.00 0.00 175.22 178.23 2c1y h PRO 43 N 4.41 0.00 -3.56 0.24 0.13 -1.86 -3.26 132.00 128.11 2c1y h PRO 43 Ca -0.51 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.46 2c1y h PRO 43 Cb 1.19 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.10 2c1y h PRO 43 CO 0.61 0.17 -0.55 0.71 -0.23 0.00 0.00 178.00 178.71 2c1y s TYR 44 N -4.07 0.02 -0.09 1.56 2.02 -1.18 -2.69 117.35 112.92 2c1y s TYR 44 Ca -0.02 -0.05 -0.08 0.00 -0.37 0.00 0.00 57.07 56.55 2c1y s TYR 44 Cb 0.13 -0.04 0.02 0.00 -0.40 0.00 0.00 41.96 41.67 2c1y s TYR 44 CO 0.61 -0.21 0.24 -1.12 -1.57 0.00 0.00 175.55 173.51 2c1y s SER 45 N -0.95 -0.25 -0.11 2.29 0.01 -0.17 -0.74 113.70 113.78 2c1y s SER 45 Ca -0.10 0.49 0.03 0.00 1.31 0.00 0.00 55.95 57.67 2c1y s SER 45 Cb -0.06 0.49 0.01 0.00 0.21 0.00 0.00 66.02 66.67 2c1y s SER 45 CO 0.01 -0.09 -0.19 -0.69 0.41 0.00 0.00 173.24 172.69 2c1y s VAL 46 N 0.17 1.76 -0.07 3.43 1.01 -0.10 -0.40 120.40 126.20 2c1y s VAL 46 Ca -0.00 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.18 2c1y s VAL 46 Cb -0.02 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.81 2c1y s VAL 46 CO -0.00 0.49 -0.14 -0.69 0.00 0.00 0.00 175.10 174.77 2c1y s VAL 47 N 0.74 1.25 -0.30 2.92 1.01 -0.63 -1.66 120.40 123.73 2c1y s VAL 47 Ca -0.11 -0.54 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 2c1y s VAL 47 Cb -0.16 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 2c1y s VAL 47 CO 0.01 0.38 0.21 -0.75 0.00 0.00 0.00 175.10 174.95 2c1y s LYS 48 N 0.67 3.76 0.01 2.72 2.20 -0.77 -1.50 119.74 126.83 2c1y s LYS 48 Ca -0.14 -0.45 -0.21 0.00 -0.36 0.00 0.00 55.97 54.80 2c1y s LYS 48 Cb -0.16 -3.71 -0.06 0.00 -1.51 0.00 0.00 37.83 32.40 2c1y s LYS 48 CO 0.04 -0.29 0.63 -0.06 -0.36 0.00 0.00 175.35 175.31 2c1y s PHE 49 N 1.74 3.71 0.25 4.03 0.40 0.12 -0.00 117.98 128.22 2c1y s PHE 49 Ca 0.07 1.27 -0.16 0.00 -0.60 0.00 0.00 56.93 57.50 2c1y s PHE 49 Cb -0.17 -2.65 0.06 0.00 0.51 0.00 0.00 43.02 40.78 2c1y s PHE 49 CO 0.11 0.35 0.81 -3.47 0.70 0.00 0.00 175.22 173.72 2c1y n ASP 50 N 2.65 -1.77 -4.62 1.36 -0.08 -0.36 -0.97 116.55 112.77 2c1y n ASP 50 Ca -0.06 -2.08 -0.30 0.00 -1.51 0.00 0.00 54.79 50.83 2c1y n ASP 50 Cb 0.51 2.91 0.19 0.00 2.34 0.00 0.00 41.12 47.07 2c1y n ASP 50 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 2c1y s ILE 51 N -2.16 2.19 0.05 5.18 -4.36 -1.26 -0.68 121.20 120.16 2c1y s ILE 51 Ca 0.17 0.06 -0.31 0.00 -0.26 0.00 0.00 60.65 60.32 2c1y s ILE 51 Cb -0.03 -2.17 -0.06 0.00 1.25 0.00 0.00 42.46 41.45 2c1y s ILE 51 CO 0.07 -0.08 1.22 0.00 0.24 0.00 0.00 174.94 176.40 2c1y s ALA 52 N -2.63 3.42 0.00 2.27 0.00 -1.17 -4.21 121.76 119.45 2c1y s ALA 52 Ca 0.67 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.48 2c1y s ALA 52 Cb -0.23 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2c1y s ALA 52 CO 0.60 -0.50 0.00 0.66 0.00 0.00 0.00 175.76 176.52 2c1y n TYR 53 N 4.11 0.00 -2.21 0.00 4.02 -1.26 -5.00 117.16 116.82 2c1y n TYR 53 Ca 0.09 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.57 2c1y n TYR 53 Cb 0.46 -1.99 -0.03 0.00 -0.02 0.00 0.00 39.34 37.76 2c1y n TYR 53 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 2c1y s PRO 54 N -3.28 4.36 0.13 -0.72 0.02 -1.26 -5.04 135.00 129.21 2c1y s PRO 54 Ca 0.00 2.05 0.09 0.00 0.02 0.00 0.00 61.00 63.16 2c1y s PRO 54 Cb 0.00 -3.22 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 2c1y s PRO 54 CO 0.00 -0.33 -0.21 0.15 -0.33 0.00 0.00 177.00 176.27 2c1y s LYS 55 N 0.47 1.23 0.00 5.54 3.01 -1.26 -4.86 119.74 123.88 2c1y s LYS 55 Ca 0.60 -1.28 0.00 0.00 -1.01 0.00 0.00 55.97 54.28 2c1y s LYS 55 Cb -0.36 -1.49 0.00 0.00 -1.01 0.00 0.00 37.83 34.96 2c1y s LYS 55 CO 0.34 0.34 0.00 0.41 0.51 0.00 0.00 175.35 176.95 2c1y n GLY 56 N 0.80 1.53 0.17 -3.33 0.00 -1.26 -4.74 105.19 98.37 2c1y n GLY 56 Ca -0.17 -2.10 -0.01 0.00 0.00 0.00 0.00 46.02 43.73 2c1y n GLY 56 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2c1y h GLU 57 N 0.00 0.12 -0.04 1.61 3.07 -1.98 -1.31 114.58 116.06 2c1y h GLU 57 Ca 0.00 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.69 2c1y h GLU 57 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2c1y h GLU 57 CO 0.00 0.59 -0.45 1.57 -1.40 0.00 0.00 179.01 179.32 2c1y h LYS 58 N 0.10 0.08 0.17 2.33 2.10 -1.90 -2.12 116.57 117.34 2c1y h LYS 58 Ca 0.00 -0.04 -0.31 0.00 -2.00 0.00 0.00 60.65 58.31 2c1y h LYS 58 Cb 0.91 0.00 0.03 0.00 -0.90 0.00 0.00 32.23 32.28 2c1y h LYS 58 CO 0.07 0.52 -1.30 1.25 -2.00 0.00 0.00 179.45 177.99 2c1y h HIS 59 N 0.07 0.98 -0.22 0.07 6.17 -1.66 -3.03 115.15 117.52 2c1y h HIS 59 Ca 0.00 -0.65 -0.03 0.00 0.71 0.00 0.00 60.37 60.40 2c1y h HIS 59 Cb 0.83 -0.06 -0.01 0.00 2.52 0.00 0.00 27.41 30.68 2c1y h HIS 59 CO 0.01 1.50 0.00 0.93 0.71 0.00 0.00 177.93 181.07 2c1y h GLU 60 N 0.18 0.33 0.00 5.26 5.08 -1.26 -1.32 114.58 122.85 2c1y h GLU 60 Ca -0.21 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 57.94 2c1y h GLU 60 Cb 1.99 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 31.16 2c1y h GLU 60 CO 0.25 0.35 -0.73 0.00 -1.00 0.00 0.00 179.01 177.88 2c1y h ALA 61 N 1.69 0.71 -0.32 3.43 0.00 -1.42 -1.40 119.26 121.94 2c1y h ALA 61 Ca 0.07 -0.67 -0.15 0.00 0.00 0.00 0.00 54.91 54.17 2c1y h ALA 61 Cb 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2c1y h ALA 61 CO 0.00 0.92 -0.40 0.35 0.00 0.00 0.00 179.25 180.13 2c1y h PHE 62 N 0.00 0.93 -0.04 0.00 3.57 -1.33 -1.58 116.94 118.49 2c1y h PHE 62 Ca -0.01 -0.28 -0.00 0.00 3.53 0.00 0.00 57.97 61.21 2c1y h PHE 62 Cb 1.36 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 2c1y h PHE 62 CO 0.00 1.04 0.01 1.15 -2.23 0.00 0.00 178.31 178.29 2c1y h THR 63 N 0.63 1.17 -0.19 4.41 2.02 -1.25 0.63 112.91 120.33 2c1y h THR 63 Ca 0.05 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 2c1y h THR 63 Cb 0.95 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 2c1y h THR 63 CO 0.09 0.13 0.10 0.00 0.37 0.00 0.00 175.52 176.21 2c1y h ALA 64 N 0.82 1.82 0.09 6.16 0.00 -1.13 -2.69 119.26 124.33 2c1y h ALA 64 Ca 0.01 -0.04 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 2c1y h ALA 64 Cb 0.21 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 17.94 2c1y h ALA 64 CO -0.00 0.16 -1.10 0.35 0.00 0.00 0.00 179.25 178.65 2c1y h PHE 65 N 0.26 0.93 -0.70 0.00 3.57 -0.70 -2.19 116.94 118.12 2c1y h PHE 65 Ca 0.07 -0.57 0.08 0.00 3.53 0.00 0.00 57.97 61.08 2c1y h PHE 65 Cb 0.01 -0.08 -0.11 0.00 2.79 0.00 0.00 35.95 38.57 2c1y h PHE 65 CO 0.00 1.42 -0.53 1.03 -2.23 0.00 0.00 178.31 178.00 2c1y h SER 66 N 0.19 -1.87 -0.41 0.41 0.87 0.42 -0.65 113.55 112.52 2c1y h SER 66 Ca -0.16 0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.66 2c1y h SER 66 Cb 1.79 0.82 -0.02 0.00 -0.44 0.00 0.00 62.40 64.55 2c1y h SER 66 CO 0.21 -0.32 0.18 0.11 -0.53 0.00 0.00 176.83 176.48 2c1y h LYS 67 N -0.19 0.60 -0.79 2.24 1.57 -1.38 -1.89 116.57 116.73 2c1y h LYS 67 Ca 0.15 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2c1y h LYS 67 Cb 0.52 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.68 2c1y h LYS 67 CO -0.77 0.54 0.51 1.03 -0.57 0.00 0.00 179.45 180.19 2c1y h SER 68 N 0.52 0.84 0.26 0.86 0.87 -1.35 -2.60 113.55 112.95 2c1y h SER 68 Ca 0.14 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 2c1y h SER 68 Cb 0.15 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2c1y h SER 68 CO -0.01 0.58 -0.13 0.00 -0.53 0.00 0.00 176.83 176.74 2c1y h ALA 69 N 1.33 -0.35 -0.87 6.23 0.00 -0.99 -2.41 119.26 122.19 2c1y h ALA 69 Ca 0.31 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.33 2c1y h ALA 69 Cb -0.00 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2c1y h ALA 69 CO -0.11 -0.69 0.57 0.45 0.00 0.00 0.00 179.25 179.48 2c1y h HIS 70 N -0.37 0.57 -0.30 0.00 -0.00 -1.36 -1.14 115.15 112.55 2c1y h HIS 70 Ca -0.04 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.24 2c1y h HIS 70 Cb 0.28 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 2c1y h HIS 70 CO -0.05 0.17 -0.29 -0.22 -0.00 0.00 0.00 177.93 177.54 2c1y h LYS 71 N 0.44 0.62 0.00 2.45 3.64 -1.05 -3.34 116.57 119.33 2c1y h LYS 71 Ca 0.45 -0.26 -0.05 0.00 -1.27 0.00 0.00 60.65 59.51 2c1y h LYS 71 Cb 1.05 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 2c1y h LYS 71 CO -0.17 0.84 -1.40 0.00 -2.27 0.00 0.00 179.45 176.44 2c1y n ALA 72 N -2.50 2.41 -2.48 5.00 0.00 -0.54 -4.96 120.51 117.45 2c1y n ALA 72 Ca -0.01 -0.42 -0.08 0.00 0.00 0.00 0.00 53.44 52.93 2c1y n ALA 72 Cb 0.45 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 18.88 2c1y n ALA 72 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2c1y s THR 73 N -3.26 0.16 -1.42 0.00 -1.32 -0.57 -4.96 115.64 104.27 2c1y s THR 73 Ca -0.03 -1.29 0.15 0.00 -1.21 0.00 0.00 61.69 59.30 2c1y s THR 73 Cb 0.10 -1.35 0.02 0.00 -1.51 0.00 0.00 72.50 69.76 2c1y s THR 73 CO 0.83 -0.71 0.83 0.29 -2.21 0.00 0.00 174.62 173.64 2c1y n LYS 74 N 0.01 1.67 -0.11 7.08 4.76 -1.26 -4.55 118.16 125.76 2c1y n LYS 74 Ca -0.15 -0.86 0.11 0.00 -2.87 0.00 0.00 58.31 54.54 2c1y n LYS 74 Cb 0.62 -1.23 0.30 0.00 -1.84 0.00 0.00 35.03 32.88 2c1y n LYS 74 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2c1y n ASP 75 N 0.01 2.43 -4.14 4.39 8.00 -1.26 -4.90 116.55 121.08 2c1y n ASP 75 Ca 0.06 -1.83 -0.33 0.00 0.71 0.00 0.00 54.79 53.41 2c1y n ASP 75 Cb 0.32 -0.14 -0.16 0.00 -0.02 0.00 0.00 41.12 41.11 2c1y n ASP 75 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2c1y s LEU 76 N -1.60 2.13 -0.14 0.64 2.96 -1.26 -3.08 118.68 118.33 2c1y s LEU 76 Ca 0.35 -0.63 -0.29 0.00 -0.22 0.00 0.00 54.13 53.33 2c1y s LEU 76 Cb 0.20 -1.47 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 2c1y s LEU 76 CO 0.29 0.03 1.15 -0.22 -1.32 0.00 0.00 176.35 176.27 2c1y s LEU 77 N 1.14 4.20 -0.29 -0.68 2.96 0.08 -4.96 118.68 121.13 2c1y s LEU 77 Ca 0.01 1.62 -0.10 0.00 -0.22 0.00 0.00 54.13 55.45 2c1y s LEU 77 Cb -0.14 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 2c1y s LEU 77 CO -0.09 -0.63 0.15 -0.63 -1.32 0.00 0.00 176.35 173.83 2c1y s ILE 78 N 2.79 4.82 0.19 6.68 -1.09 -1.26 -0.93 121.20 132.41 2c1y s ILE 78 Ca 0.51 -0.14 0.03 0.00 -2.23 0.00 0.00 60.65 58.82 2c1y s ILE 78 Cb -0.20 -3.35 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 2c1y s ILE 78 CO 0.15 0.19 -0.01 0.00 -1.23 0.00 0.00 174.94 174.04 2c1y s ALA 79 N 1.67 1.55 0.02 9.38 0.00 -0.67 0.21 121.76 133.92 2c1y s ALA 79 Ca 0.06 -1.65 0.02 0.00 0.00 0.00 0.00 51.96 50.39 2c1y s ALA 79 Cb -0.16 0.46 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 2c1y s ALA 79 CO 0.07 -0.26 -0.07 0.95 0.00 0.00 0.00 175.76 176.46 2c1y s THR 80 N -3.52 0.48 -0.22 0.00 -4.23 0.01 -1.85 115.64 106.32 2c1y s THR 80 Ca 0.25 -0.59 0.01 0.00 -1.18 0.00 0.00 61.69 60.18 2c1y s THR 80 Cb 0.05 -0.47 0.05 0.00 1.34 0.00 0.00 72.50 73.47 2c1y s THR 80 CO 0.05 -0.09 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.25 2c1y s VAL 81 N -0.65 1.82 -0.16 2.29 1.01 0.99 -1.97 120.40 123.73 2c1y s VAL 81 Ca -0.03 -1.21 -0.24 0.00 0.00 0.00 0.00 61.98 60.50 2c1y s VAL 81 Cb -0.05 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 2c1y s VAL 81 CO 0.00 0.11 0.76 -0.83 0.00 0.00 0.00 175.10 175.14 2c1y s GLY 82 N 1.30 2.17 -0.12 4.51 0.00 -1.26 -1.22 107.32 112.70 2c1y s GLY 82 Ca -0.04 -0.03 0.01 0.00 0.00 0.00 0.00 44.72 44.67 2c1y s GLY 82 CO -0.07 1.50 -0.17 0.14 0.00 0.00 0.00 173.10 174.50 2c1y s VAL 83 N 1.88 2.72 0.14 1.40 1.01 0.15 -4.60 120.40 123.10 2c1y s VAL 83 Ca 0.36 -0.78 0.09 0.00 0.00 0.00 0.00 61.98 61.65 2c1y s VAL 83 Cb -0.17 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 2c1y s VAL 83 CO 0.13 0.54 -0.18 -0.75 0.00 0.00 0.00 175.10 174.83 2c1y s LYS 84 N 0.34 1.77 -0.38 2.72 2.20 -0.67 -3.04 119.74 122.68 2c1y s LYS 84 Ca -0.14 -1.25 0.11 0.00 -0.36 0.00 0.00 55.97 54.34 2c1y s LYS 84 Cb -0.17 -2.07 0.39 0.00 -1.51 0.00 0.00 37.83 34.48 2c1y s LYS 84 CO 0.07 0.46 1.13 -0.40 -0.36 0.00 0.00 175.35 176.25 2c1y n ASP 85 N 0.61 -0.71 -3.06 1.43 5.68 -1.26 -4.27 116.55 114.97 2c1y n ASP 85 Ca -0.15 -2.80 -0.11 0.00 -0.50 0.00 0.00 54.79 51.24 2c1y n ASP 85 Cb 0.54 0.54 -0.01 0.00 -1.14 0.00 0.00 41.12 41.05 2c1y n ASP 85 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2c1y n TYR 86 N -0.19 -0.65 -0.97 2.11 0.53 -1.26 -4.99 117.16 111.74 2c1y n TYR 86 Ca 0.05 -0.91 0.00 0.00 -1.02 0.00 0.00 57.90 56.02 2c1y n TYR 86 Cb 0.80 -0.16 0.00 0.00 -1.03 0.00 0.00 39.34 38.95 2c1y n TYR 86 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2c1y n GLY 87 N 2.54 2.62 1.74 2.72 0.00 -1.26 -2.73 105.19 110.82 2c1y n GLY 87 Ca -0.03 -0.16 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 2c1y n GLY 87 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2c1y n GLU 88 N 14.00 2.81 -3.51 1.61 0.00 -1.26 -4.96 120.64 129.33 2c1y n GLU 88 Ca 0.00 -2.27 -0.17 0.00 0.00 0.00 0.00 57.16 54.72 2c1y n GLU 88 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 31.44 29.49 2c1y n GLU 88 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2c1y n LEU 89 N -0.18 -0.44 -4.68 -1.84 4.32 -1.11 -4.84 117.00 108.23 2c1y n LEU 89 Ca 0.33 -0.54 -0.44 0.00 -0.02 0.00 0.00 56.01 55.34 2c1y n LEU 89 Cb 1.18 -0.75 -0.04 0.00 -1.62 0.00 0.00 43.42 42.20 2c1y n LEU 89 CO 0.36 0.30 1.48 -1.84 -1.22 0.00 0.00 177.39 176.46 2c1y n GLU 90 N -2.21 2.61 -0.97 3.23 0.00 -1.26 -2.95 120.64 119.09 2c1y n GLU 90 Ca -0.10 0.95 0.00 0.00 0.00 0.00 0.00 57.16 58.01 2c1y n GLU 90 Cb 0.30 -2.84 0.00 0.00 0.00 0.00 0.00 31.44 28.90 2c1y n GLU 90 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2c1y n ASN 91 N 6.05 -3.56 -0.13 -1.84 3.02 -1.26 -1.67 115.26 115.86 2c1y n ASN 91 Ca 0.19 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.62 2c1y n ASN 91 Cb 0.35 -1.57 -0.09 0.00 -0.61 0.00 0.00 39.78 37.87 2c1y n ASN 91 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2c1y h LYS 92 N 0.79 -0.37 -0.37 3.52 5.09 -1.76 0.65 116.57 124.11 2c1y h LYS 92 Ca 0.00 0.03 0.04 0.00 0.09 0.00 0.00 60.65 60.80 2c1y h LYS 92 Cb 0.33 0.08 -0.05 0.00 0.10 0.00 0.00 32.23 32.69 2c1y h LYS 92 CO 0.00 -0.25 -0.31 0.00 -2.09 0.00 0.00 179.45 176.80 2c1y h ALA 93 N 0.07 -0.44 -0.85 0.07 0.00 -1.91 -1.72 119.26 114.48 2c1y h ALA 93 Ca 0.09 0.03 0.19 0.00 0.00 0.00 0.00 54.91 55.22 2c1y h ALA 93 Cb 0.60 1.06 -0.16 0.00 0.00 0.00 0.00 17.79 19.29 2c1y h ALA 93 CO -0.59 -0.63 -0.09 1.25 0.00 0.00 0.00 179.25 179.19 2c1y h LEU 94 N -0.12 -0.58 0.18 0.00 5.85 -1.96 0.07 115.31 118.75 2c1y h LEU 94 Ca 0.06 0.24 0.01 0.00 0.84 0.00 0.00 57.88 59.03 2c1y h LEU 94 Cb 0.28 0.46 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 2c1y h LEU 94 CO -0.41 -0.26 -0.49 1.23 -0.34 0.00 0.00 178.44 178.17 2c1y h GLY 95 N 0.04 -1.18 -0.77 3.75 0.00 -0.02 -2.03 103.07 102.85 2c1y h GLY 95 Ca 0.45 0.63 0.38 0.00 0.00 0.00 0.00 47.33 48.79 2c1y h GLY 95 CO -0.82 -0.30 0.83 -0.55 0.00 0.00 0.00 176.54 175.71 2c1y h ASP 96 N -0.75 0.26 0.11 0.19 3.45 -1.02 -0.33 116.42 118.34 2c1y h ASP 96 Ca -0.02 0.09 -0.02 0.00 0.43 0.00 0.00 57.03 57.52 2c1y h ASP 96 Cb 0.73 0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.56 2c1y h ASP 96 CO -0.23 -0.06 -0.09 -0.09 -1.57 0.00 0.00 179.24 177.20 2c1y h ARG 97 N 0.16 0.00 -0.28 3.56 2.43 -0.23 -2.09 114.38 117.94 2c1y h ARG 97 Ca 0.73 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.90 2c1y h ARG 97 Cb 2.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.84 2c1y h ARG 97 CO -0.30 0.09 0.00 0.66 -1.51 0.00 0.00 179.97 178.91 2c1y n TYR 98 N -4.28 0.66 -2.85 2.20 4.01 -0.86 -4.98 117.16 111.07 2c1y n TYR 98 Ca -0.03 -0.70 -0.21 0.00 -0.16 0.00 0.00 57.90 56.80 2c1y n TYR 98 Cb 0.17 -0.17 0.02 0.00 -0.31 0.00 0.00 39.34 39.05 2c1y n TYR 98 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2c1y n LYS 99 N -0.10 -4.00 -2.90 -0.72 4.76 -0.66 -4.88 118.16 109.66 2c1y n LYS 99 Ca 0.16 0.90 -0.40 0.00 -2.87 0.00 0.00 58.31 56.10 2c1y n LYS 99 Cb 0.66 -5.65 -0.05 0.00 -1.84 0.00 0.00 35.03 28.14 2c1y n LYS 99 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2c1y s VAL 100 N -3.12 4.62 -0.77 -0.18 -7.23 -0.22 -4.97 120.40 108.52 2c1y s VAL 100 Ca 0.22 1.79 -0.26 0.00 -1.81 0.00 0.00 61.98 61.92 2c1y s VAL 100 Cb -0.10 -4.19 0.04 0.00 0.56 0.00 0.00 36.38 32.69 2c1y s VAL 100 CO 0.28 0.36 1.26 -0.62 -0.31 0.00 0.00 175.10 176.07 2c1y s ASP 101 N -0.13 6.21 0.36 4.85 3.68 -1.26 -4.65 116.67 125.72 2c1y s ASP 101 Ca 0.41 -0.64 0.10 0.00 2.13 0.00 0.00 52.55 54.55 2c1y s ASP 101 Cb -0.22 -2.54 0.85 0.00 -1.45 0.00 0.00 42.92 39.55 2c1y s ASP 101 CO 0.26 -1.75 1.85 -2.24 0.13 0.00 0.00 175.17 173.42 2c1y h ASP 102 N 9.94 0.64 -1.05 -0.34 -0.00 -1.97 -2.71 116.42 120.92 2c1y h ASP 102 Ca -0.22 0.05 -0.56 0.00 -0.00 0.00 0.00 57.03 56.30 2c1y h ASP 102 Cb 1.05 -0.07 -0.16 0.00 -0.00 0.00 0.00 39.33 40.14 2c1y h ASP 102 CO 1.28 0.30 0.93 2.29 -0.00 0.00 0.00 179.24 184.04 2c1y n LYS 103 N -4.58 3.00 0.00 4.15 -0.00 -1.26 -4.17 118.16 115.29 2c1y n LYS 103 Ca 0.19 -2.61 0.00 0.00 -0.00 0.00 0.00 58.31 55.89 2c1y n LYS 103 Cb 0.52 -2.27 0.00 0.00 -0.00 0.00 0.00 35.03 33.28 2c1y n LYS 103 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2c1y n ASN 104 N 1.17 0.00 -4.75 -5.58 0.23 -1.04 -5.18 115.26 100.12 2c1y n ASN 104 Ca 0.53 0.00 -0.30 0.00 -0.53 0.00 0.00 54.58 54.27 2c1y n ASN 104 Cb 0.48 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.29 2c1y n ASN 104 CO 0.00 0.00 0.00 -0.36 -0.93 0.00 0.00 177.26 175.97 2c1y s PHE 105 N 0.00 2.49 0.44 -2.53 0.08 -1.14 -4.58 117.98 112.73 2c1y s PHE 105 Ca 0.00 1.36 -0.22 0.00 0.12 0.00 0.00 56.93 58.19 2c1y s PHE 105 Cb 0.00 -3.10 -0.09 0.00 -0.57 0.00 0.00 43.02 39.26 2c1y s PHE 105 CO 0.00 -2.07 1.04 -1.25 -0.10 0.00 0.00 175.22 172.84 2c1y s PRO 106 N -4.95 4.01 -0.13 0.24 0.04 -1.26 -5.07 135.00 127.89 2c1y s PRO 106 Ca 0.62 1.43 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 2c1y s PRO 106 Cb -0.17 -2.34 -0.02 0.00 0.04 0.00 0.00 34.50 32.01 2c1y s PRO 106 CO 0.56 -0.26 -0.09 -1.12 0.04 0.00 0.00 177.00 176.13 2c1y s SER 107 N -1.76 4.38 -0.14 6.66 0.01 -0.14 -4.95 113.70 117.75 2c1y s SER 107 Ca 0.62 -0.21 0.01 0.00 1.31 0.00 0.00 55.95 57.68 2c1y s SER 107 Cb -0.19 -1.57 -0.00 0.00 0.21 0.00 0.00 66.02 64.47 2c1y s SER 107 CO 0.24 0.20 -0.17 -0.63 0.41 0.00 0.00 173.24 173.28 2c1y s ILE 108 N 0.14 2.52 0.05 1.44 1.01 -1.26 0.16 121.20 125.26 2c1y s ILE 108 Ca -0.04 -0.83 0.08 0.00 0.00 0.00 0.00 60.65 59.85 2c1y s ILE 108 Cb -0.14 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 2c1y s ILE 108 CO 0.04 0.53 -0.22 -0.36 0.00 0.00 0.00 174.94 174.93 2c1y s PHE 109 N 0.68 1.94 -0.07 3.97 0.40 -0.56 -0.82 117.98 123.52 2c1y s PHE 109 Ca -0.08 -0.39 0.04 0.00 -0.60 0.00 0.00 56.93 55.90 2c1y s PHE 109 Cb -0.16 -1.15 -0.02 0.00 0.51 0.00 0.00 43.02 42.21 2c1y s PHE 109 CO 0.02 0.11 -0.20 -1.17 0.70 0.00 0.00 175.22 174.68 2c1y s LEU 110 N -1.25 2.39 0.19 -0.37 0.20 0.25 -1.60 118.68 118.48 2c1y s LEU 110 Ca 0.08 -0.39 0.11 0.00 0.69 0.00 0.00 54.13 54.62 2c1y s LEU 110 Cb -0.09 -1.47 -0.04 0.00 -0.43 0.00 0.00 46.19 44.15 2c1y s LEU 110 CO 0.02 0.26 -0.22 -0.36 -0.29 0.00 0.00 176.35 175.75 2c1y s PHE 111 N -0.21 2.18 -0.51 5.38 0.40 0.46 -1.54 117.98 124.14 2c1y s PHE 111 Ca -0.01 -0.38 0.04 0.00 -0.60 0.00 0.00 56.93 55.98 2c1y s PHE 111 Cb -0.13 -1.07 0.40 0.00 0.51 0.00 0.00 43.02 42.72 2c1y s PHE 111 CO 0.03 0.47 1.16 1.63 0.70 0.00 0.00 175.22 179.21 2c1y n LYS 112 N 0.22 3.39 -0.80 0.44 5.02 -1.26 -0.99 118.16 124.17 2c1y n LYS 112 Ca -0.12 -4.52 0.00 0.00 -2.02 0.00 0.00 58.31 51.65 2c1y n LYS 112 Cb 0.56 -2.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.32 2c1y n LYS 112 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c1y n GLY 113 N -0.43 0.89 2.85 0.72 0.00 -1.09 -4.83 105.19 103.30 2c1y n GLY 113 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 2c1y n GLY 113 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2c1y s ASN 114 N -2.98 3.17 0.08 1.61 3.84 -1.26 -4.53 114.94 114.86 2c1y s ASN 114 Ca 0.00 -0.87 0.24 0.00 0.21 0.00 0.00 52.86 52.44 2c1y s ASN 114 Cb 0.00 -0.88 0.97 0.00 -0.55 0.00 0.00 41.25 40.79 2c1y s ASN 114 CO 0.00 -0.24 1.76 0.00 -2.79 0.00 0.00 177.10 175.83 2c1y n ALA 115 N 4.87 2.08 1.37 1.71 0.00 -1.26 -0.95 120.51 128.33 2c1y n ALA 115 Ca -0.11 -0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.42 2c1y n ALA 115 Cb 0.46 -1.40 0.52 0.00 0.00 0.00 0.00 19.45 19.03 2c1y n ALA 115 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2c1y n ASP 116 N -1.77 0.76 -3.80 0.00 8.00 -1.26 -4.78 116.55 113.70 2c1y n ASP 116 Ca 0.05 -0.79 -0.23 0.00 0.71 0.00 0.00 54.79 54.53 2c1y n ASP 116 Cb 0.31 0.01 -0.17 0.00 -0.02 0.00 0.00 41.12 41.25 2c1y n ASP 116 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2c1y s GLU 117 N -2.43 0.79 0.09 -1.24 8.01 -0.12 -5.12 118.70 118.68 2c1y s GLU 117 Ca 0.28 0.03 0.00 0.00 0.01 0.00 0.00 54.97 55.29 2c1y s GLU 117 Cb 0.20 -1.07 -0.04 0.00 -4.31 0.00 0.00 34.13 28.90 2c1y s GLU 117 CO 0.48 -0.28 -0.02 1.52 0.01 0.00 0.00 175.26 176.96 2c1y s TYR 118 N 1.85 0.74 -0.04 1.61 1.13 -1.26 -4.40 117.35 116.98 2c1y s TYR 118 Ca 0.04 -1.05 0.06 0.00 -1.41 0.00 0.00 57.07 54.71 2c1y s TYR 118 Cb -0.12 -0.47 -0.02 0.00 -1.10 0.00 0.00 41.96 40.25 2c1y s TYR 118 CO -0.05 -0.32 -0.21 0.54 -2.51 0.00 0.00 175.55 172.99 2c1y s VAL 119 N -3.84 2.44 -0.12 -3.49 0.11 -0.59 -4.99 120.40 109.92 2c1y s VAL 119 Ca 0.13 -0.95 -0.01 0.00 -2.93 0.00 0.00 61.98 58.21 2c1y s VAL 119 Cb 0.07 -1.90 -0.03 0.00 -1.53 0.00 0.00 36.38 32.99 2c1y s VAL 119 CO -0.05 0.58 -0.07 -1.58 -3.33 0.00 0.00 175.10 170.65 2c1y s GLN 120 N -0.55 3.29 0.02 1.54 0.74 -1.26 -0.58 119.66 122.86 2c1y s GLN 120 Ca 0.08 -0.57 -0.30 0.00 0.05 0.00 0.00 55.36 54.62 2c1y s GLN 120 Cb -0.11 -2.74 -0.08 0.00 1.10 0.00 0.00 33.01 31.18 2c1y s GLN 120 CO 0.00 0.38 1.90 -1.17 -0.55 0.00 0.00 175.29 175.86 2c1y s LEU 121 N -0.04 4.41 0.60 3.68 2.96 0.00 -4.91 118.68 125.39 2c1y s LEU 121 Ca -0.00 2.60 -0.19 0.00 -0.22 0.00 0.00 54.13 56.32 2c1y s LEU 121 Cb -0.13 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 2c1y s LEU 121 CO 0.03 -1.03 1.11 -2.65 -1.32 0.00 0.00 176.35 172.49 2c1y n PRO 122 N 7.38 1.07 0.24 0.98 -0.02 -1.26 -4.73 135.00 138.65 2c1y n PRO 122 Ca 0.19 0.41 0.16 0.00 -2.02 0.00 0.00 63.50 62.24 2c1y n PRO 122 Cb 0.41 -2.32 0.64 0.00 -0.02 0.00 0.00 33.50 32.21 2c1y n PRO 122 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2c1y h SER 123 N 0.65 0.00 0.78 2.55 4.64 -1.98 -1.88 113.55 118.31 2c1y h SER 123 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2c1y h SER 123 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2c1y h SER 123 CO 0.52 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.48 2c1y n HIS 124 N -2.84 0.00 -2.64 4.77 1.44 -1.26 -4.82 115.22 109.88 2c1y n HIS 124 Ca 0.01 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.29 2c1y n HIS 124 Cb 0.28 -0.42 -0.02 0.00 0.12 0.00 0.00 29.99 29.95 2c1y n HIS 124 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2c1y s VAL 125 N -2.83 4.66 0.46 0.61 1.01 -0.71 -5.03 120.40 118.57 2c1y s VAL 125 Ca 0.19 1.95 -0.25 0.00 0.00 0.00 0.00 61.98 63.86 2c1y s VAL 125 Cb 0.18 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 32.23 2c1y s VAL 125 CO 0.47 -0.04 1.42 0.47 0.00 0.00 0.00 175.10 177.43 2c1y n ASP 126 N 5.34 3.24 -4.42 3.32 10.43 -1.26 -4.94 116.55 128.26 2c1y n ASP 126 Ca 0.10 1.11 -0.45 0.00 2.57 0.00 0.00 54.79 58.12 2c1y n ASP 126 Cb 0.48 -1.60 -0.02 0.00 1.84 0.00 0.00 41.12 41.82 2c1y n ASP 126 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2c1y s VAL 127 N -1.20 5.13 0.15 2.53 1.01 -1.26 -4.73 120.40 122.03 2c1y s VAL 127 Ca 0.62 -2.22 0.08 0.00 0.00 0.00 0.00 61.98 60.46 2c1y s VAL 127 Cb -0.45 -4.72 -0.04 0.00 0.00 0.00 0.00 36.38 31.16 2c1y s VAL 127 CO 0.57 -1.40 -0.17 0.42 0.00 0.00 0.00 175.10 174.52 2c1y s THR 128 N 1.46 1.65 0.19 3.92 -4.23 -1.26 -4.61 115.64 112.76 2c1y s THR 128 Ca 0.32 -1.85 -0.14 0.00 -1.18 0.00 0.00 61.69 58.84 2c1y s THR 128 Cb -0.06 -1.74 0.20 0.00 1.34 0.00 0.00 72.50 72.24 2c1y s THR 128 CO -0.07 -0.35 1.26 -0.11 -0.54 0.00 0.00 174.62 174.82 2c1y n LEU 129 N 0.38 -0.52 0.02 4.79 0.00 -1.26 -1.40 117.00 119.01 2c1y n LEU 129 Ca -0.14 1.42 -0.17 0.00 0.00 0.00 0.00 56.01 57.12 2c1y n LEU 129 Cb 0.57 -0.33 -0.07 0.00 0.00 0.00 0.00 43.42 43.59 2c1y n LEU 129 CO 0.28 -1.28 0.19 0.44 0.00 0.00 0.00 177.39 177.03 2c1y h ASP 130 N 0.00 0.84 0.41 1.96 5.19 -1.96 -1.80 116.42 121.06 2c1y h ASP 130 Ca 0.29 -0.61 -0.07 0.00 -0.62 0.00 0.00 57.03 56.01 2c1y h ASP 130 Cb 0.49 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.74 2c1y h ASP 130 CO -0.81 1.41 -0.34 0.78 -3.12 0.00 0.00 179.24 177.16 2c1y h ASN 131 N 0.43 0.00 0.04 6.45 2.35 -1.80 -1.46 115.58 121.59 2c1y h ASN 131 Ca -0.08 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2c1y h ASN 131 Cb 1.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.90 2c1y h ASN 131 CO 0.18 0.34 -0.02 -0.07 -1.65 0.00 0.00 177.43 176.20 2c1y h LEU 132 N 0.00 -0.05 -0.54 1.61 -0.00 -0.74 -0.53 115.31 115.06 2c1y h LEU 132 Ca -0.00 -0.26 0.11 0.00 -0.00 0.00 0.00 57.88 57.73 2c1y h LEU 132 Cb 0.63 0.01 -0.10 0.00 -0.00 0.00 0.00 40.66 41.20 2c1y h LEU 132 CO 0.04 0.23 -0.11 0.11 -0.00 0.00 0.00 178.44 178.72 2c1y h LYS 133 N -0.34 0.02 -0.67 1.13 1.57 -1.34 -2.27 116.57 114.66 2c1y h LYS 133 Ca -0.01 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2c1y h LYS 133 Cb 0.31 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 2c1y h LYS 133 CO 0.01 0.01 0.45 0.00 -0.57 0.00 0.00 179.45 179.35 2c1y h ALA 134 N 1.53 1.55 -0.14 3.86 0.00 -1.20 -0.73 119.26 124.13 2c1y h ALA 134 Ca 0.26 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2c1y h ALA 134 Cb 0.40 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2c1y h ALA 134 CO -0.53 0.40 -0.03 0.35 0.00 0.00 0.00 179.25 179.43 2c1y h PHE 135 N 0.88 -0.07 0.10 0.00 3.57 -0.71 -0.90 116.94 119.80 2c1y h PHE 135 Ca 0.25 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 2c1y h PHE 135 Cb -0.05 0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.75 2c1y h PHE 135 CO -0.00 -0.06 -0.05 0.28 -2.23 0.00 0.00 178.31 176.25 2c1y h VAL 136 N 0.00 0.92 -0.55 1.41 2.07 -1.44 -3.14 116.25 115.54 2c1y h VAL 136 Ca 0.07 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 2c1y h VAL 136 Cb 0.10 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2c1y h VAL 136 CO -0.14 0.01 0.26 0.77 0.02 0.00 0.00 177.57 178.49 2c1y h SER 137 N -0.16 0.69 1.16 0.57 4.64 -1.10 -2.68 113.55 116.68 2c1y h SER 137 Ca -0.01 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2c1y h SER 137 Cb 0.13 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2c1y h SER 137 CO 0.02 0.59 0.00 0.00 -0.87 0.00 0.00 176.83 176.57 2c1y h ALA 138 N 1.52 1.00 0.00 5.18 0.00 -1.19 -3.36 119.26 122.42 2c1y h ALA 138 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2c1y h ALA 138 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2c1y h ALA 138 CO -0.03 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.31 2c1y n ASN 139 N -3.01 0.93 -4.10 0.00 3.02 -1.06 -5.05 115.26 105.99 2c1y n ASN 139 Ca 0.01 -1.14 -0.11 0.00 -0.03 0.00 0.00 54.58 53.32 2c1y n ASN 139 Cb 0.34 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.43 2c1y n ASN 139 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2c1y s THR 140 N -0.14 0.01 -1.35 3.41 -4.23 -1.04 -5.04 115.64 107.27 2c1y s THR 140 Ca 0.00 -1.72 0.14 0.00 -1.18 0.00 0.00 61.69 58.92 2c1y s THR 140 Cb 0.00 -2.32 0.21 0.00 1.34 0.00 0.00 72.50 71.74 2c1y s THR 140 CO 0.00 -0.04 1.37 -2.65 -0.54 0.00 0.00 174.62 172.76 2c1y n PRO 141 N -0.30 0.16 -2.48 3.99 -0.02 -1.26 -4.82 135.00 130.26 2c1y n PRO 141 Ca -0.00 0.18 -0.27 0.00 -2.02 0.00 0.00 63.50 61.38 2c1y n PRO 141 Cb 0.64 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.64 2c1y n PRO 141 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2c1y s LEU 142 N -2.65 3.41 -0.16 2.45 1.43 -1.26 -4.96 118.68 116.93 2c1y s LEU 142 Ca 0.12 0.83 -0.09 0.00 -1.03 0.00 0.00 54.13 53.96 2c1y s LEU 142 Cb 0.09 -3.73 0.06 0.00 0.03 0.00 0.00 46.19 42.65 2c1y s LEU 142 CO 0.22 -0.84 0.39 -0.47 0.23 0.00 0.00 176.35 175.88 2c1y s TYR 143 N -2.88 -0.58 -0.44 0.29 6.14 -1.26 -4.41 117.35 114.21 2c1y s TYR 143 Ca 0.51 1.24 0.02 0.00 0.64 0.00 0.00 57.07 59.49 2c1y s TYR 143 Cb -0.10 0.24 0.12 0.00 0.42 0.00 0.00 41.96 42.63 2c1y s TYR 143 CO 0.45 -0.34 0.18 0.42 0.64 0.00 0.00 175.55 176.90 2c1y s ILE 144 N 1.48 2.70 0.00 3.14 1.01 -1.26 -4.83 121.20 123.44 2c1y s ILE 144 Ca -0.09 -2.66 0.00 0.00 0.00 0.00 0.00 60.65 57.91 2c1y s ILE 144 Cb -0.09 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.48 2c1y s ILE 144 CO -0.12 -0.71 0.00 0.61 0.00 0.00 0.00 174.94 174.72 2c1y n GLY 145 N 3.89 3.67 3.69 6.18 0.00 -1.26 -4.94 105.19 116.42 2c1y n GLY 145 Ca 0.04 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2c1y n GLY 145 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c1y s ARG 146 N 4.70 4.43 0.11 1.61 0.52 -1.26 -4.98 118.95 124.09 2c1y s ARG 146 Ca 0.00 1.49 -0.32 0.00 -0.52 0.00 0.00 55.73 56.37 2c1y s ARG 146 Cb 0.00 -3.52 -0.18 0.00 0.52 0.00 0.00 34.95 31.78 2c1y s ARG 146 CO 0.00 -0.29 0.73 -3.47 0.02 0.00 0.00 175.30 172.29 2c1y n ASP 147 N 4.76 -0.71 0.00 0.23 2.03 -1.26 -2.00 116.55 119.60 2c1y n ASP 147 Ca 0.09 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.51 2c1y n ASP 147 Cb 0.48 -0.92 0.00 0.00 -0.72 0.00 0.00 41.12 39.97 2c1y n ASP 147 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2c1y n GLY 148 N 1.75 2.89 3.72 0.27 0.00 -1.26 -4.38 105.19 108.19 2c1y n GLY 148 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2c1y n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c1y s ILE 150 N -2.53 -0.39 0.19 0.00 1.01 -1.26 -5.04 121.20 113.18 2c1y s ILE 150 Ca 0.67 0.00 -0.12 0.00 0.00 0.00 0.00 60.65 61.20 2c1y s ILE 150 Cb -0.22 -0.63 0.11 0.00 0.01 0.00 0.00 42.46 41.72 2c1y s ILE 150 CO 0.53 -0.10 1.72 0.50 0.00 0.00 0.00 174.94 177.59 2c1y h LYS 151 N 8.29 0.26 0.00 2.79 3.64 -1.96 -0.21 116.57 129.37 2c1y h LYS 151 Ca -0.17 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 2c1y h LYS 151 Cb 1.14 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2c1y h LYS 151 CO 0.24 0.17 -0.13 0.93 -2.27 0.00 0.00 179.45 178.39 2c1y h GLU 152 N 0.27 0.00 0.01 1.90 3.07 -1.97 -1.11 114.58 116.74 2c1y h GLU 152 Ca 0.25 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.11 2c1y h GLU 152 Cb 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 2c1y h GLU 152 CO -0.32 0.13 -0.00 0.74 -1.40 0.00 0.00 179.01 178.16 2c1y h PHE 153 N 0.00 -0.01 -0.92 4.33 -1.00 -1.76 -3.31 116.94 114.28 2c1y h PHE 153 Ca -0.00 -0.00 0.18 0.00 2.81 0.00 0.00 57.97 60.96 2c1y h PHE 153 Cb 0.35 0.00 -0.11 0.00 3.61 0.00 0.00 35.95 39.81 2c1y h PHE 153 CO 0.00 0.83 0.49 -0.91 -1.61 0.00 0.00 178.31 177.11 2c1y h ASN 154 N -0.92 0.58 -0.56 2.17 2.35 -1.06 -2.79 115.58 115.35 2c1y h ASN 154 Ca -0.00 0.11 0.07 0.00 -0.55 0.00 0.00 56.30 55.93 2c1y h ASN 154 Cb 0.84 0.02 -0.06 0.00 0.05 0.00 0.00 38.32 39.17 2c1y h ASN 154 CO 0.00 0.18 0.23 -0.33 -1.65 0.00 0.00 177.43 175.87 2c1y h GLU 155 N 0.62 0.43 0.00 0.81 3.07 -1.28 -2.23 114.58 115.99 2c1y h GLU 155 Ca 0.53 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 2c1y h GLU 155 Cb 0.86 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.67 2c1y h GLU 155 CO -0.41 0.28 0.00 1.33 -1.40 0.00 0.00 179.01 178.81 2c1y n VAL 156 N -4.95 0.46 0.87 3.13 0.24 -1.12 -4.38 118.33 112.57 2c1y n VAL 156 Ca 0.07 0.06 0.09 0.00 -2.04 0.00 0.00 64.34 62.53 2c1y n VAL 156 Cb 0.21 -0.72 -0.03 0.00 -1.47 0.00 0.00 33.84 31.83 2c1y n VAL 156 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2c1y n LEU 157 N -1.65 1.63 -4.67 1.34 4.77 -0.84 -4.87 117.00 112.70 2c1y n LEU 157 Ca 0.05 -0.70 -0.45 0.00 -0.03 0.00 0.00 56.01 54.88 2c1y n LEU 157 Cb 0.29 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2c1y n LEU 157 CO 0.22 0.32 1.05 0.29 -1.33 0.00 0.00 177.39 177.95 2c1y n LYS 158 N -0.37 2.08 -4.35 3.23 4.76 -1.23 -1.51 118.16 120.76 2c1y n LYS 158 Ca 0.07 0.74 -0.37 0.00 -2.87 0.00 0.00 58.31 55.88 2c1y n LYS 158 Cb 0.38 -2.42 -0.06 0.00 -1.84 0.00 0.00 35.03 31.09 2c1y n LYS 158 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2c1y n ASN 159 N 2.37 -1.64 -0.24 4.39 5.03 -1.26 -4.88 115.26 119.02 2c1y n ASN 159 Ca 0.12 -1.16 0.02 0.00 0.87 0.00 0.00 54.58 54.43 2c1y n ASN 159 Cb 0.31 -2.09 0.14 0.00 -1.02 0.00 0.00 39.78 37.12 2c1y n ASN 159 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 2c1y h TYR 160 N -1.32 0.61 -0.03 3.10 5.03 -1.57 -2.80 116.97 119.98 2c1y h TYR 160 Ca -0.61 0.03 0.01 0.00 2.58 0.00 0.00 58.73 60.74 2c1y h TYR 160 Cb 1.39 -0.17 -0.00 0.00 1.55 0.00 0.00 36.73 39.50 2c1y h TYR 160 CO 0.63 0.21 0.06 0.00 -1.32 0.00 0.00 178.16 177.74 2c1y h ALA 161 N 1.44 1.40 -0.02 1.82 0.00 -1.86 -2.28 119.26 119.76 2c1y h ALA 161 Ca 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2c1y h ALA 161 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2c1y h ALA 161 CO -0.28 -0.08 0.00 0.09 0.00 0.00 0.00 179.25 178.98 2c1y n ASN 162 N -3.53 1.77 -4.89 0.00 3.02 -1.06 -4.70 115.26 105.86 2c1y n ASN 162 Ca -0.02 -1.39 -0.28 0.00 -0.03 0.00 0.00 54.58 52.86 2c1y n ASN 162 Cb 0.14 -0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.30 2c1y n ASN 162 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2c1y s ILE 163 N -0.75 4.86 0.67 2.41 -4.36 -0.86 -4.68 121.20 118.49 2c1y s ILE 163 Ca 0.11 0.38 -0.17 0.00 -0.26 0.00 0.00 60.65 60.70 2c1y s ILE 163 Cb 0.07 -3.84 0.00 0.00 1.25 0.00 0.00 42.46 39.95 2c1y s ILE 163 CO 0.11 -0.83 1.28 -2.84 0.24 0.00 0.00 174.94 172.90 2c1y s PRO 164 N -4.62 2.40 0.27 0.37 0.02 -1.26 -4.66 135.00 127.51 2c1y s PRO 164 Ca 0.49 2.01 -0.00 0.00 0.02 0.00 0.00 61.00 63.51 2c1y s PRO 164 Cb -0.10 -1.83 0.61 0.00 0.02 0.00 0.00 34.50 33.19 2c1y s PRO 164 CO 0.43 -1.70 1.38 -0.25 -0.33 0.00 0.00 177.00 176.53 2c1y n ASP 165 N -2.14 -0.15 -0.02 2.53 9.92 -1.26 -0.39 116.55 125.04 2c1y n ASP 165 Ca 0.15 1.50 -0.10 0.00 -0.53 0.00 0.00 54.79 55.81 2c1y n ASP 165 Cb 0.49 -0.52 0.04 0.00 -0.64 0.00 0.00 41.12 40.48 2c1y n ASP 165 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2c1y h ALA 166 N 1.76 0.67 -0.35 2.24 0.00 -2.00 -2.37 119.26 119.22 2c1y h ALA 166 Ca 0.51 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2c1y h ALA 166 Cb 0.99 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2c1y h ALA 166 CO -0.85 0.68 -0.32 1.05 0.00 0.00 0.00 179.25 179.82 2c1y h GLU 167 N 0.49 0.83 -0.84 0.00 4.11 -1.78 -2.42 114.58 114.97 2c1y h GLU 167 Ca 0.02 -0.43 0.03 0.00 0.07 0.00 0.00 59.36 59.06 2c1y h GLU 167 Cb 1.07 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.28 2c1y h GLU 167 CO 0.10 1.06 0.55 1.96 0.07 0.00 0.00 179.01 182.76 2c1y h GLN 168 N 0.62 1.01 0.07 1.06 4.20 -0.45 -1.63 115.11 119.99 2c1y h GLN 168 Ca 0.06 -0.06 -0.26 0.00 0.06 0.00 0.00 58.65 58.45 2c1y h GLN 168 Cb 0.90 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 28.46 2c1y h GLN 168 CO 0.08 0.67 -1.10 -0.07 -0.67 0.00 0.00 178.83 177.74 2c1y h LEU 169 N 1.04 0.55 -1.19 1.46 3.38 -1.45 -2.22 115.31 116.88 2c1y h LEU 169 Ca 0.33 -0.50 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 2c1y h LEU 169 Cb 0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2c1y h LEU 169 CO -0.10 1.33 0.04 0.11 0.09 0.00 0.00 178.44 179.91 2c1y h LYS 170 N 0.18 0.60 -0.33 1.13 1.57 -1.13 -0.92 116.57 117.67 2c1y h LYS 170 Ca -0.12 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.41 2c1y h LYS 170 Cb 1.77 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.98 2c1y h LYS 170 CO 0.19 0.59 -0.34 -0.07 -0.57 0.00 0.00 179.45 179.25 2c1y h LEU 171 N 0.57 0.77 0.32 2.94 3.38 -1.19 -1.81 115.31 120.30 2c1y h LEU 171 Ca 0.13 -0.32 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 2c1y h LEU 171 Cb 0.31 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2c1y h LEU 171 CO 0.01 1.04 -0.29 0.40 0.09 0.00 0.00 178.44 179.68 2c1y h ILE 172 N 0.62 0.38 -0.64 1.22 2.04 -1.19 0.11 117.51 120.05 2c1y h ILE 172 Ca 0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.99 2c1y h ILE 172 Cb 0.87 0.38 -0.10 0.00 -0.74 0.00 0.00 36.82 37.23 2c1y h ILE 172 CO 0.08 0.00 -0.55 -0.33 0.00 0.00 0.00 178.15 177.34 2c1y h GLU 173 N -0.63 -0.23 -0.24 2.37 5.08 -1.10 -0.39 114.58 119.44 2c1y h GLU 173 Ca -0.02 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2c1y h GLU 173 Cb 0.57 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.81 2c1y h GLU 173 CO -0.05 -0.15 -0.23 0.87 -1.00 0.00 0.00 179.01 178.45 2c1y h LYS 174 N -0.24 -0.23 0.00 2.33 1.57 -1.22 0.12 116.57 118.90 2c1y h LYS 174 Ca 0.12 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 2c1y h LYS 174 Cb 0.53 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2c1y h LYS 174 CO -0.73 -0.15 -0.26 -0.07 -0.57 0.00 0.00 179.45 177.67 2c1y h LEU 175 N -0.24 0.00 0.04 2.94 3.38 -0.50 -1.76 115.31 119.17 2c1y h LEU 175 Ca 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2c1y h LEU 175 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2c1y h LEU 175 CO -0.38 0.26 -0.02 1.56 0.09 0.00 0.00 178.44 179.95 2c1y h GLN 176 N 0.00 -0.05 -0.89 1.13 1.08 -0.73 0.35 115.11 116.00 2c1y h GLN 176 Ca -0.00 0.00 0.21 0.00 -1.45 0.00 0.00 58.65 57.41 2c1y h GLN 176 Cb 1.04 0.01 -0.16 0.00 -0.05 0.00 0.00 27.48 28.32 2c1y h GLN 176 CO 0.03 0.27 -0.06 0.00 -0.95 0.00 0.00 178.83 178.11 2c1y h ALA 177 N 0.58 0.85 -0.01 3.87 0.00 -0.01 -1.74 119.26 122.80 2c1y h ALA 177 Ca -0.01 0.31 -0.17 0.00 0.00 0.00 0.00 54.91 55.05 2c1y h ALA 177 Cb 0.34 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2c1y h ALA 177 CO 0.01 -0.46 -0.76 0.87 0.00 0.00 0.00 179.25 178.90 2c1y h LYS 178 N 0.04 0.13 -0.73 0.00 1.57 -1.01 -2.96 116.57 113.60 2c1y h LYS 178 Ca 0.48 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 59.12 2c1y h LYS 178 Cb 0.88 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.18 2c1y h LYS 178 CO -0.84 0.83 0.34 0.37 -0.57 0.00 0.00 179.45 179.58 2c1y h GLN 179 N 0.08 1.06 -0.99 3.15 4.15 -0.05 -3.13 115.11 119.38 2c1y h GLN 179 Ca -0.02 -0.16 0.04 0.00 0.77 0.00 0.00 58.65 59.28 2c1y h GLN 179 Cb 1.34 -0.19 -0.06 0.00 0.21 0.00 0.00 27.48 28.78 2c1y h GLN 179 CO 0.11 0.84 0.65 0.93 -1.93 0.00 0.00 178.83 179.43 2c1y h GLU 180 N 1.03 1.20 -0.20 1.69 3.07 -1.25 -2.81 114.58 117.30 2c1y h GLU 180 Ca 0.25 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2c1y h GLU 180 Cb 0.13 -0.27 0.00 0.00 -0.84 0.00 0.00 28.75 27.77 2c1y h GLU 180 CO -0.03 0.79 0.00 1.04 -1.40 0.00 0.00 179.01 179.41 2c1y n GLN 181 N -4.45 1.83 -2.10 2.33 6.02 -1.19 -4.96 117.38 114.85 2c1y n GLN 181 Ca 0.14 -1.25 -0.42 0.00 -0.01 0.00 0.00 57.00 55.46 2c1y n GLN 181 Cb 0.12 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 29.95 2c1y n GLN 181 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2c1y s LEU 182 N -1.52 4.36 -0.10 1.08 1.43 -1.06 -5.02 118.68 117.85 2c1y s LEU 182 Ca 0.32 2.37 -0.15 0.00 -1.03 0.00 0.00 54.13 55.64 2c1y s LEU 182 Cb 0.18 -3.58 -0.27 0.00 0.03 0.00 0.00 46.19 42.54 2c1y s LEU 182 CO 0.26 -0.73 0.54 0.74 0.23 0.00 0.00 176.35 177.39 2c1y h THR 183 N 4.40 0.99 -3.33 5.49 2.02 -1.93 -3.45 112.91 117.11 2c1y h THR 183 Ca -0.42 -2.40 -0.55 0.00 0.77 0.00 0.00 66.41 63.82 2c1y h THR 183 Cb 1.20 2.69 -0.03 0.00 -1.74 0.00 0.00 68.15 70.27 2c1y h THR 183 CO 0.89 0.72 0.46 -0.62 0.37 0.00 0.00 175.52 177.34 2c1y s ASP 184 N -7.05 7.29 0.00 4.18 2.15 -1.26 -4.91 116.67 117.07 2c1y s ASP 184 Ca -0.20 1.57 -0.00 0.00 0.43 0.00 0.00 52.55 54.35 2c1y s ASP 184 Cb 0.05 -2.56 -0.00 0.00 -0.30 0.00 0.00 42.92 40.11 2c1y s ASP 184 CO 0.77 -0.35 0.57 -2.65 -0.17 0.00 0.00 175.17 173.33 2c1y n PRO 185 N 4.48 -0.01 -0.23 4.34 -0.02 -1.26 -0.23 135.00 142.07 2c1y n PRO 185 Ca 0.07 0.56 -0.06 0.00 -2.02 0.00 0.00 63.50 62.06 2c1y n PRO 185 Cb 0.50 -0.85 -0.05 0.00 -0.02 0.00 0.00 33.50 33.08 2c1y n PRO 185 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2c1y n GLU 186 N -2.62 -0.24 -0.32 -0.52 2.13 -1.26 -2.15 120.64 115.66 2c1y n GLU 186 Ca 0.00 1.10 0.08 0.00 0.66 0.00 0.00 57.16 59.00 2c1y n GLU 186 Cb 0.00 -1.63 0.24 0.00 0.27 0.00 0.00 31.44 30.33 2c1y n GLU 186 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 2c1y h GLN 187 N 0.00 0.75 -0.51 5.31 5.75 -1.78 0.31 115.11 124.95 2c1y h GLN 187 Ca 0.09 -0.05 0.09 0.00 -0.15 0.00 0.00 58.65 58.63 2c1y h GLN 187 Cb 0.22 -0.17 -0.07 0.00 1.07 0.00 0.00 27.48 28.53 2c1y h GLN 187 CO -0.50 0.50 0.11 1.96 -2.65 0.00 0.00 178.83 178.24 2c1y h GLN 188 N 0.77 0.24 -0.33 1.69 4.20 -0.12 -2.29 115.11 119.27 2c1y h GLN 188 Ca 0.49 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 59.11 2c1y h GLN 188 Cb 0.62 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 2c1y h GLN 188 CO -0.32 0.16 -0.10 1.96 -0.67 0.00 0.00 178.83 179.86 2c1y h GLN 189 N 0.25 0.65 -1.11 1.46 7.50 -0.47 -2.06 115.11 121.33 2c1y h GLN 189 Ca 0.26 -0.26 0.33 0.00 0.50 0.00 0.00 58.65 59.48 2c1y h GLN 189 Cb 0.34 -0.03 -0.12 0.00 0.05 0.00 0.00 27.48 27.72 2c1y h GLN 189 CO -0.33 0.83 0.69 -0.91 -1.50 0.00 0.00 178.83 177.61 2c1y h ASN 190 N 0.43 0.42 0.65 1.46 2.35 -1.12 -2.68 115.58 117.09 2c1y h ASN 190 Ca 0.08 0.13 -0.27 0.00 -0.55 0.00 0.00 56.30 55.69 2c1y h ASN 190 Cb 0.60 0.08 -0.00 0.00 0.05 0.00 0.00 38.32 39.05 2c1y h ASN 190 CO 0.04 -0.05 -1.25 0.00 -1.65 0.00 0.00 177.43 174.52 2c1y h ALA 191 N 1.68 0.14 -0.72 -0.83 0.00 -0.96 -2.88 119.26 115.70 2c1y h ALA 191 Ca 0.70 -0.91 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2c1y h ALA 191 Cb 1.83 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.61 2c1y h ALA 191 CO -0.43 1.02 0.23 0.00 0.00 0.00 0.00 179.25 180.07 2c1y h ARG 192 N 0.07 1.11 -0.16 0.00 3.08 -1.12 -1.74 114.38 115.62 2c1y h ARG 192 Ca -0.13 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.68 2c1y h ARG 192 Cb 1.96 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.84 2c1y h ARG 192 CO 0.19 0.95 0.08 0.00 -1.07 0.00 0.00 179.97 180.12 2c1y h ALA 193 N 1.11 0.20 -0.24 0.04 0.00 -1.50 -0.28 119.26 118.59 2c1y h ALA 193 Ca 0.23 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.13 2c1y h ALA 193 Cb 0.30 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 2c1y h ALA 193 CO -0.01 -0.25 -0.43 1.88 0.00 0.00 0.00 179.25 180.44 2c1y h TYR 194 N 0.14 -1.24 -0.70 0.00 -1.99 -1.30 -1.26 116.97 110.63 2c1y h TYR 194 Ca 0.06 0.06 -0.05 0.00 2.00 0.00 0.00 58.73 60.79 2c1y h TYR 194 Cb 0.09 0.58 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 2c1y h TYR 194 CO -0.03 -0.46 0.23 -0.07 -0.00 0.00 0.00 178.16 177.82 2c1y h LEU 195 N -0.43 1.00 -0.79 3.88 -0.00 -1.25 0.03 115.31 117.75 2c1y h LEU 195 Ca 0.10 -0.20 0.10 0.00 -0.00 0.00 0.00 57.88 57.87 2c1y h LEU 195 Cb 0.61 -0.26 -0.07 0.00 -0.00 0.00 0.00 40.66 40.94 2c1y h LEU 195 CO -0.47 0.93 0.44 0.40 -0.00 0.00 0.00 178.44 179.74 2c1y h ILE 196 N 1.01 0.89 -0.04 1.22 2.04 -0.78 -0.05 117.51 121.79 2c1y h ILE 196 Ca 0.23 -0.25 -0.20 0.00 1.00 0.00 0.00 64.86 65.63 2c1y h ILE 196 Cb 0.28 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2c1y h ILE 196 CO -0.01 0.13 -0.83 1.88 0.00 0.00 0.00 178.15 179.32 2c1y h TYR 197 N 0.73 0.59 -0.65 1.37 0.99 -0.79 -1.52 116.97 117.69 2c1y h TYR 197 Ca 0.38 -0.29 -0.06 0.00 2.00 0.00 0.00 58.73 60.76 2c1y h TYR 197 Cb 0.37 -0.08 -0.03 0.00 1.00 0.00 0.00 36.73 37.99 2c1y h TYR 197 CO -0.07 1.08 0.15 0.52 -0.00 0.00 0.00 178.16 179.83 2c1y h MET 198 N 0.26 1.03 -0.04 4.88 2.86 -0.47 -2.36 114.93 121.09 2c1y h MET 198 Ca -0.05 -0.24 -0.21 0.00 -2.06 0.00 0.00 59.70 57.14 2c1y h MET 198 Cb 1.43 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.95 2c1y h MET 198 CO 0.14 0.91 -0.84 0.00 1.06 0.00 0.00 176.91 178.18 2c1y h ARG 199 N 0.98 0.44 -0.30 1.72 3.08 -0.73 -2.49 114.38 117.07 2c1y h ARG 199 Ca 0.21 -0.41 -0.18 0.00 0.07 0.00 0.00 59.98 59.66 2c1y h ARG 199 Cb 0.35 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 2c1y h ARG 199 CO 0.00 1.06 -0.51 0.87 -1.07 0.00 0.00 179.97 180.32 2c1y h LYS 200 N 0.27 0.87 -0.21 0.04 1.79 -1.29 -0.84 116.57 117.20 2c1y h LYS 200 Ca -0.06 -0.53 -0.15 0.00 -2.18 0.00 0.00 60.65 57.73 2c1y h LYS 200 Cb 1.46 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 32.15 2c1y h LYS 200 CO 0.15 1.17 -0.50 0.82 -1.08 0.00 0.00 179.45 180.01 2c1y h ILE 201 N 0.68 1.31 0.16 1.86 2.04 -1.50 0.69 117.51 122.75 2c1y h ILE 201 Ca 0.02 -1.72 -0.01 0.00 1.00 0.00 0.00 64.86 64.16 2c1y h ILE 201 Cb 1.12 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 2c1y h ILE 201 CO 0.12 0.54 -0.07 -0.74 0.00 0.00 0.00 178.15 177.99 2c1y h HIS 202 N 0.46 -0.19 0.95 1.37 2.76 -1.42 -0.55 115.15 118.53 2c1y h HIS 202 Ca 0.02 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 2c1y h HIS 202 Cb 1.03 0.06 0.01 0.00 1.55 0.00 0.00 27.41 30.07 2c1y h HIS 202 CO 0.04 -0.01 -0.47 1.49 -1.30 0.00 0.00 177.93 177.69 2c1y h GLU 203 N -0.35 -1.24 0.00 5.26 4.81 -0.88 -3.38 114.58 118.80 2c1y h GLU 203 Ca -0.02 0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2c1y h GLU 203 Cb 0.28 0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2c1y h GLU 203 CO 0.04 -0.83 -1.62 0.28 -0.73 0.00 0.00 179.01 176.15 2c1y n VAL 204 N -5.65 0.02 -2.36 0.32 0.31 0.24 -5.08 118.33 106.13 2c1y n VAL 204 Ca -0.16 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 63.84 2c1y n VAL 204 Cb 0.51 0.32 0.00 0.00 -0.91 0.00 0.00 33.84 33.76 2c1y n VAL 204 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c1y n GLY 205 N 1.34 -2.17 0.28 2.92 0.00 -0.21 -4.49 105.19 102.86 2c1y n GLY 205 Ca -0.01 -1.61 0.11 0.00 0.00 0.00 0.00 46.02 44.50 2c1y n GLY 205 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c1y h TYR 206 N 0.00 0.00 -0.61 1.61 3.20 -1.89 -2.52 116.97 116.76 2c1y h TYR 206 Ca 0.00 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.05 2c1y h TYR 206 Cb 0.00 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2c1y h TYR 206 CO 0.00 0.00 0.63 -0.44 -1.64 0.00 0.00 178.16 176.71 2c1y h ASP 207 N 0.00 0.00 -0.10 -2.11 5.19 -1.98 -2.35 116.42 115.08 2c1y h ASP 207 Ca 0.01 0.00 0.03 0.00 -0.62 0.00 0.00 57.03 56.45 2c1y h ASP 207 Cb 0.06 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.57 2c1y h ASP 207 CO -0.00 0.00 0.11 0.15 -3.12 0.00 0.00 179.24 176.38 2c1y h PHE 208 N 0.00 0.00 0.58 4.55 3.57 -1.73 -2.60 116.94 121.31 2c1y h PHE 208 Ca 0.29 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.76 2c1y h PHE 208 Cb 1.54 0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.29 2c1y h PHE 208 CO 0.00 0.00 -0.28 -0.07 -2.23 0.00 0.00 178.31 175.73 2c1y h LEU 209 N 0.00 -0.66 -0.77 0.59 -0.00 -1.68 0.79 115.31 113.57 2c1y h LEU 209 Ca 0.05 -0.02 0.16 0.00 -0.00 0.00 0.00 57.88 58.07 2c1y h LEU 209 Cb 0.27 0.17 -0.10 0.00 -0.00 0.00 0.00 40.66 40.99 2c1y h LEU 209 CO -0.00 -0.27 0.28 -0.08 -0.00 0.00 0.00 178.44 178.38 2c1y h GLU 210 N -1.14 0.38 0.60 1.13 4.57 -1.71 -1.27 114.58 117.14 2c1y h GLU 210 Ca -0.08 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.05 2c1y h GLU 210 Cb 0.63 -0.09 0.01 0.00 -0.16 0.00 0.00 28.75 29.14 2c1y h GLU 210 CO 0.13 0.25 -0.29 0.93 -1.18 0.00 0.00 179.01 178.86 2c1y h GLU 211 N 0.39 -0.77 -0.56 1.92 3.07 -1.43 -2.17 114.58 115.03 2c1y h GLU 211 Ca 0.44 0.05 0.03 0.00 -0.50 0.00 0.00 59.36 59.38 2c1y h GLU 211 Cb 0.71 0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 28.76 2c1y h GLU 211 CO -0.45 -0.50 0.33 1.49 -1.40 0.00 0.00 179.01 178.48 2c1y h GLU 212 N -0.86 0.62 0.00 2.33 4.57 -0.75 -1.66 114.58 118.84 2c1y h GLU 212 Ca -0.08 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.08 2c1y h GLU 212 Cb 0.64 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 2c1y h GLU 212 CO 0.14 0.41 -0.11 1.15 -1.18 0.00 0.00 179.01 179.42 2c1y h THR 213 N 0.64 0.73 -0.35 0.32 2.02 -1.27 -1.55 112.91 113.44 2c1y h THR 213 Ca 0.23 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.48 2c1y h THR 213 Cb 0.05 0.73 -0.07 0.00 -1.74 0.00 0.00 68.15 67.12 2c1y h THR 213 CO -0.11 0.00 -0.11 0.11 0.37 0.00 0.00 175.52 175.78 2c1y h LYS 214 N -0.19 -0.03 -0.37 6.66 1.57 -1.20 -2.23 116.57 120.78 2c1y h LYS 214 Ca 0.04 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2c1y h LYS 214 Cb 0.23 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 2c1y h LYS 214 CO -0.11 -0.02 0.09 -0.09 -0.57 0.00 0.00 179.45 178.76 2c1y h ARG 215 N -0.03 0.22 -0.68 3.15 2.43 -1.11 -2.73 114.38 115.63 2c1y h ARG 215 Ca 0.17 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 2c1y h ARG 215 Cb 0.30 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 2c1y h ARG 215 CO -0.38 0.15 0.17 -0.07 -1.51 0.00 0.00 179.97 178.32 2c1y h LEU 216 N 0.23 1.03 -1.06 3.80 3.38 -1.26 0.17 115.31 121.60 2c1y h LEU 216 Ca 0.17 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2c1y h LEU 216 Cb 0.18 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2c1y h LEU 216 CO -0.21 1.00 -0.43 -0.07 0.09 0.00 0.00 178.44 178.82 2c1y h LEU 217 N 1.02 0.00 -0.02 1.67 3.38 -1.35 -0.17 115.31 119.84 2c1y h LEU 217 Ca 0.21 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2c1y h LEU 217 Cb 0.37 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.13 2c1y h LEU 217 CO 0.00 0.43 -0.38 -0.09 0.09 0.00 0.00 178.44 178.49 2c1y h ARG 218 N 0.00 0.29 -0.79 1.13 9.65 -1.19 0.05 114.38 123.52 2c1y h ARG 218 Ca -0.00 -0.29 0.17 0.00 -1.10 0.00 0.00 59.98 58.75 2c1y h ARG 218 Cb 0.84 0.08 -0.15 0.00 -1.39 0.00 0.00 29.97 29.35 2c1y h ARG 218 CO 0.06 0.98 -0.13 -0.07 2.80 0.00 0.00 179.97 183.60 2c1y h LEU 219 N -0.29 -0.62 -0.70 3.80 3.38 -0.73 -2.82 115.31 117.34 2c1y h LEU 219 Ca -0.04 0.23 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 2c1y h LEU 219 Cb 1.10 0.45 -0.01 0.00 0.09 0.00 0.00 40.66 42.28 2c1y h LEU 219 CO 0.08 -0.25 -0.50 0.50 0.09 0.00 0.00 178.44 178.36 2c1y h LYS 220 N 0.02 0.00 0.00 1.13 3.64 -0.93 -2.18 116.57 118.25 2c1y h LYS 220 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2c1y h LYS 220 Cb 0.65 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2c1y h LYS 220 CO -0.78 0.50 0.00 0.00 -2.27 0.00 0.00 179.45 176.90 2c1y n ALA 221 N -2.32 2.26 -2.31 5.00 0.00 -0.00 -4.89 120.51 118.26 2c1y n ALA 221 Ca -0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 53.44 53.12 2c1y n ALA 221 Cb 0.60 -1.38 0.12 0.00 0.00 0.00 0.00 19.45 18.79 2c1y n ALA 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c1y n GLY 222 N 0.62 0.00 3.62 0.00 0.00 -0.82 -5.03 105.19 103.58 2c1y n GLY 222 Ca 0.14 -1.92 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 2c1y n GLY 222 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2c1y s LYS 223 N -4.91 3.72 0.06 1.61 2.47 -1.26 -5.01 119.74 116.41 2c1y s LYS 223 Ca 0.58 1.56 -0.03 0.00 -1.56 0.00 0.00 55.97 56.52 2c1y s LYS 223 Cb -0.03 -4.05 -0.03 0.00 -1.46 0.00 0.00 37.83 32.26 2c1y s LYS 223 CO 0.39 -1.39 0.02 0.14 0.16 0.00 0.00 175.35 174.67 2c1y s VAL 224 N 5.43 0.20 0.24 4.02 -7.23 -1.26 -5.09 120.40 116.71 2c1y s VAL 224 Ca 0.71 -1.66 -0.08 0.00 -1.81 0.00 0.00 61.98 59.14 2c1y s VAL 224 Cb -0.23 -1.46 -0.07 0.00 0.56 0.00 0.00 36.38 35.18 2c1y s VAL 224 CO 0.30 -0.92 0.54 0.42 -0.31 0.00 0.00 175.10 175.14 2c1y s THR 225 N -3.85 4.96 0.35 5.32 -4.23 -1.26 -4.90 115.64 112.04 2c1y s THR 225 Ca 0.06 0.36 0.17 0.00 -1.18 0.00 0.00 61.69 61.10 2c1y s THR 225 Cb 0.07 -3.64 0.35 0.00 1.34 0.00 0.00 72.50 70.61 2c1y s THR 225 CO -0.10 -0.13 1.61 -0.33 -0.54 0.00 0.00 174.62 175.13 2c1y h GLU 226 N 2.35 0.10 -0.29 3.99 4.39 -2.01 0.16 114.58 123.27 2c1y h GLU 226 Ca -0.47 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.12 2c1y h GLU 226 Cb 1.17 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 2c1y h GLU 226 CO 0.69 0.07 -0.28 0.00 -1.16 0.00 0.00 179.01 178.33 2c1y h ALA 227 N 1.95 0.98 -0.21 3.43 0.00 -1.99 -1.02 119.26 122.40 2c1y h ALA 227 Ca 0.79 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 55.24 2c1y h ALA 227 Cb 1.96 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.62 2c1y h ALA 227 CO -0.73 0.60 -0.21 1.57 0.00 0.00 0.00 179.25 180.48 2c1y h LYS 228 N 0.51 0.51 -0.51 0.00 5.09 -1.18 -2.38 116.57 118.61 2c1y h LYS 228 Ca 0.07 -0.27 0.10 0.00 0.09 0.00 0.00 60.65 60.64 2c1y h LYS 228 Cb 0.74 0.01 -0.10 0.00 0.10 0.00 0.00 32.23 32.97 2c1y h LYS 228 CO 0.06 0.85 -0.25 -0.22 -2.09 0.00 0.00 179.45 177.80 2c1y h LYS 229 N 0.19 -0.13 0.00 0.07 3.64 -0.83 -0.24 116.57 119.27 2c1y h LYS 229 Ca 0.03 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.35 2c1y h LYS 229 Cb 0.76 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2c1y h LYS 229 CO 0.05 -0.09 -0.34 0.93 -2.27 0.00 0.00 179.45 177.74 2c1y h GLU 230 N -0.14 0.00 -0.06 1.90 5.08 -1.13 -0.05 114.58 120.19 2c1y h GLU 230 Ca 0.23 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.35 2c1y h GLU 230 Cb 0.50 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 2c1y h GLU 230 CO -0.59 0.34 -0.91 1.49 -1.00 0.00 0.00 179.01 178.33 2c1y h GLU 231 N 0.00 0.65 -0.33 2.33 4.81 -0.86 -2.06 114.58 119.11 2c1y h GLU 231 Ca -0.00 -0.62 -0.01 0.00 -0.13 0.00 0.00 59.36 58.59 2c1y h GLU 231 Cb 0.71 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.23 2c1y h GLU 231 CO 0.04 1.23 0.17 -0.07 -0.73 0.00 0.00 179.01 179.65 2c1y h LEU 232 N 0.40 0.43 -0.41 1.64 3.38 -0.54 -2.08 115.31 118.13 2c1y h LEU 232 Ca -0.09 -0.12 0.08 0.00 0.09 0.00 0.00 57.88 57.85 2c1y h LEU 232 Cb 1.55 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 42.11 2c1y h LEU 232 CO 0.18 0.43 -0.05 -0.07 0.09 0.00 0.00 178.44 179.02 2c1y h LEU 233 N 0.41 -0.27 -1.30 1.67 3.38 -1.07 -1.25 115.31 116.87 2c1y h LEU 233 Ca 0.12 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.31 2c1y h LEU 233 Cb 0.11 0.21 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 2c1y h LEU 233 CO -0.02 -0.09 0.55 0.03 0.09 0.00 0.00 178.44 179.00 2c1y h ARG 234 N 0.06 0.71 -0.34 1.13 3.08 -1.12 0.30 114.38 118.20 2c1y h ARG 234 Ca 0.20 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 60.12 2c1y h ARG 234 Cb 0.30 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2c1y h ARG 234 CO -0.38 0.47 -0.16 0.87 -1.07 0.00 0.00 179.97 179.70 2c1y h LYS 235 N 0.74 0.71 -0.46 0.04 1.57 -1.18 -1.72 116.57 116.27 2c1y h LYS 235 Ca 0.41 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 2c1y h LYS 235 Cb 0.55 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2c1y h LYS 235 CO -0.17 0.91 0.01 -0.07 -0.57 0.00 0.00 179.45 179.55 2c1y h LEU 236 N 0.49 0.72 -0.62 2.94 3.38 -0.93 -0.99 115.31 120.29 2c1y h LEU 236 Ca 0.08 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2c1y h LEU 236 Cb 0.69 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 2c1y h LEU 236 CO 0.05 0.78 0.29 0.78 0.09 0.00 0.00 178.44 180.43 2c1y h ASN 237 N 0.70 0.83 -0.24 -0.43 2.35 -0.29 -1.47 115.58 117.03 2c1y h ASN 237 Ca 0.14 -0.14 -0.13 0.00 -0.55 0.00 0.00 56.30 55.62 2c1y h ASN 237 Cb 0.43 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 2c1y h ASN 237 CO 0.02 0.74 -0.36 0.40 -1.65 0.00 0.00 177.43 176.57 2c1y h ILE 238 N 0.86 1.31 -0.68 2.81 2.04 -1.11 -3.09 117.51 119.66 2c1y h ILE 238 Ca 0.21 -1.56 0.01 0.00 1.00 0.00 0.00 64.86 64.52 2c1y h ILE 238 Cb 0.14 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 2c1y h ILE 238 CO -0.02 0.49 0.45 0.25 0.00 0.00 0.00 178.15 179.31 2c1y h LEU 239 N 0.39 0.78 -1.67 1.44 5.85 -1.09 -0.33 115.31 120.67 2c1y h LEU 239 Ca 0.02 -0.02 0.43 0.00 0.84 0.00 0.00 57.88 59.15 2c1y h LEU 239 Cb 0.95 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.69 2c1y h LEU 239 CO 0.08 0.57 0.97 -0.08 -0.34 0.00 0.00 178.44 179.64 2c1y h GLU 240 N 0.92 0.08 0.00 1.25 4.57 -1.18 -0.71 114.58 119.51 2c1y h GLU 240 Ca 0.25 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.42 2c1y h GLU 240 Cb -0.10 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.47 2c1y h GLU 240 CO -0.05 0.05 0.00 0.28 -1.18 0.00 0.00 179.01 178.11 2c1y h VAL 241 N 0.08 0.00 0.00 0.32 2.07 -1.09 -3.07 116.25 114.56 2c1y h VAL 241 Ca 0.77 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.99 2c1y h VAL 241 Cb 2.68 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 33.67 2c1y h VAL 241 CO -0.22 0.00 -0.89 0.49 0.02 0.00 0.00 177.57 176.97 2c1y n PHE 242 N -2.90 0.09 -1.67 1.57 3.72 -0.27 -4.82 117.46 113.18 2c1y n PHE 242 Ca -0.00 0.03 -0.43 0.00 -0.05 0.00 0.00 57.45 56.99 2c1y n PHE 242 Cb 0.21 -0.23 -0.01 0.00 -0.94 0.00 0.00 39.48 38.51 2c1y n PHE 242 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2c1y n ARG 243 N -1.68 1.93 -4.52 -1.08 1.74 -1.16 -4.57 116.66 107.33 2c1y n ARG 243 Ca 0.03 0.68 -0.24 0.00 -0.77 0.00 0.00 57.85 57.55 2c1y n ARG 243 Cb 0.37 -2.22 -0.14 0.00 -1.02 0.00 0.00 32.46 29.45 2c1y n ARG 243 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2c1y s VAL 244 N -0.93 1.58 0.08 1.55 -7.23 -1.26 -4.83 120.40 109.36 2c1y s VAL 244 Ca 0.58 -1.24 -0.22 0.00 -1.81 0.00 0.00 61.98 59.29 2c1y s VAL 244 Cb -0.61 -1.40 -0.13 0.00 0.56 0.00 0.00 36.38 34.80 2c1y s VAL 244 CO 0.60 0.11 1.66 0.45 -0.31 0.00 0.00 175.10 177.61 2c1y h HIS 245 N 4.71 0.10 -3.29 2.82 3.86 -2.03 -3.42 115.15 117.90 2c1y h HIS 245 Ca -0.43 -0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.25 2c1y h HIS 245 Cb 1.17 -0.03 -0.35 0.00 1.06 0.00 0.00 27.41 29.26 2c1y h HIS 245 CO 0.53 0.16 -0.81 0.15 0.86 0.00 0.00 177.93 178.82 2c1y s LYS 246 N -5.79 1.75 -0.06 2.45 1.02 -1.26 -5.12 119.74 112.75 2c1y s LYS 246 Ca -0.14 -0.39 -0.30 0.00 0.02 0.00 0.00 55.97 55.17 2c1y s LYS 246 Cb 0.06 -1.59 -0.06 0.00 -0.52 0.00 0.00 37.83 35.72 2c1y s LYS 246 CO 0.68 -0.11 1.78 0.14 -0.92 0.00 0.00 175.35 176.92 2c1y s VAL 247 N 1.15 3.38 -0.17 3.17 -7.23 -1.26 -4.87 120.40 114.58 2c1y s VAL 247 Ca -0.05 0.46 0.02 0.00 -1.81 0.00 0.00 61.98 60.60 2c1y s VAL 247 Cb -0.14 -3.32 -0.01 0.00 0.56 0.00 0.00 36.38 33.46 2c1y s VAL 247 CO -0.02 -0.07 0.23 0.41 -0.31 0.00 0.00 175.10 175.33 2c1y n THR 248 N 5.76 0.00 -3.79 5.32 -1.04 -1.26 -4.94 114.28 114.34 2c1y n THR 248 Ca 0.19 -0.46 -0.35 0.00 -2.04 0.00 0.00 64.05 61.39 2c1y n THR 248 Cb 0.43 1.01 -0.08 0.00 -1.82 0.00 0.00 70.33 69.87 2c1y n THR 248 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2c1y s LYS 249 N -0.98 3.99 0.23 -2.82 1.02 -1.26 -5.06 119.74 114.85 2c1y s LYS 249 Ca 0.01 -0.21 0.05 0.00 0.02 0.00 0.00 55.97 55.84 2c1y s LYS 249 Cb 0.02 -3.35 -0.05 0.00 -0.52 0.00 0.00 37.83 33.93 2c1y s LYS 249 CO 0.08 0.42 -0.04 0.95 -0.92 0.00 0.00 175.35 175.84 2c1y s THR 250 N 0.02 1.25 -0.07 2.17 -4.23 -1.26 -5.03 115.64 108.49 2c1y s THR 250 Ca 0.09 -2.07 0.02 0.00 -1.18 0.00 0.00 61.69 58.56 2c1y s THR 250 Cb -0.11 -2.27 0.01 0.00 1.34 0.00 0.00 72.50 71.47 2c1y s THR 250 CO -0.00 -0.40 -0.13 0.00 -0.54 0.00 0.00 174.62 173.55 2c1y s ALA 251 N -3.28 1.30 0.20 3.99 0.00 -1.26 -5.17 121.76 117.55 2c1y s ALA 251 Ca 0.26 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2c1y s ALA 251 Cb 0.04 -0.58 0.00 0.00 0.00 0.00 0.00 23.12 22.58 2c1y s ALA 251 CO 0.08 0.12 0.00 -0.35 0.00 0.00 0.00 175.76 175.61 2c1y n PRO 252 N 3.80 -1.75 0.00 0.00 -0.06 -1.26 -5.27 135.00 130.46 2c1y n PRO 252 Ca -0.23 1.15 0.00 0.00 -0.06 0.00 0.00 63.50 64.36 2c1y n PRO 252 Cb 0.52 -2.13 0.00 0.00 -0.06 0.00 0.00 33.50 31.83 2c1y n PRO 252 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 175.50 175.83