#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2sta s VAL 17 N 0.00 4.44 0.00 1.39 1.01 0.38 -3.96 120.40 123.65 2sta s VAL 17 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.82 2sta s VAL 17 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2sta s VAL 17 CO 0.00 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.19 2sta n GLY 18 N 3.49 0.58 0.00 4.51 0.00 -1.25 -1.60 105.19 110.92 2sta n GLY 18 Ca -0.17 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2sta n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sta n GLY 19 N -2.79 2.63 3.22 -0.02 0.00 -1.26 -4.88 105.19 102.09 2sta n GLY 19 Ca 0.00 -1.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 2sta n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2sta s TYR 20 N 2.75 0.16 0.11 1.61 1.13 -0.37 -4.94 117.35 117.80 2sta s TYR 20 Ca 0.00 -0.58 -0.31 0.00 -1.41 0.00 0.00 57.07 54.77 2sta s TYR 20 Cb 0.00 -0.05 -0.08 0.00 -1.10 0.00 0.00 41.96 40.74 2sta s TYR 20 CO 0.00 -0.57 1.35 -2.00 -2.51 0.00 0.00 175.55 171.82 2sta s GLU 21 N -3.87 4.35 0.58 -3.49 2.12 -1.26 -0.36 118.70 116.76 2sta s GLU 21 Ca 0.06 2.02 -0.19 0.00 0.36 0.00 0.00 54.97 57.22 2sta s GLU 21 Cb 0.05 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.13 2sta s GLU 21 CO -0.10 -0.39 1.16 0.00 -0.54 0.00 0.00 175.26 175.38 2sta n LYS 23 N -1.56 2.60 -1.67 0.00 4.81 -1.26 -4.86 118.16 116.23 2sta n LYS 23 Ca 0.12 0.94 -0.46 0.00 -0.87 0.00 0.00 58.31 58.04 2sta n LYS 23 Cb 0.51 -2.76 -0.04 0.00 0.02 0.00 0.00 35.03 32.76 2sta n LYS 23 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2sta n PRO 24 N 3.70 2.09 -1.42 1.64 -0.02 -1.26 -1.65 135.00 138.09 2sta n PRO 24 Ca 0.16 0.75 -0.14 0.00 -2.02 0.00 0.00 63.50 62.25 2sta n PRO 24 Cb 0.33 -2.48 -0.06 0.00 -0.02 0.00 0.00 33.50 31.27 2sta n PRO 24 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2sta n TYR 25 N 2.84 0.00 0.34 6.00 4.01 -1.26 -4.86 117.16 124.22 2sta n TYR 25 Ca 0.15 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 58.03 2sta n TYR 25 Cb 0.30 -2.73 0.40 0.00 -0.31 0.00 0.00 39.34 37.00 2sta n TYR 25 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2sta h SER 26 N 0.00 0.00 -2.29 7.72 4.64 -1.69 -3.29 113.55 118.64 2sta h SER 26 Ca -0.29 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.40 2sta h SER 26 Cb 1.07 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.76 2sta h SER 26 CO 0.43 0.00 -0.40 0.00 -0.87 0.00 0.00 176.83 175.99 2sta n GLN 27 N -2.83 3.20 0.05 4.77 1.13 -1.26 -4.94 117.38 117.51 2sta n GLN 27 Ca 0.03 -4.75 0.08 0.00 -1.94 0.00 0.00 57.00 50.42 2sta n GLN 27 Cb 0.41 -2.28 0.36 0.00 0.11 0.00 0.00 30.24 28.84 2sta n GLN 27 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2sta n PRO 28 N 0.32 0.07 0.13 -1.09 -0.04 -1.24 -1.05 135.00 132.11 2sta n PRO 28 Ca 0.31 0.35 0.13 0.00 -0.04 0.00 0.00 63.50 64.25 2sta n PRO 28 Cb 0.38 -1.65 0.36 0.00 -0.04 0.00 0.00 33.50 32.56 2sta n PRO 28 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 2sta h HIS 29 N 0.00 0.00 -3.31 0.54 2.07 -1.73 -2.70 115.15 110.03 2sta h HIS 29 Ca 0.00 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 57.00 2sta h HIS 29 Cb 0.26 0.00 0.03 0.00 2.57 0.00 0.00 27.41 30.27 2sta h HIS 29 CO 0.00 0.00 0.66 -1.14 -3.07 0.00 0.00 177.93 174.38 2sta s GLN 30 N -3.14 4.38 0.24 5.12 2.00 -0.22 -1.12 119.66 126.93 2sta s GLN 30 Ca 0.09 2.04 0.07 0.00 -2.00 0.00 0.00 55.36 55.56 2sta s GLN 30 Cb 0.11 -3.21 -0.05 0.00 0.80 0.00 0.00 33.01 30.65 2sta s GLN 30 CO 0.60 -0.28 -0.10 0.14 -0.50 0.00 0.00 175.29 175.15 2sta s VAL 31 N 0.33 1.71 -0.13 1.34 -7.23 -0.54 -4.49 120.40 111.38 2sta s VAL 31 Ca 0.58 -2.17 -0.04 0.00 -1.81 0.00 0.00 61.98 58.54 2sta s VAL 31 Cb -0.36 -2.26 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 2sta s VAL 31 CO 0.36 -0.44 0.01 -0.55 -0.31 0.00 0.00 175.10 174.17 2sta s SER 32 N -3.38 5.22 -0.20 4.85 0.15 -0.20 -2.31 113.70 117.83 2sta s SER 32 Ca 0.26 0.05 -0.10 0.00 0.70 0.00 0.00 55.95 56.87 2sta s SER 32 Cb 0.01 -1.70 -0.05 0.00 -1.71 0.00 0.00 66.02 62.57 2sta s SER 32 CO 0.10 0.27 0.12 -0.76 1.20 0.00 0.00 173.24 174.17 2sta s LEU 33 N -0.20 4.17 -0.06 3.45 1.43 -0.21 -0.69 118.68 126.57 2sta s LEU 33 Ca 0.05 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.38 2sta s LEU 33 Cb -0.12 -2.08 0.02 0.00 0.03 0.00 0.00 46.19 44.04 2sta s LEU 33 CO 0.02 0.18 -0.08 0.21 0.23 0.00 0.00 176.35 176.91 2sta s ASN 34 N 0.37 1.48 -0.43 2.29 3.84 0.16 -2.04 114.94 120.61 2sta s ASN 34 Ca 0.08 -0.22 0.09 0.00 0.21 0.00 0.00 52.86 53.01 2sta s ASN 34 Cb -0.11 -0.66 0.29 0.00 -0.55 0.00 0.00 41.25 40.22 2sta s ASN 34 CO -0.02 -0.03 0.66 -1.20 -2.79 0.00 0.00 177.10 173.73 2sta n SER 37 N 4.08 1.22 0.00 -4.21 7.64 -1.26 -1.29 113.62 119.80 2sta n SER 37 Ca -0.22 -2.98 0.00 0.00 1.01 0.00 0.00 58.87 56.68 2sta n SER 37 Cb 0.51 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 2sta n SER 37 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2sta n GLY 38 N 0.80 3.06 3.53 0.23 0.00 -1.26 -4.97 105.19 106.59 2sta n GLY 38 Ca 0.24 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.19 2sta n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2sta s TYR 39 N -2.79 -0.29 0.19 1.61 -0.85 -1.26 -5.14 117.35 108.82 2sta s TYR 39 Ca 0.00 0.21 -0.31 0.00 -0.52 0.00 0.00 57.07 56.45 2sta s TYR 39 Cb 0.00 0.52 -0.11 0.00 0.38 0.00 0.00 41.96 42.76 2sta s TYR 39 CO 0.00 -0.43 1.59 -1.58 -1.52 0.00 0.00 175.55 173.61 2sta s HIS 40 N -2.75 3.00 0.00 -3.49 5.65 -1.26 -4.37 115.29 112.07 2sta s HIS 40 Ca 0.06 0.62 0.00 0.00 0.25 0.00 0.00 55.06 55.98 2sta s HIS 40 Cb -0.01 -3.97 0.00 0.00 -1.18 0.00 0.00 32.58 27.42 2sta s HIS 40 CO -0.07 -3.55 0.00 1.97 -0.65 0.00 0.00 174.74 172.44 2sta n PHE 41 N 3.67 0.00 -3.56 3.88 -1.74 -0.86 -5.00 117.46 113.84 2sta n PHE 41 Ca 0.13 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.91 2sta n PHE 41 Cb 0.38 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.35 2sta n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2sta n GLY 43 N -0.38 2.49 3.83 0.00 0.00 0.66 -1.04 105.19 110.74 2sta n GLY 43 Ca -0.14 -2.18 -0.01 0.00 0.00 0.00 0.00 46.02 43.69 2sta n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2sta s GLY 44 N -2.44 -0.11 -0.03 -0.02 0.00 -0.98 -3.89 107.32 99.85 2sta s GLY 44 Ca 0.12 0.04 0.02 0.00 0.00 0.00 0.00 44.72 44.89 2sta s GLY 44 CO 0.08 2.29 -0.06 -0.56 0.00 0.00 0.00 173.10 174.85 2sta s SER 45 N -3.34 1.00 -0.14 1.64 0.01 0.03 -1.46 113.70 111.44 2sta s SER 45 Ca 0.20 -0.15 -0.29 0.00 1.31 0.00 0.00 55.95 57.02 2sta s SER 45 Cb -0.00 -0.37 -0.02 0.00 0.21 0.00 0.00 66.02 65.84 2sta s SER 45 CO 0.02 0.00 1.24 -0.22 0.41 0.00 0.00 173.24 174.69 2sta s LEU 46 N 0.53 4.21 -0.00 2.44 2.96 -0.28 -0.53 118.68 128.00 2sta s LEU 46 Ca -0.07 1.72 0.12 0.00 -0.22 0.00 0.00 54.13 55.67 2sta s LEU 46 Cb -0.11 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 42.90 2sta s LEU 46 CO 0.00 -0.71 0.46 1.33 -1.32 0.00 0.00 176.35 176.12 2sta n VAL 47 N 5.16 0.00 -3.81 1.68 0.24 -0.68 -0.57 118.33 120.35 2sta n VAL 47 Ca 0.13 -0.23 -0.02 0.00 -2.04 0.00 0.00 64.34 62.17 2sta n VAL 47 Cb 0.45 0.91 0.02 0.00 -1.47 0.00 0.00 33.84 33.75 2sta n VAL 47 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2sta n ASN 48 N -1.35 -1.40 0.01 -1.34 0.23 -1.21 -4.60 115.26 105.61 2sta n ASN 48 Ca 0.02 -1.73 0.21 0.00 -0.53 0.00 0.00 54.58 52.55 2sta n ASN 48 Cb 0.20 2.27 0.72 0.00 -2.08 0.00 0.00 39.78 40.89 2sta n ASN 48 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2sta h GLU 49 N 0.00 0.00 -0.00 -3.83 3.07 -1.96 -3.06 114.58 108.79 2sta h GLU 49 Ca -0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 2sta h GLU 49 Cb 0.96 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 2sta h GLU 49 CO 0.29 0.00 -0.35 0.09 -1.40 0.00 0.00 179.01 177.65 2sta n ASN 50 N -4.12 0.55 -3.99 1.42 3.02 -1.26 -0.86 115.26 110.01 2sta n ASN 50 Ca 0.10 -0.77 -0.13 0.00 -0.03 0.00 0.00 54.58 53.74 2sta n ASN 50 Cb 0.65 0.89 -0.13 0.00 -0.61 0.00 0.00 39.78 40.58 2sta n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2sta s TRP 51 N -1.67 0.45 -0.05 3.10 0.52 -1.16 -0.81 118.94 119.32 2sta s TRP 51 Ca 0.04 -0.29 0.05 0.00 0.02 0.00 0.00 56.10 55.92 2sta s TRP 51 Cb 0.06 -0.28 -0.01 0.00 -1.15 0.00 0.00 33.47 32.10 2sta s TRP 51 CO 0.31 -0.06 -0.22 0.08 0.02 0.00 0.00 176.95 177.09 2sta s VAL 52 N -0.77 1.79 -0.11 4.03 1.01 0.04 -1.69 120.40 124.70 2sta s VAL 52 Ca -0.05 -0.92 -0.13 0.00 0.00 0.00 0.00 61.98 60.87 2sta s VAL 52 Cb -0.06 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 2sta s VAL 52 CO -0.00 0.50 0.31 -0.69 0.00 0.00 0.00 175.10 175.22 2sta s VAL 53 N -0.11 5.26 0.00 2.92 1.01 0.31 -0.35 120.40 129.44 2sta s VAL 53 Ca -0.03 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.55 2sta s VAL 53 Cb -0.13 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2sta s VAL 53 CO 0.03 0.47 0.00 -0.24 0.00 0.00 0.00 175.10 175.35 2sta n SER 54 N 2.92 0.00 -4.87 3.32 2.88 -0.60 -0.79 113.62 116.48 2sta n SER 54 Ca -0.13 -0.46 -0.35 0.00 -1.33 0.00 0.00 58.87 56.60 2sta n SER 54 Cb 0.52 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 2sta n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2sta s ALA 55 N -1.71 3.80 0.52 -1.46 0.00 -1.26 -1.12 121.76 120.52 2sta s ALA 55 Ca 0.00 -0.48 0.18 0.00 0.00 0.00 0.00 51.96 51.66 2sta s ALA 55 Cb 0.00 -2.16 1.33 0.00 0.00 0.00 0.00 23.12 22.29 2sta s ALA 55 CO 0.00 0.60 2.15 0.00 0.00 0.00 0.00 175.76 178.51 2sta h ALA 56 N 4.17 1.90 0.00 0.00 0.00 -1.67 -1.53 119.26 122.12 2sta h ALA 56 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2sta h ALA 56 Cb 1.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2sta h ALA 56 CO 0.64 0.02 0.00 -2.39 0.00 0.00 0.00 179.25 177.53 2sta n HIS 57 N -4.41 0.00 1.22 0.00 1.44 -1.26 -1.86 115.22 110.34 2sta n HIS 57 Ca -0.03 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.75 2sta n HIS 57 Cb 0.10 -0.41 0.26 0.00 0.12 0.00 0.00 29.99 30.06 2sta n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2sta n TYR 59 N 0.24 2.54 -3.91 0.00 9.36 -0.78 -5.02 117.16 119.59 2sta n TYR 59 Ca 0.12 0.25 -0.10 0.00 3.32 0.00 0.00 57.90 61.49 2sta n TYR 59 Cb 0.26 -2.57 -0.11 0.00 -0.63 0.00 0.00 39.34 36.29 2sta n TYR 59 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2sta s LYS 60 N 0.18 0.37 0.50 2.98 1.02 -1.26 -5.07 119.74 118.47 2sta s LYS 60 Ca 0.71 -0.41 0.27 0.00 0.02 0.00 0.00 55.97 56.55 2sta s LYS 60 Cb -0.57 0.15 1.32 0.00 -0.52 0.00 0.00 37.83 38.20 2sta s LYS 60 CO 0.43 -0.08 2.01 0.66 -0.92 0.00 0.00 175.35 177.45 2sta h SER 61 N 4.64 0.00 -3.64 2.83 4.64 -1.96 -3.41 113.55 116.65 2sta h SER 61 Ca -0.30 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.77 2sta h SER 61 Cb 1.20 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.99 2sta h SER 61 CO 0.41 0.15 -0.68 -0.60 -0.87 0.00 0.00 176.83 175.24 2sta s ARG 62 N -4.02 0.03 0.04 4.77 6.06 -1.26 -4.62 118.95 119.94 2sta s ARG 62 Ca -0.02 0.13 0.00 0.00 -2.50 0.00 0.00 55.73 53.34 2sta s ARG 62 Cb 0.12 -0.08 -0.03 0.00 0.06 0.00 0.00 34.95 35.02 2sta s ARG 62 CO 0.59 -0.07 -0.04 0.14 -2.50 0.00 0.00 175.30 173.42 2sta s VAL 63 N 0.46 0.25 -0.16 7.11 -7.23 -1.26 -4.98 120.40 114.60 2sta s VAL 63 Ca -0.04 -1.28 -0.10 0.00 -1.81 0.00 0.00 61.98 58.75 2sta s VAL 63 Cb -0.05 -0.79 -0.05 0.00 0.56 0.00 0.00 36.38 36.05 2sta s VAL 63 CO -0.02 -0.66 0.18 -0.70 -0.31 0.00 0.00 175.10 173.59 2sta s GLU 64 N -2.39 3.94 -0.19 4.82 2.12 -0.41 -1.62 118.70 124.96 2sta s GLU 64 Ca -0.06 -0.10 -0.08 0.00 0.36 0.00 0.00 54.97 55.09 2sta s GLU 64 Cb -0.03 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 2sta s GLU 64 CO -0.04 0.47 0.08 0.08 -0.54 0.00 0.00 175.26 175.31 2sta s VAL 65 N -0.17 4.90 -0.20 3.70 1.01 0.52 -0.67 120.40 129.49 2sta s VAL 65 Ca 0.13 0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.13 2sta s VAL 65 Cb -0.12 -3.22 0.03 0.00 0.00 0.00 0.00 36.38 33.07 2sta s VAL 65 CO 0.02 0.45 -0.18 -0.13 0.00 0.00 0.00 175.10 175.27 2sta s ARG 66 N 0.39 2.78 0.25 2.72 0.52 0.13 -0.83 118.95 124.92 2sta s ARG 66 Ca 0.04 -0.97 0.08 0.00 -0.52 0.00 0.00 55.73 54.36 2sta s ARG 66 Cb -0.12 -2.66 -0.04 0.00 0.52 0.00 0.00 34.95 32.65 2sta s ARG 66 CO -0.00 -0.31 0.11 -0.51 0.02 0.00 0.00 175.30 174.61 2sta s LEU 67 N 1.24 3.56 -1.23 2.53 1.02 -0.02 -1.03 118.68 124.76 2sta s LEU 67 Ca 0.01 -0.40 -0.00 0.00 0.02 0.00 0.00 54.13 53.76 2sta s LEU 67 Cb -0.15 -2.10 0.00 0.00 0.02 0.00 0.00 46.19 43.96 2sta s LEU 67 CO -0.11 -0.01 0.06 0.61 0.02 0.00 0.00 176.35 176.92 2sta n GLY 69 N -0.99 -0.22 3.81 -3.19 0.00 -1.26 -1.20 105.19 102.13 2sta n GLY 69 Ca -0.07 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 2sta n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2sta s GLU 70 N -4.81 4.20 0.08 1.61 0.41 -1.26 -3.67 118.70 115.25 2sta s GLU 70 Ca 0.03 0.73 -0.01 0.00 -0.41 0.00 0.00 54.97 55.31 2sta s GLU 70 Cb -0.01 -3.23 -0.00 0.00 -1.78 0.00 0.00 34.13 29.11 2sta s GLU 70 CO 0.04 0.63 -0.01 1.58 -0.49 0.00 0.00 175.26 177.01 2sta n HIS 71 N 1.69 0.00 -3.52 1.61 -0.00 -1.26 -4.75 115.22 108.99 2sta n HIS 71 Ca -0.10 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.21 2sta n HIS 71 Cb 0.51 -0.02 -0.10 0.00 -0.00 0.00 0.00 29.99 30.37 2sta n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2sta s ASN 72 N -5.86 6.07 0.23 0.26 3.84 -1.26 -1.85 114.94 116.37 2sta s ASN 72 Ca -0.01 -0.46 0.25 0.00 0.21 0.00 0.00 52.86 52.85 2sta s ASN 72 Cb 0.00 -2.14 0.90 0.00 -0.55 0.00 0.00 41.25 39.46 2sta s ASN 72 CO 0.02 -0.26 1.74 2.30 -2.79 0.00 0.00 177.10 178.11 2sta n ILE 73 N 5.12 0.70 0.52 -5.21 -5.35 -0.49 -2.96 119.36 111.70 2sta n ILE 73 Ca -0.12 -0.02 0.12 0.00 -0.27 0.00 0.00 62.75 62.46 2sta n ILE 73 Cb 0.49 -0.88 0.24 0.00 -1.74 0.00 0.00 39.64 37.76 2sta n ILE 73 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2sta n LYS 74 N -2.23 2.35 -4.76 6.28 4.76 -1.26 -4.89 118.16 118.41 2sta n LYS 74 Ca 0.04 -2.03 -0.26 0.00 -2.87 0.00 0.00 58.31 53.19 2sta n LYS 74 Cb 0.33 -1.49 -0.16 0.00 -1.84 0.00 0.00 35.03 31.87 2sta n LYS 74 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2sta s VAL 75 N -1.57 1.35 -0.21 -0.18 1.01 -1.15 -5.11 120.40 114.53 2sta s VAL 75 Ca 0.37 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 2sta s VAL 75 Cb 0.22 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.43 2sta s VAL 75 CO 0.30 0.39 1.01 -0.89 0.00 0.00 0.00 175.10 175.92 2sta s THR 76 N 0.20 4.72 -0.34 3.92 2.01 -1.26 -4.79 115.64 120.09 2sta s THR 76 Ca -0.07 1.97 0.13 0.00 0.31 0.00 0.00 61.69 64.03 2sta s THR 76 Cb -0.13 -4.29 -0.16 0.00 0.01 0.00 0.00 72.50 67.94 2sta s THR 76 CO 0.03 -0.13 0.42 -0.62 -0.69 0.00 0.00 174.62 173.63 2sta n GLU 77 N 6.04 1.83 0.00 4.92 1.02 -1.26 -4.99 120.64 128.20 2sta n GLU 77 Ca 0.11 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2sta n GLU 77 Cb 0.47 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 2sta n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2sta n GLY 78 N 1.50 0.52 0.42 0.62 0.00 -1.26 -4.92 105.19 102.06 2sta n GLY 78 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2sta n GLY 78 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2sta n SER 79 N 0.00 1.70 -4.85 1.61 3.41 -1.26 -5.01 113.62 109.21 2sta n SER 79 Ca 0.00 -1.31 -0.32 0.00 -0.26 0.00 0.00 58.87 56.98 2sta n SER 79 Cb 0.00 0.36 -0.05 0.00 -0.26 0.00 0.00 64.21 64.26 2sta n SER 79 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2sta s GLU 80 N -2.48 3.99 -0.08 4.33 8.01 -1.24 -4.42 118.70 126.81 2sta s GLU 80 Ca 0.21 0.79 -0.00 0.00 0.01 0.00 0.00 54.97 55.97 2sta s GLU 80 Cb 0.19 -2.30 0.02 0.00 -4.31 0.00 0.00 34.13 27.73 2sta s GLU 80 CO 0.55 -0.02 -0.04 -0.65 0.01 0.00 0.00 175.26 175.11 2sta s GLN 81 N -3.46 1.05 -0.24 1.61 -0.21 -0.34 -4.97 119.66 113.09 2sta s GLN 81 Ca 0.56 -0.10 -0.06 0.00 0.02 0.00 0.00 55.36 55.78 2sta s GLN 81 Cb -0.10 -1.18 -0.02 0.00 1.00 0.00 0.00 33.01 32.70 2sta s GLN 81 CO 0.23 -0.22 0.04 -0.06 -2.12 0.00 0.00 175.29 173.16 2sta s PHE 82 N 1.56 3.05 -0.04 0.91 0.40 -1.26 -0.84 117.98 121.77 2sta s PHE 82 Ca 0.00 -0.54 0.01 0.00 -0.60 0.00 0.00 56.93 55.79 2sta s PHE 82 Cb -0.13 -2.21 0.02 0.00 0.51 0.00 0.00 43.02 41.22 2sta s PHE 82 CO -0.04 -0.40 -0.03 0.42 0.70 0.00 0.00 175.22 175.87 2sta s ILE 83 N 1.57 0.42 0.48 0.64 1.01 -0.01 -4.97 121.20 120.35 2sta s ILE 83 Ca 0.06 -0.04 -0.21 0.00 0.00 0.00 0.00 60.65 60.46 2sta s ILE 83 Cb -0.15 -0.48 -0.08 0.00 0.01 0.00 0.00 42.46 41.76 2sta s ILE 83 CO 0.02 0.21 1.06 -0.94 0.00 0.00 0.00 174.94 175.29 2sta s SER 84 N 1.03 6.31 0.38 3.58 1.04 -1.26 -0.36 113.70 124.42 2sta s SER 84 Ca -0.09 2.02 -0.25 0.00 0.48 0.00 0.00 55.95 58.11 2sta s SER 84 Cb -0.14 -2.57 -0.09 0.00 0.10 0.00 0.00 66.02 63.32 2sta s SER 84 CO -0.01 -0.80 1.01 -0.94 0.98 0.00 0.00 173.24 173.48 2sta s SER 85 N -1.82 6.96 -0.19 7.02 1.04 -0.64 -0.59 113.70 125.48 2sta s SER 85 Ca 0.66 1.96 0.17 0.00 0.48 0.00 0.00 55.95 59.23 2sta s SER 85 Cb -0.20 -2.58 -0.25 0.00 0.10 0.00 0.00 66.02 63.09 2sta s SER 85 CO 0.24 -0.35 0.11 -1.54 0.98 0.00 0.00 173.24 172.68 2sta n SER 86 N 0.11 0.08 -3.90 7.02 3.41 0.56 -4.56 113.62 116.34 2sta n SER 86 Ca 0.04 0.03 -0.12 0.00 -0.26 0.00 0.00 58.87 58.56 2sta n SER 86 Cb 0.50 0.91 -0.13 0.00 -0.26 0.00 0.00 64.21 65.23 2sta n SER 86 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2sta s ARG 87 N -2.50 0.11 -0.13 4.33 0.52 -1.19 -4.99 118.95 115.10 2sta s ARG 87 Ca -0.10 -0.15 -0.00 0.00 -0.52 0.00 0.00 55.73 54.96 2sta s ARG 87 Cb 0.06 -0.02 0.03 0.00 0.52 0.00 0.00 34.95 35.54 2sta s ARG 87 CO 0.83 0.00 -0.08 0.08 0.02 0.00 0.00 175.30 176.15 2sta s VAL 88 N -0.33 1.12 -0.27 3.52 1.01 -1.26 -0.96 120.40 123.23 2sta s VAL 88 Ca -0.03 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.53 2sta s VAL 88 Cb -0.02 -1.17 0.07 0.00 0.00 0.00 0.00 36.38 35.26 2sta s VAL 88 CO -0.00 0.31 -0.03 -0.63 0.00 0.00 0.00 175.10 174.75 2sta s ILE 89 N 1.66 1.71 0.52 2.22 1.01 0.22 -4.99 121.20 123.55 2sta s ILE 89 Ca 0.04 -1.53 -0.19 0.00 0.00 0.00 0.00 60.65 58.97 2sta s ILE 89 Cb -0.13 -2.03 -0.07 0.00 0.01 0.00 0.00 42.46 40.23 2sta s ILE 89 CO -0.08 -0.25 1.04 -0.13 0.00 0.00 0.00 174.94 175.52 2sta s ARG 90 N 1.28 3.67 0.30 2.79 0.52 -1.26 -1.08 118.95 125.16 2sta s ARG 90 Ca -0.01 1.29 -0.30 0.00 -0.52 0.00 0.00 55.73 56.19 2sta s ARG 90 Cb -0.19 -2.08 -0.12 0.00 0.52 0.00 0.00 34.95 33.08 2sta s ARG 90 CO -0.08 -0.53 1.49 1.58 0.02 0.00 0.00 175.30 177.77 2sta n HIS 91 N -1.32 2.65 0.26 -0.53 -0.00 -0.77 -4.86 115.22 110.66 2sta n HIS 91 Ca 0.09 0.37 0.09 0.00 -0.00 0.00 0.00 57.72 58.27 2sta n HIS 91 Cb 0.53 -2.53 0.66 0.00 -0.00 0.00 0.00 29.99 28.65 2sta n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2sta h PRO 92 N 4.02 0.00 -0.64 1.57 0.13 -1.93 -1.51 132.00 133.65 2sta h PRO 92 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2sta h PRO 92 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2sta h PRO 92 CO 0.73 0.07 0.00 0.09 -0.23 0.00 0.00 178.00 178.67 2sta n ASN 93 N -4.23 4.91 -4.76 1.44 3.02 -1.26 -4.97 115.26 109.40 2sta n ASN 93 Ca -0.03 -2.67 -0.41 0.00 -0.03 0.00 0.00 54.58 51.44 2sta n ASN 93 Cb 0.15 -0.62 -0.01 0.00 -0.61 0.00 0.00 39.78 38.69 2sta n ASN 93 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2sta s TYR 94 N -2.30 2.69 -0.25 3.10 5.04 -0.57 -4.61 117.35 120.45 2sta s TYR 94 Ca 0.48 0.96 0.02 0.00 -2.44 0.00 0.00 57.07 56.09 2sta s TYR 94 Cb 0.34 -4.04 0.06 0.00 0.35 0.00 0.00 41.96 38.68 2sta s TYR 94 CO 0.17 -3.29 -0.08 0.45 -1.34 0.00 0.00 175.55 171.47 2sta s SER 95 N 0.20 4.14 0.47 4.32 0.15 -0.21 -4.96 113.70 117.79 2sta s SER 95 Ca 0.58 -1.29 0.22 0.00 0.70 0.00 0.00 55.95 56.16 2sta s SER 95 Cb -0.47 -1.35 1.15 0.00 -1.71 0.00 0.00 66.02 63.63 2sta s SER 95 CO 0.55 -0.22 1.97 0.77 1.20 0.00 0.00 173.24 177.51 2sta h SER 96 N 7.87 0.00 -0.34 5.45 4.64 -1.95 0.13 113.55 129.35 2sta h SER 96 Ca -0.18 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.16 2sta h SER 96 Cb 1.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 2sta h SER 96 CO 0.44 0.20 0.19 0.22 -0.87 0.00 0.00 176.83 177.01 2sta h TYR 97 N 0.00 0.35 0.00 4.77 3.20 -1.98 -3.30 116.97 120.01 2sta h TYR 97 Ca -0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2sta h TYR 97 Cb 0.47 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2sta h TYR 97 CO 0.00 0.20 -0.02 0.27 -1.64 0.00 0.00 178.16 176.97 2sta n ASN 98 N -4.91 1.68 -3.71 -2.11 2.04 -1.16 -5.00 115.26 102.09 2sta n ASN 98 Ca -0.00 -2.01 -0.24 0.00 -0.44 0.00 0.00 54.58 51.88 2sta n ASN 98 Cb 0.06 -0.07 0.05 0.00 -2.53 0.00 0.00 39.78 37.29 2sta n ASN 98 CO 0.00 0.00 0.00 -0.38 -0.44 0.00 0.00 177.26 176.44 2sta n ILE 99 N -0.55 -3.46 -3.47 1.53 2.08 0.40 -4.99 119.36 110.91 2sta n ILE 99 Ca 0.02 -0.20 -0.33 0.00 0.56 0.00 0.00 62.75 62.81 2sta n ILE 99 Cb 0.36 -3.69 -0.05 0.00 -0.75 0.00 0.00 39.64 35.51 2sta n ILE 99 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2sta s ASP 100 N -3.72 6.64 -1.24 4.38 2.15 -0.86 -4.21 116.67 119.80 2sta s ASP 100 Ca 0.39 0.88 -0.03 0.00 0.43 0.00 0.00 52.55 54.21 2sta s ASP 100 Cb -0.18 -2.21 -0.01 0.00 -0.30 0.00 0.00 42.92 40.22 2sta s ASP 100 CO 0.78 0.00 0.77 0.59 -0.17 0.00 0.00 175.17 177.14 2sta n ASN 101 N 0.16 -2.40 -3.76 -0.34 3.02 -1.26 -1.05 115.26 109.62 2sta n ASN 101 Ca -0.02 -0.81 -0.42 0.00 -0.03 0.00 0.00 54.58 53.30 2sta n ASN 101 Cb 0.52 -4.21 0.00 0.00 -0.61 0.00 0.00 39.78 35.48 2sta n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2sta n ASP 102 N -3.04 4.79 -3.90 6.41 2.03 -1.26 -4.20 116.55 117.38 2sta n ASP 102 Ca -0.25 -2.97 -0.11 0.00 0.52 0.00 0.00 54.79 51.99 2sta n ASP 102 Cb 0.66 -1.56 -0.10 0.00 -0.72 0.00 0.00 41.12 39.40 2sta n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2sta s ILE 103 N 1.67 0.09 0.00 5.18 2.07 -1.26 -3.55 121.20 125.40 2sta s ILE 103 Ca 0.45 -0.71 -0.17 0.00 -1.41 0.00 0.00 60.65 58.81 2sta s ILE 103 Cb 0.12 -0.37 0.03 0.00 0.13 0.00 0.00 42.46 42.37 2sta s ILE 103 CO -0.04 -0.39 0.37 -0.32 -1.91 0.00 0.00 174.94 172.64 2sta s MET 104 N -1.32 0.77 -0.01 3.50 -2.45 -0.28 -1.84 119.30 117.68 2sta s MET 104 Ca -0.14 -0.22 0.05 0.00 -1.25 0.00 0.00 55.69 54.12 2sta s MET 104 Cb -0.08 0.35 -0.03 0.00 1.25 0.00 0.00 34.83 36.32 2sta s MET 104 CO 0.01 -0.23 -0.14 -0.51 1.05 0.00 0.00 175.02 175.20 2sta s LEU 105 N -1.54 2.81 -0.10 4.11 1.43 -0.24 -1.55 118.68 123.59 2sta s LEU 105 Ca -0.11 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 2sta s LEU 105 Cb -0.03 -1.61 0.02 0.00 0.03 0.00 0.00 46.19 44.59 2sta s LEU 105 CO 0.03 0.30 -0.13 -0.63 0.23 0.00 0.00 176.35 176.15 2sta s ILE 106 N -0.86 1.31 -0.15 -0.59 1.01 0.53 -0.61 121.20 121.84 2sta s ILE 106 Ca 0.14 -0.52 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 2sta s ILE 106 Cb -0.11 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.09 2sta s ILE 106 CO 0.04 0.40 0.22 -0.75 0.00 0.00 0.00 174.94 174.85 2sta s LYS 107 N 1.10 4.04 0.24 2.79 2.20 -0.14 -0.78 119.74 129.19 2sta s LYS 107 Ca -0.05 -0.02 -0.28 0.00 -0.36 0.00 0.00 55.97 55.26 2sta s LYS 107 Cb -0.14 -3.36 -0.09 0.00 -1.51 0.00 0.00 37.83 32.73 2sta s LYS 107 CO -0.02 0.41 0.89 -0.51 -0.36 0.00 0.00 175.35 175.76 2sta s LEU 108 N -0.02 4.57 0.52 5.43 1.43 0.01 -0.32 118.68 130.30 2sta s LEU 108 Ca 0.14 1.84 0.30 0.00 -1.03 0.00 0.00 54.13 55.38 2sta s LEU 108 Cb -0.12 -3.61 1.36 0.00 0.03 0.00 0.00 46.19 43.85 2sta s LEU 108 CO 0.03 0.13 2.00 0.77 0.23 0.00 0.00 176.35 179.50 2sta h SER 109 N 3.98 0.00 -5.06 2.29 4.64 -1.09 -3.40 113.55 114.91 2sta h SER 109 Ca -0.46 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.72 2sta h SER 109 Cb 1.20 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.10 2sta h SER 109 CO 0.67 0.10 -0.62 -1.59 -0.87 0.00 0.00 176.83 174.52 2sta s LYS 110 N -3.85 0.46 0.53 4.77 -2.85 -1.26 -4.95 119.74 112.59 2sta s LYS 110 Ca -0.01 -0.74 -0.20 0.00 -1.00 0.00 0.00 55.97 54.02 2sta s LYS 110 Cb 0.11 0.17 -0.06 0.00 -2.06 0.00 0.00 37.83 35.99 2sta s LYS 110 CO 0.57 -0.10 1.17 -1.25 0.10 0.00 0.00 175.35 175.85 2sta s PRO 111 N -2.22 3.36 0.51 1.78 0.04 -1.26 -4.92 135.00 132.28 2sta s PRO 111 Ca -0.09 1.75 -0.20 0.00 0.04 0.00 0.00 61.00 62.50 2sta s PRO 111 Cb -0.04 -2.11 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 2sta s PRO 111 CO -0.03 -0.87 1.07 0.00 0.04 0.00 0.00 177.00 177.21 2sta s ALA 112 N -1.64 2.81 -0.30 8.56 0.00 -0.04 -5.01 121.76 126.14 2sta s ALA 112 Ca 0.71 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 53.18 2sta s ALA 112 Cb -0.28 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 2sta s ALA 112 CO 0.32 -0.49 0.57 0.99 0.00 0.00 0.00 175.76 177.15 2sta s THR 113 N -1.90 5.00 0.03 0.00 2.01 -1.26 -4.87 115.64 114.65 2sta s THR 113 Ca 0.69 0.76 -0.26 0.00 0.31 0.00 0.00 61.69 63.19 2sta s THR 113 Cb -0.19 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.33 2sta s THR 113 CO 0.23 -0.08 0.82 -0.76 -0.69 0.00 0.00 174.62 174.13 2sta s LEU 114 N 2.47 4.43 0.00 4.42 1.43 -1.26 -4.73 118.68 125.43 2sta s LEU 114 Ca 0.22 1.49 0.00 0.00 -1.03 0.00 0.00 54.13 54.82 2sta s LEU 114 Cb -0.15 -3.31 0.00 0.00 0.03 0.00 0.00 46.19 42.75 2sta s LEU 114 CO 0.11 -0.06 0.00 -0.46 0.23 0.00 0.00 176.35 176.18 2sta n ASN 115 N 3.11 0.00 0.27 2.29 0.23 -0.10 -4.96 115.26 116.09 2sta n ASN 115 Ca -0.00 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.16 2sta n ASN 115 Cb 0.50 0.00 0.74 0.00 -2.08 0.00 0.00 39.78 38.94 2sta n ASN 115 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 2sta h THR 116 N 0.00 0.68 0.00 5.53 1.35 -2.01 -2.96 112.91 115.50 2sta h THR 116 Ca 0.00 -0.35 -0.14 0.00 -0.55 0.00 0.00 66.41 65.37 2sta h THR 116 Cb 0.00 1.21 -0.03 0.00 -1.73 0.00 0.00 68.15 67.61 2sta h THR 116 CO 0.00 0.09 -1.79 -1.22 -0.25 0.00 0.00 175.52 172.34 2sta n TYR 117 N -3.88 0.42 -3.87 4.73 4.01 -1.26 -4.86 117.16 112.44 2sta n TYR 117 Ca -0.02 0.13 -0.28 0.00 -0.16 0.00 0.00 57.90 57.57 2sta n TYR 117 Cb 0.18 -0.85 -0.16 0.00 -0.31 0.00 0.00 39.34 38.19 2sta n TYR 117 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2sta s VAL 118 N -3.08 1.07 -0.02 -0.72 1.01 -1.12 -4.31 120.40 113.24 2sta s VAL 118 Ca -0.06 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 2sta s VAL 118 Cb 0.10 -1.32 0.00 0.00 0.00 0.00 0.00 36.38 35.17 2sta s VAL 118 CO 0.85 0.04 0.07 -1.10 0.00 0.00 0.00 175.10 174.96 2sta s GLN 119 N 1.63 0.20 0.67 2.72 -1.52 -1.02 -0.92 119.66 121.43 2sta s GLN 119 Ca -0.01 -0.10 -0.12 0.00 -1.95 0.00 0.00 55.36 53.18 2sta s GLN 119 Cb -0.16 0.08 0.00 0.00 -0.22 0.00 0.00 33.01 32.71 2sta s GLN 119 CO -0.07 -0.04 1.06 -1.25 -0.25 0.00 0.00 175.29 174.75 2sta s PRO 120 N -0.45 2.96 -0.04 2.91 0.04 -1.26 -2.16 135.00 137.00 2sta s PRO 120 Ca -0.05 1.07 -0.01 0.00 0.04 0.00 0.00 61.00 62.05 2sta s PRO 120 Cb -0.03 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2sta s PRO 120 CO 0.00 -1.09 0.06 0.54 0.04 0.00 0.00 177.00 176.55 2sta s VAL 121 N -2.83 4.65 0.32 -0.36 0.11 0.26 -4.83 120.40 117.73 2sta s VAL 121 Ca 0.60 -0.32 -0.29 0.00 -2.93 0.00 0.00 61.98 59.05 2sta s VAL 121 Cb -0.15 -3.06 -0.10 0.00 -1.53 0.00 0.00 36.38 31.54 2sta s VAL 121 CO 0.49 0.45 1.23 0.00 -3.33 0.00 0.00 175.10 173.95 2sta s ALA 122 N -1.08 3.44 0.65 1.54 0.00 -1.25 -4.55 121.76 120.51 2sta s ALA 122 Ca 0.19 1.13 -0.14 0.00 0.00 0.00 0.00 51.96 53.14 2sta s ALA 122 Cb -0.12 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 2sta s ALA 122 CO 0.09 -0.49 1.07 -0.51 0.00 0.00 0.00 175.76 175.93 2sta s LEU 123 N -1.74 3.33 0.26 0.00 1.43 -1.26 -0.55 118.68 120.15 2sta s LEU 123 Ca 0.48 1.81 -0.29 0.00 -1.03 0.00 0.00 54.13 55.10 2sta s LEU 123 Cb -0.37 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.23 2sta s LEU 123 CO 0.48 -1.44 1.13 -2.16 0.23 0.00 0.00 176.35 174.59 2sta s PRO 124 N -4.40 4.60 0.29 1.29 0.04 -1.26 -4.69 135.00 130.87 2sta s PRO 124 Ca 0.63 1.84 0.16 0.00 0.04 0.00 0.00 61.00 63.67 2sta s PRO 124 Cb -0.17 -3.19 0.09 0.00 0.04 0.00 0.00 34.50 31.27 2sta s PRO 124 CO 0.44 0.13 1.43 1.79 0.04 0.00 0.00 177.00 180.83 2sta h THR 125 N 3.24 0.71 -3.12 1.26 1.35 -1.96 -3.48 112.91 110.91 2sta h THR 125 Ca -0.46 -2.02 0.04 0.00 -0.55 0.00 0.00 66.41 63.41 2sta h THR 125 Cb 1.21 2.33 -0.05 0.00 -1.73 0.00 0.00 68.15 69.91 2sta h THR 125 CO 0.68 0.41 0.17 -0.94 -0.25 0.00 0.00 175.52 175.59 2sta s SER 127 N -6.37 -0.21 0.31 5.36 1.04 -1.26 -5.15 113.70 107.42 2sta s SER 127 Ca 0.04 -0.70 -0.29 0.00 0.48 0.00 0.00 55.95 55.48 2sta s SER 127 Cb 0.07 0.71 -0.10 0.00 0.10 0.00 0.00 66.02 66.81 2sta s SER 127 CO 0.74 -1.33 1.17 0.00 0.98 0.00 0.00 173.24 174.79 2sta s ALA 129 N -1.19 3.36 0.67 0.00 0.00 -1.26 -5.06 121.76 118.28 2sta s ALA 129 Ca 0.47 0.38 -0.11 0.00 0.00 0.00 0.00 51.96 52.70 2sta s ALA 129 Cb -0.34 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 2sta s ALA 129 CO 0.44 0.10 1.05 -1.25 0.00 0.00 0.00 175.76 176.10 2sta s PRO 130 N -0.33 3.14 0.42 0.00 0.04 -1.26 -4.97 135.00 132.05 2sta s PRO 130 Ca 0.40 0.92 -0.25 0.00 0.04 0.00 0.00 61.00 62.10 2sta s PRO 130 Cb -0.22 -2.02 -0.10 0.00 0.04 0.00 0.00 34.50 32.20 2sta s PRO 130 CO 0.26 -0.93 1.20 0.00 0.04 0.00 0.00 177.00 177.57 2sta n ALA 132 N -2.95 0.99 0.00 8.56 0.00 -1.26 -2.23 120.51 123.62 2sta n ALA 132 Ca 0.07 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2sta n ALA 132 Cb 0.54 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2sta n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2sta n GLY 133 N 0.91 2.12 3.75 0.00 0.00 0.48 -4.96 105.19 107.50 2sta n GLY 133 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2sta n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2sta s THR 134 N -2.44 2.42 -0.03 2.61 2.01 -0.95 -4.68 115.64 114.58 2sta s THR 134 Ca 0.00 0.37 -0.20 0.00 0.31 0.00 0.00 61.69 62.17 2sta s THR 134 Cb 0.00 -3.23 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 2sta s THR 134 CO 0.00 0.06 0.57 -0.32 -0.69 0.00 0.00 174.62 174.25 2sta s MET 135 N -0.73 4.30 0.29 4.92 1.75 -1.26 -1.29 119.30 127.28 2sta s MET 135 Ca 0.59 0.68 0.02 0.00 -1.25 0.00 0.00 55.69 55.73 2sta s MET 135 Cb -0.44 -3.36 -0.05 0.00 2.84 0.00 0.00 34.83 33.82 2sta s MET 135 CO 0.48 0.33 0.09 0.00 -0.65 0.00 0.00 175.02 175.27 2sta s THR 137 N -3.57 2.22 0.12 0.00 2.01 0.07 -0.85 115.64 115.64 2sta s THR 137 Ca 0.36 -1.02 0.10 0.00 0.31 0.00 0.00 61.69 61.45 2sta s THR 137 Cb 0.08 -1.81 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 2sta s THR 137 CO 0.15 0.57 -0.24 0.54 -0.69 0.00 0.00 174.62 174.95 2sta s VAL 138 N -0.35 2.45 0.08 3.82 0.11 -0.15 -1.26 120.40 125.10 2sta s VAL 138 Ca 0.02 -1.67 -0.08 0.00 -2.93 0.00 0.00 61.98 57.32 2sta s VAL 138 Cb -0.12 -2.10 -0.00 0.00 -1.53 0.00 0.00 36.38 32.63 2sta s VAL 138 CO 0.02 0.10 0.18 -0.94 -3.33 0.00 0.00 175.10 171.13 2sta s SER 139 N -2.07 0.13 0.00 3.54 1.04 -1.23 -1.48 113.70 113.62 2sta s SER 139 Ca 0.15 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2sta s SER 139 Cb -0.10 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.35 2sta s SER 139 CO 0.07 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.19 2sta n GLY 140 N 0.02 -0.21 1.24 7.32 0.00 -0.76 -4.47 105.19 108.33 2sta n GLY 140 Ca -0.15 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2sta n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2sta n TRP 141 N -0.49 1.35 -1.83 1.61 8.01 -1.26 -1.71 117.44 123.13 2sta n TRP 141 Ca 0.00 -1.22 -0.18 0.00 -1.31 0.00 0.00 57.50 54.79 2sta n TRP 141 Cb 0.00 -0.47 0.12 0.00 -2.01 0.00 0.00 31.31 28.95 2sta n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2sta n GLY 142 N -0.69 -0.81 3.62 6.99 0.00 -1.24 -4.72 105.19 108.33 2sta n GLY 142 Ca 0.31 -1.78 -0.49 0.00 0.00 0.00 0.00 46.02 44.06 2sta n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2sta n ASN 143 N -3.38 2.06 -0.00 1.61 3.02 -0.16 -2.99 115.26 115.42 2sta n ASN 143 Ca 0.11 1.12 0.09 0.00 -0.03 0.00 0.00 54.58 55.86 2sta n ASN 143 Cb 0.37 -1.29 -0.11 0.00 -0.61 0.00 0.00 39.78 38.15 2sta n ASN 143 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2sta n THR 144 N 2.33 0.00 -3.84 3.41 -2.24 -1.25 -0.82 114.28 111.86 2sta n THR 144 Ca 0.16 -0.13 -0.30 0.00 -2.27 0.00 0.00 64.05 61.51 2sta n THR 144 Cb 0.25 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 2sta n THR 144 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2sta n MET 145 N -1.52 -4.21 -3.72 -0.78 2.81 -1.26 -4.47 117.12 103.97 2sta n MET 145 Ca 0.02 0.50 -0.13 0.00 -1.81 0.00 0.00 57.70 56.29 2sta n MET 145 Cb 0.30 -5.30 -0.10 0.00 -0.71 0.00 0.00 33.22 27.41 2sta n MET 145 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2sta s SER 147 N -3.12 -0.47 0.32 7.83 0.15 -1.26 -5.01 113.70 112.15 2sta s SER 147 Ca 0.62 0.88 0.26 0.00 0.70 0.00 0.00 55.95 58.41 2sta s SER 147 Cb -0.32 0.86 0.94 0.00 -1.71 0.00 0.00 66.02 65.79 2sta s SER 147 CO 0.76 -0.16 1.77 0.28 1.20 0.00 0.00 173.24 177.09 2sta h SER 148 N 5.84 0.00 0.24 5.45 0.02 -2.06 -3.29 113.55 119.75 2sta h SER 148 Ca -0.29 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.32 2sta h SER 148 Cb 1.18 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.68 2sta h SER 148 CO 0.25 0.00 -1.98 0.41 -1.14 0.00 0.00 176.83 174.37 2sta n THR 149 N -2.50 1.65 -3.41 -2.27 -1.04 -1.26 -4.86 114.28 100.59 2sta n THR 149 Ca 0.03 -0.72 -0.38 0.00 -2.04 0.00 0.00 64.05 60.93 2sta n THR 149 Cb 0.33 -1.30 -0.08 0.00 -1.82 0.00 0.00 70.33 67.47 2sta n THR 149 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2sta s ALA 150 N -2.56 3.56 -0.33 2.41 0.00 -1.24 -5.04 121.76 118.56 2sta s ALA 150 Ca -0.15 -0.58 -0.22 0.00 0.00 0.00 0.00 51.96 51.01 2sta s ALA 150 Cb 0.07 -2.62 0.00 0.00 0.00 0.00 0.00 23.12 20.57 2sta s ALA 150 CO 0.78 -0.33 0.72 0.34 0.00 0.00 0.00 175.76 177.27 2sta s ASP 151 N 1.10 6.54 0.12 0.00 -1.08 -1.26 -4.72 116.67 117.37 2sta s ASP 151 Ca 0.18 0.41 0.18 0.00 -0.52 0.00 0.00 52.55 52.80 2sta s ASP 151 Cb -0.15 -2.37 0.77 0.00 -1.46 0.00 0.00 42.92 39.71 2sta s ASP 151 CO 0.08 -0.61 1.56 -1.54 0.52 0.00 0.00 175.17 175.18 2sta n SER 152 N 6.15 0.30 0.12 -0.34 3.41 -1.26 -2.19 113.62 119.80 2sta n SER 152 Ca 0.01 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.33 2sta n SER 152 Cb 0.48 -0.64 0.43 0.00 -0.26 0.00 0.00 64.21 64.23 2sta n SER 152 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2sta n ASN 153 N -1.83 0.80 -4.72 4.04 3.02 -1.26 -4.51 115.26 110.79 2sta n ASN 153 Ca 0.03 0.61 -0.35 0.00 -0.03 0.00 0.00 54.58 54.83 2sta n ASN 153 Cb 0.19 -0.81 -0.09 0.00 -0.61 0.00 0.00 39.78 38.46 2sta n ASN 153 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2sta s LYS 154 N -3.18 3.52 0.06 3.52 1.02 -0.93 -1.39 119.74 122.36 2sta s LYS 154 Ca 0.08 -0.30 -0.33 0.00 0.02 0.00 0.00 55.97 55.45 2sta s LYS 154 Cb 0.11 -3.08 -0.12 0.00 -0.52 0.00 0.00 37.83 34.23 2sta s LYS 154 CO 0.54 0.55 1.80 -0.11 -0.92 0.00 0.00 175.35 177.21 2sta n LEU 155 N 2.65 3.67 -4.90 3.17 7.94 -0.77 -4.87 117.00 123.88 2sta n LEU 155 Ca -0.18 1.00 -0.32 0.00 -1.11 0.00 0.00 56.01 55.39 2sta n LEU 155 Cb 0.53 -1.47 -0.05 0.00 0.53 0.00 0.00 43.42 42.97 2sta n LEU 155 CO 0.32 0.01 -0.03 -1.10 -1.11 0.00 0.00 177.39 175.47 2sta s GLN 156 N 2.84 3.57 0.08 1.96 -1.52 -0.69 -0.58 119.66 125.32 2sta s GLN 156 Ca 0.85 -0.16 0.07 0.00 -1.95 0.00 0.00 55.36 54.17 2sta s GLN 156 Cb -0.58 -2.96 -0.03 0.00 -0.22 0.00 0.00 33.01 29.22 2sta s GLN 156 CO 0.42 0.55 -0.18 0.00 -0.25 0.00 0.00 175.29 175.83 2sta s LEU 158 N -1.64 -0.06 -0.21 0.00 2.96 -0.55 -1.23 118.68 117.95 2sta s LEU 158 Ca 0.04 0.95 -0.14 0.00 -0.22 0.00 0.00 54.13 54.76 2sta s LEU 158 Cb -0.09 1.49 -0.04 0.00 0.50 0.00 0.00 46.19 48.05 2sta s LEU 158 CO 0.03 -0.19 0.32 0.20 -1.32 0.00 0.00 176.35 175.40 2sta s ASN 159 N 1.09 6.35 -0.00 3.68 0.01 -1.26 -0.98 114.94 123.84 2sta s ASN 159 Ca -0.07 0.41 0.02 0.00 -0.71 0.00 0.00 52.86 52.50 2sta s ASN 159 Cb -0.07 -2.19 -0.00 0.00 0.41 0.00 0.00 41.25 39.40 2sta s ASN 159 CO -0.10 -0.02 -0.05 0.27 -1.51 0.00 0.00 177.10 175.69 2sta s ILE 160 N 1.16 0.39 0.22 0.60 -4.36 -0.03 -4.96 121.20 114.23 2sta s ILE 160 Ca 0.16 -0.21 -0.14 0.00 -0.26 0.00 0.00 60.65 60.20 2sta s ILE 160 Cb -0.14 -0.34 -0.08 0.00 1.25 0.00 0.00 42.46 43.15 2sta s ILE 160 CO 0.07 0.11 0.63 -2.16 0.24 0.00 0.00 174.94 173.82 2sta s PRO 161 N -0.09 4.00 0.14 0.37 0.04 -1.26 -0.37 135.00 137.82 2sta s PRO 161 Ca 0.02 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 61.31 2sta s PRO 161 Cb -0.02 -2.74 -0.07 0.00 0.04 0.00 0.00 34.50 31.71 2sta s PRO 161 CO -0.00 0.35 1.19 0.42 0.04 0.00 0.00 177.00 178.99 2sta s ILE 162 N -1.68 3.77 0.37 0.56 1.01 -0.41 -1.50 121.20 123.31 2sta s ILE 162 Ca 0.45 1.41 -0.04 0.00 0.00 0.00 0.00 60.65 62.46 2sta s ILE 162 Cb -0.13 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 2sta s ILE 162 CO 0.20 0.19 0.64 -0.76 0.00 0.00 0.00 174.94 175.21 2sta s LEU 163 N 0.20 3.90 0.74 2.97 1.43 0.02 -0.38 118.68 127.55 2sta s LEU 163 Ca 0.54 0.76 -0.13 0.00 -1.03 0.00 0.00 54.13 54.28 2sta s LEU 163 Cb -0.31 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.32 2sta s LEU 163 CO 0.34 -0.35 1.12 -0.94 0.23 0.00 0.00 176.35 176.75 2sta s SER 164 N -3.65 4.47 0.38 2.29 1.04 -1.26 -4.60 113.70 112.37 2sta s SER 164 Ca 0.45 2.01 0.05 0.00 0.48 0.00 0.00 55.95 58.94 2sta s SER 164 Cb -0.10 -2.55 0.76 0.00 0.10 0.00 0.00 66.02 64.23 2sta s SER 164 CO 0.36 -2.06 2.03 0.22 0.98 0.00 0.00 173.24 174.77 2sta h TYR 165 N -0.69 0.65 -0.44 5.02 3.20 -1.98 -1.81 116.97 120.92 2sta h TYR 165 Ca -0.45 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.45 2sta h TYR 165 Cb 1.25 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 39.27 2sta h TYR 165 CO 0.54 0.40 0.27 0.66 -1.64 0.00 0.00 178.16 178.40 2sta h SER 166 N 0.70 0.46 -0.52 -2.11 4.64 -1.99 0.16 113.55 114.89 2sta h SER 166 Ca 0.20 -0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.44 2sta h SER 166 Cb -0.05 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 2sta h SER 166 CO -0.04 0.33 0.03 0.44 -0.87 0.00 0.00 176.83 176.72 2sta h ASP 167 N 0.56 0.87 -0.19 4.97 3.32 -1.87 0.10 116.42 124.17 2sta h ASP 167 Ca 0.17 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 2sta h ASP 167 Cb -0.02 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 2sta h ASP 167 CO -0.06 0.94 0.03 0.00 -1.72 0.00 0.00 179.24 178.43 2sta h ASN 169 N 0.10 0.23 -0.72 0.00 -0.73 -0.61 -2.00 115.58 111.86 2sta h ASN 169 Ca 0.06 -0.14 -0.04 0.00 1.87 0.00 0.00 56.30 58.04 2sta h ASN 169 Cb 0.31 -0.07 -0.03 0.00 0.27 0.00 0.00 38.32 38.80 2sta h ASN 169 CO 0.00 0.81 0.29 -1.13 -0.37 0.00 0.00 177.43 177.04 2sta h ASN 170 N 0.14 1.01 0.27 1.15 -0.73 -0.63 -2.05 115.58 114.73 2sta h ASN 170 Ca -0.01 -0.15 -0.12 0.00 1.87 0.00 0.00 56.30 57.89 2sta h ASN 170 Cb 1.16 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 39.48 2sta h ASN 170 CO 0.10 0.90 -0.48 0.28 -0.37 0.00 0.00 177.43 177.85 2sta h SER 171 N 1.07 0.27 -2.42 1.15 0.02 -0.88 -3.37 113.55 109.40 2sta h SER 171 Ca 0.25 -0.13 -0.59 0.00 -0.84 0.00 0.00 61.79 60.48 2sta h SER 171 Cb 0.21 -0.08 -0.40 0.00 0.14 0.00 0.00 62.40 62.27 2sta h SER 171 CO -0.02 0.71 -0.87 -1.22 -1.14 0.00 0.00 176.83 174.30 2sta n TYR 172 N -3.97 0.76 -1.68 3.45 4.01 -0.79 -4.93 117.16 114.02 2sta n TYR 172 Ca -0.02 -3.71 -0.50 0.00 -0.16 0.00 0.00 57.90 53.51 2sta n TYR 172 Cb 0.53 -0.19 -0.05 0.00 -0.31 0.00 0.00 39.34 39.32 2sta n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2sta n PRO 173 N 2.03 1.92 -1.37 -0.72 -0.02 -0.81 -1.41 135.00 134.64 2sta n PRO 173 Ca 0.26 0.70 -0.13 0.00 -2.02 0.00 0.00 63.50 62.31 2sta n PRO 173 Cb 0.45 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.34 2sta n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2sta n GLY 174 N 4.49 1.33 0.36 -1.23 0.00 -1.26 -4.87 105.19 104.01 2sta n GLY 174 Ca 0.24 -0.31 0.07 0.00 0.00 0.00 0.00 46.02 46.02 2sta n GLY 174 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2sta n MET 175 N -2.31 1.67 -3.60 1.61 2.81 -0.50 -4.96 117.12 111.84 2sta n MET 175 Ca -0.13 -0.85 -0.38 0.00 -1.81 0.00 0.00 57.70 54.54 2sta n MET 175 Cb 0.45 -1.20 -0.11 0.00 -0.71 0.00 0.00 33.22 31.65 2sta n MET 175 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2sta s ILE 176 N -1.55 5.21 0.38 2.02 -1.09 -1.26 -5.07 121.20 119.85 2sta s ILE 176 Ca 0.12 0.12 0.06 0.00 -2.23 0.00 0.00 60.65 58.72 2sta s ILE 176 Cb 0.11 -3.49 0.06 0.00 -1.58 0.00 0.00 42.46 37.57 2sta s ILE 176 CO 0.30 0.25 0.53 0.35 -1.23 0.00 0.00 174.94 175.14 2sta n THR 177 N 5.05 0.00 0.42 2.92 -2.24 -1.26 -4.99 114.28 114.18 2sta n THR 177 Ca -0.14 -1.26 0.13 0.00 -2.27 0.00 0.00 64.05 60.51 2sta n THR 177 Cb 0.52 -0.69 0.48 0.00 -2.10 0.00 0.00 70.33 68.54 2sta n THR 177 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 2sta h ASN 178 N 0.05 0.00 -0.37 3.42 -0.00 -2.03 -2.70 115.58 113.95 2sta h ASN 178 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.12 2sta h ASN 178 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.14 2sta h ASN 178 CO 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 177.43 177.68 2sta n ALA 179 N -1.85 2.65 -2.77 1.57 0.00 -1.26 -4.86 120.51 113.98 2sta n ALA 179 Ca 0.03 -0.77 -0.16 0.00 0.00 0.00 0.00 53.44 52.54 2sta n ALA 179 Cb 0.31 -0.99 -0.12 0.00 0.00 0.00 0.00 19.45 18.65 2sta n ALA 179 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2sta s MET 180 N -1.59 0.68 0.06 0.00 -1.94 -1.02 -0.83 119.30 114.66 2sta s MET 180 Ca 0.27 -0.82 -0.04 0.00 -1.71 0.00 0.00 55.69 53.39 2sta s MET 180 Cb 0.16 -0.58 -0.02 0.00 2.01 0.00 0.00 34.83 36.40 2sta s MET 180 CO 0.15 0.12 0.06 -0.59 -0.01 0.00 0.00 175.02 174.76 2sta s PHE 181 N -1.24 0.33 -0.04 -0.03 -0.71 -0.17 -4.76 117.98 111.35 2sta s PHE 181 Ca -0.05 -0.78 -0.04 0.00 -1.04 0.00 0.00 56.93 55.03 2sta s PHE 181 Cb -0.10 -0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.45 2sta s PHE 181 CO 0.01 -0.42 0.15 0.00 -1.34 0.00 0.00 175.22 173.62 2sta s ALA 183 N -1.20 -0.45 0.00 0.00 0.00 -0.83 -0.80 121.76 118.47 2sta s ALA 183 Ca 0.22 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.49 2sta s ALA 183 Cb -0.12 -0.15 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2sta s ALA 183 CO 0.13 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.16 2sta n GLY 184 N 2.33 0.63 2.77 0.00 0.00 -0.56 -2.73 105.19 107.63 2sta n GLY 184 Ca -0.17 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 43.89 2sta n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2sta s TYR 184 N -2.94 0.70 0.09 1.61 2.02 -1.26 -4.34 117.35 113.23 2sta s TYR 184 Ca 0.00 -0.22 0.32 0.00 -0.37 0.00 0.00 57.07 56.80 2sta s TYR 184 Cb 0.00 -0.82 1.59 0.00 -0.40 0.00 0.00 41.96 42.33 2sta s TYR 184 CO 0.00 -0.35 1.96 -0.07 -1.57 0.00 0.00 175.55 175.52 2sta h LEU 185 N 8.32 0.00 -0.22 -1.29 3.38 -1.96 -1.44 115.31 122.10 2sta h LEU 185 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2sta h LEU 185 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2sta h LEU 185 CO 0.27 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.47 2sta h GLU 186 N 0.00 0.00 0.00 1.13 3.07 -1.95 0.37 114.58 117.20 2sta h GLU 186 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2sta h GLU 186 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 2sta h GLU 186 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 2sta n GLY 187 N 0.96 -1.90 2.58 -3.84 0.00 -0.54 -4.07 105.19 98.38 2sta n GLY 187 Ca 0.04 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.34 2sta n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sta n GLY 188 N 0.00 2.54 2.94 -0.02 0.00 0.20 -4.88 105.19 105.97 2sta n GLY 188 Ca 0.00 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 2sta n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sta s LYS 188 N 0.00 1.59 0.07 1.61 1.02 -1.26 -3.92 119.74 118.84 2sta s LYS 188 Ca 0.00 -0.30 -0.27 0.00 0.02 0.00 0.00 55.97 55.41 2sta s LYS 188 Cb 0.00 -1.55 0.09 0.00 -0.52 0.00 0.00 37.83 35.85 2sta s LYS 188 CO 0.00 -0.19 1.05 0.34 -0.92 0.00 0.00 175.35 175.63 2sta s ASP 189 N 1.42 -0.16 0.81 2.83 2.15 -0.63 -4.41 116.67 118.68 2sta s ASP 189 Ca -0.00 -0.26 -0.08 0.00 0.43 0.00 0.00 52.55 52.64 2sta s ASP 189 Cb -0.13 0.37 0.14 0.00 -0.30 0.00 0.00 42.92 43.00 2sta s ASP 189 CO -0.05 -0.67 1.12 -0.94 -0.17 0.00 0.00 175.17 174.45 2sta s SER 190 N -2.86 3.99 0.31 -0.34 1.04 -1.26 -0.47 113.70 114.10 2sta s SER 190 Ca 0.12 0.05 -0.18 0.00 0.48 0.00 0.00 55.95 56.41 2sta s SER 190 Cb 0.00 -0.36 0.07 0.00 0.10 0.00 0.00 66.02 65.83 2sta s SER 190 CO -0.01 -2.13 0.90 0.00 0.98 0.00 0.00 173.24 172.98 2sta n GLN 192 N -0.62 2.26 0.00 0.00 3.00 -1.26 -1.29 117.38 119.47 2sta n GLN 192 Ca -0.06 0.82 0.00 0.00 -0.01 0.00 0.00 57.00 57.75 2sta n GLN 192 Cb 0.60 -2.62 0.00 0.00 0.00 0.00 0.00 30.24 28.22 2sta n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2sta n GLY 193 N 3.66 0.84 0.02 1.08 0.00 -1.26 -0.99 105.19 108.54 2sta n GLY 193 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2sta n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2sta n ASP 194 N 0.00 0.62 -4.52 1.61 8.00 -0.41 -3.65 116.55 118.19 2sta n ASP 194 Ca 0.00 -0.38 -0.48 0.00 0.71 0.00 0.00 54.79 54.64 2sta n ASP 194 Cb 0.00 0.98 -0.03 0.00 -0.02 0.00 0.00 41.12 42.05 2sta n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2sta n SER 195 N -1.86 0.39 0.00 -2.24 7.64 -1.26 -1.85 113.62 114.43 2sta n SER 195 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2sta n SER 195 Cb 0.42 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 2sta n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2sta n GLY 196 N 1.68 3.22 3.76 0.23 0.00 -0.20 -0.24 105.19 113.64 2sta n GLY 196 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 2sta n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2sta s GLY 197 N -2.02 1.59 0.32 -0.02 0.00 -0.77 -3.48 107.32 102.94 2sta s GLY 197 Ca 0.00 -0.63 -0.26 0.00 0.00 0.00 0.00 44.72 43.83 2sta s GLY 197 CO 0.00 0.00 0.95 2.56 0.00 0.00 0.00 173.10 176.61 2sta s PRO 198 N -5.32 4.60 -0.25 2.90 0.04 -1.26 -1.42 135.00 134.29 2sta s PRO 198 Ca 0.66 1.35 0.02 0.00 0.04 0.00 0.00 61.00 63.07 2sta s PRO 198 Cb -0.14 -2.84 0.05 0.00 0.04 0.00 0.00 34.50 31.62 2sta s PRO 198 CO 0.54 0.29 -0.10 0.08 0.04 0.00 0.00 177.00 177.85 2sta s VAL 199 N -1.58 2.32 -0.15 -0.36 1.01 -0.23 -3.58 120.40 117.83 2sta s VAL 199 Ca 0.49 -1.47 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 2sta s VAL 199 Cb -0.19 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2sta s VAL 199 CO 0.25 0.05 -0.03 -0.69 0.00 0.00 0.00 175.10 174.67 2sta s VAL 200 N 1.16 3.96 -0.09 2.92 1.01 -0.39 -0.99 120.40 127.98 2sta s VAL 200 Ca -0.06 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 2sta s VAL 200 Cb -0.19 -2.73 0.03 0.00 0.00 0.00 0.00 36.38 33.48 2sta s VAL 200 CO -0.05 0.50 -0.03 0.00 0.00 0.00 0.00 175.10 175.51 2sta n ASN 202 N 5.06 -3.51 0.00 0.00 3.02 -1.26 -1.67 115.26 116.90 2sta n ASN 202 Ca -0.09 -0.89 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 2sta n ASN 202 Cb 0.50 -3.43 0.00 0.00 -0.61 0.00 0.00 39.78 36.24 2sta n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2sta n GLY 203 N -1.62 0.62 3.16 7.41 0.00 -1.26 -5.04 105.19 108.46 2sta n GLY 203 Ca -0.01 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 2sta n GLY 203 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2sta s GLU 204 N -0.27 1.15 -0.55 1.61 2.02 -0.67 -3.97 118.70 118.02 2sta s GLU 204 Ca 0.00 -0.72 -0.28 0.00 0.02 0.00 0.00 54.97 53.99 2sta s GLU 204 Cb 0.00 -1.17 0.01 0.00 0.10 0.00 0.00 34.13 33.07 2sta s GLU 204 CO 0.00 0.30 1.48 -1.17 0.02 0.00 0.00 175.26 175.89 2sta s LEU 209 N -0.86 3.40 -0.06 1.80 2.96 0.29 -1.33 118.68 124.88 2sta s LEU 209 Ca 0.05 0.37 0.20 0.00 -0.22 0.00 0.00 54.13 54.52 2sta s LEU 209 Cb -0.07 -3.05 -0.26 0.00 0.50 0.00 0.00 46.19 43.31 2sta s LEU 209 CO 0.01 -1.76 0.43 0.00 -1.32 0.00 0.00 176.35 173.70 2sta n GLN 210 N 8.68 0.66 -3.94 1.98 1.13 -0.16 -4.00 117.38 121.73 2sta n GLN 210 Ca 0.14 -0.05 -0.09 0.00 -1.94 0.00 0.00 57.00 55.06 2sta n GLN 210 Cb 0.49 -1.58 -0.08 0.00 0.11 0.00 0.00 30.24 29.18 2sta n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2sta s GLY 211 N -4.88 0.32 -0.08 1.08 0.00 -0.89 -1.97 107.32 100.91 2sta s GLY 211 Ca -0.07 -0.84 0.03 0.00 0.00 0.00 0.00 44.72 43.84 2sta s GLY 211 CO 0.86 -0.92 -0.16 0.14 0.00 0.00 0.00 173.10 173.02 2sta s VAL 212 N -3.91 1.45 0.20 1.40 1.01 -0.99 -1.07 120.40 118.48 2sta s VAL 212 Ca 0.10 -0.66 -0.32 0.00 0.00 0.00 0.00 61.98 61.10 2sta s VAL 212 Cb 0.05 -1.29 -0.13 0.00 0.00 0.00 0.00 36.38 35.02 2sta s VAL 212 CO -0.07 0.42 1.67 0.52 0.00 0.00 0.00 175.10 177.65 2sta n VAL 213 N 3.71 0.08 0.00 2.92 0.31 -0.51 -1.08 118.33 123.76 2sta n VAL 213 Ca -0.22 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2sta n VAL 213 Cb 0.52 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 2sta n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2sta n SER 214 N 3.67 0.00 -3.89 4.52 2.88 -1.06 -1.03 113.62 118.71 2sta n SER 214 Ca 0.16 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.60 2sta n SER 214 Cb 0.33 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.74 2sta n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2sta s TRP 215 N -0.91 0.48 0.11 0.66 1.48 -0.87 -4.89 118.94 115.00 2sta s TRP 215 Ca 0.00 -0.83 -0.24 0.00 -1.06 0.00 0.00 56.10 53.97 2sta s TRP 215 Cb 0.00 0.14 0.08 0.00 -1.16 0.00 0.00 33.47 32.53 2sta s TRP 215 CO 0.00 -1.01 1.13 0.20 -4.06 0.00 0.00 176.95 173.21 2sta s GLY 216 N -3.05 0.02 -0.32 3.67 0.00 -1.26 -0.56 107.32 105.81 2sta s GLY 216 Ca 0.24 -0.19 -0.10 0.00 0.00 0.00 0.00 44.72 44.67 2sta s GLY 216 CO 0.11 3.51 0.16 -0.19 0.00 0.00 0.00 173.10 176.68 2sta s TYR 217 N -2.12 3.19 0.00 1.90 1.51 -1.26 -4.99 117.35 115.57 2sta s TYR 217 Ca 0.24 -0.61 0.00 0.00 -1.01 0.00 0.00 57.07 55.69 2sta s TYR 217 Cb -0.02 -2.37 0.00 0.00 -0.11 0.00 0.00 41.96 39.46 2sta s TYR 217 CO 0.03 -0.48 0.00 0.41 -1.11 0.00 0.00 175.55 174.40 2sta n GLY 219 N 4.99 0.60 3.06 0.71 0.00 -1.26 -4.68 105.19 108.62 2sta n GLY 219 Ca -0.14 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 2sta n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2sta n ALA 221 N 3.43 -0.39 -1.76 0.00 0.00 -1.26 -4.92 120.51 115.61 2sta n ALA 221 Ca -0.17 0.26 -0.39 0.00 0.00 0.00 0.00 53.44 53.13 2sta n ALA 221 Cb 0.56 -1.88 -0.04 0.00 0.00 0.00 0.00 19.45 18.09 2sta n ALA 221 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2sta s GLU 221 N -3.96 4.58 0.21 0.00 2.02 -1.26 -0.63 118.70 119.65 2sta s GLU 221 Ca 0.00 1.70 -0.32 0.00 0.02 0.00 0.00 54.97 56.37 2sta s GLU 221 Cb 0.00 -3.07 -0.13 0.00 0.10 0.00 0.00 34.13 31.02 2sta s GLU 221 CO 0.00 0.18 1.52 -2.30 0.02 0.00 0.00 175.26 174.68 2sta n PRO 222 N 0.98 2.20 -0.97 0.39 -0.02 -1.26 -2.21 135.00 134.11 2sta n PRO 222 Ca -0.00 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2sta n PRO 222 Cb 0.46 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2sta n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2sta n GLY 223 N 2.78 0.56 2.36 -1.23 0.00 0.13 -4.93 105.19 104.85 2sta n GLY 223 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 2sta n GLY 223 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2sta n ASN 224 N -0.11 2.34 -4.68 1.61 5.03 -0.94 -4.69 115.26 113.82 2sta n ASN 224 Ca 0.00 -3.16 -0.29 0.00 0.87 0.00 0.00 54.58 52.00 2sta n ASN 224 Cb 0.06 -0.65 0.16 0.00 -1.02 0.00 0.00 39.78 38.33 2sta n ASN 224 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2sta s PRO 225 N -2.06 0.76 0.43 3.52 0.04 -1.26 -4.46 135.00 131.98 2sta s PRO 225 Ca 0.39 0.74 -0.23 0.00 0.04 0.00 0.00 61.00 61.93 2sta s PRO 225 Cb 0.17 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.87 2sta s PRO 225 CO -0.06 -2.56 1.09 0.20 0.04 0.00 0.00 177.00 175.71 2sta s GLY 226 N -3.33 2.72 -0.10 0.56 0.00 -1.10 -4.71 107.32 101.36 2sta s GLY 226 Ca 0.65 0.77 -0.01 0.00 0.00 0.00 0.00 44.72 46.13 2sta s GLY 226 CO 0.58 1.20 -0.04 0.14 0.00 0.00 0.00 173.10 174.98 2sta s VAL 227 N -1.66 3.94 0.03 1.40 1.01 0.27 -1.97 120.40 123.43 2sta s VAL 227 Ca 0.61 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 62.28 2sta s VAL 227 Cb -0.24 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 2sta s VAL 227 CO 0.29 0.57 -0.17 -0.31 0.00 0.00 0.00 175.10 175.48 2sta s TYR 228 N -0.50 1.49 0.20 5.22 2.02 0.26 -2.05 117.35 123.99 2sta s TYR 228 Ca 0.08 -0.35 -0.30 0.00 -0.37 0.00 0.00 57.07 56.13 2sta s TYR 228 Cb -0.12 -0.90 -0.08 0.00 -0.40 0.00 0.00 41.96 40.46 2sta s TYR 228 CO 0.02 0.05 1.25 0.00 -1.57 0.00 0.00 175.55 175.30 2sta s ALA 229 N -0.75 3.48 -0.73 3.71 0.00 -0.24 -1.00 121.76 126.22 2sta s ALA 229 Ca 0.05 1.03 -0.22 0.00 0.00 0.00 0.00 51.96 52.82 2sta s ALA 229 Cb -0.08 -3.44 0.08 0.00 0.00 0.00 0.00 23.12 19.68 2sta s ALA 229 CO 0.01 -0.45 1.03 0.21 0.00 0.00 0.00 175.76 176.56 2sta s LYS 230 N -0.26 3.23 0.37 0.00 2.20 -0.01 -2.36 119.74 122.91 2sta s LYS 230 Ca 0.54 -0.99 0.08 0.00 -0.36 0.00 0.00 55.97 55.24 2sta s LYS 230 Cb -0.35 -4.41 0.72 0.00 -1.51 0.00 0.00 37.83 32.29 2sta s LYS 230 CO 0.38 -1.84 1.89 0.28 -0.36 0.00 0.00 175.35 175.70 2sta h VAL 231 N 5.99 1.19 0.00 4.02 2.07 -1.69 -3.02 116.25 124.81 2sta h VAL 231 Ca -0.18 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2sta h VAL 231 Cb 1.06 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2sta h VAL 231 CO 1.18 0.26 0.00 0.00 0.02 0.00 0.00 177.57 179.04 2sta n ILE 233 N -2.55 0.23 -0.05 0.00 -5.35 -1.14 -4.06 119.36 106.44 2sta n ILE 233 Ca -0.00 -0.43 0.03 0.00 -0.27 0.00 0.00 62.75 62.08 2sta n ILE 233 Cb 0.15 0.60 0.09 0.00 -1.74 0.00 0.00 39.64 38.74 2sta n ILE 233 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2sta n PHE 234 N 0.63 0.25 -0.26 4.28 3.72 0.23 -4.72 117.46 121.59 2sta n PHE 234 Ca 0.17 -0.43 0.04 0.00 -0.05 0.00 0.00 57.45 57.18 2sta n PHE 234 Cb 0.41 -0.03 0.27 0.00 -0.94 0.00 0.00 39.48 39.19 2sta n PHE 234 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2sta h ASN 235 N 1.27 0.84 0.06 4.37 2.35 -1.70 -0.02 115.58 122.75 2sta h ASN 235 Ca 0.00 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2sta h ASN 235 Cb 0.60 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2sta h ASN 235 CO 0.00 0.56 -0.03 -0.78 -1.65 0.00 0.00 177.43 175.53 2sta h ASP 236 N 0.97 -0.07 -0.60 5.81 3.58 -1.91 -0.68 116.42 123.51 2sta h ASP 236 Ca 0.35 -0.19 -0.02 0.00 0.42 0.00 0.00 57.03 57.59 2sta h ASP 236 Cb 0.15 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.19 2sta h ASP 236 CO -0.12 0.15 0.30 -0.25 -2.88 0.00 0.00 179.24 176.45 2sta h TRP 237 N -0.30 0.85 0.13 0.28 7.01 -1.78 -1.20 115.95 120.95 2sta h TRP 237 Ca -0.01 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.95 2sta h TRP 237 Cb 0.26 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 27.05 2sta h TRP 237 CO -0.00 0.64 -0.06 -0.07 -2.79 0.00 0.00 178.44 176.15 2sta h LEU 238 N 0.82 -0.15 -0.71 0.65 3.38 -0.95 0.34 115.31 118.69 2sta h LEU 238 Ca 0.21 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2sta h LEU 238 Cb 0.09 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2sta h LEU 238 CO -0.03 0.09 -0.52 0.71 0.09 0.00 0.00 178.44 178.78 2sta h THR 239 N -0.39 1.14 -0.08 0.22 1.35 -1.11 -0.90 112.91 113.13 2sta h THR 239 Ca -0.02 -1.95 -0.13 0.00 -0.55 0.00 0.00 66.41 63.76 2sta h THR 239 Cb 0.31 2.13 0.01 0.00 -1.73 0.00 0.00 68.15 68.86 2sta h THR 239 CO 0.03 0.51 -0.46 0.77 -0.25 0.00 0.00 175.52 176.11 2sta h SER 240 N 0.00 0.55 -0.19 5.36 4.64 -1.09 -3.23 113.55 119.59 2sta h SER 240 Ca -0.01 -0.66 -0.05 0.00 -0.47 0.00 0.00 61.79 60.61 2sta h SER 240 Cb 1.08 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.99 2sta h SER 240 CO 0.07 1.12 -0.03 0.74 -0.87 0.00 0.00 176.83 177.86 2sta h THR 241 N 0.02 1.20 0.00 2.95 2.02 -0.81 -1.69 112.91 116.59 2sta h THR 241 Ca -0.04 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.34 2sta h THR 241 Cb 1.12 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 2sta h THR 241 CO 0.10 0.27 0.00 0.23 0.37 0.00 0.00 175.52 176.49 2sta n MET 242 N -4.27 0.55 -0.10 6.66 2.81 -0.35 -2.04 117.12 120.37 2sta n MET 242 Ca 0.01 0.00 0.01 0.00 -1.81 0.00 0.00 57.70 55.91 2sta n MET 242 Cb 0.25 -1.46 0.01 0.00 -0.71 0.00 0.00 33.22 31.32 2sta n MET 242 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2sta n ALA 243 N -0.96 1.49 0.10 3.04 0.00 -0.72 -4.85 120.51 118.61 2sta n ALA 243 Ca 0.12 -0.86 -0.05 0.00 0.00 0.00 0.00 53.44 52.65 2sta n ALA 243 Cb 0.05 -0.12 0.06 0.00 0.00 0.00 0.00 19.45 19.44 2sta n ALA 243 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2sta h SER 244 N 0.00 0.12 0.00 0.00 0.02 -0.74 -3.51 113.55 109.44 2sta h SER 244 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2sta h SER 244 Cb 0.98 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.48 2sta h SER 244 CO 0.00 0.83 0.00 0.00 -1.14 0.00 0.00 176.83 176.52