#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 43ca s VAL 2 N 0.00 4.47 0.08 5.18 1.01 -1.26 -4.99 120.40 124.89 43ca s VAL 2 Ca 0.00 1.10 -0.30 0.00 0.00 0.00 0.00 61.98 62.78 43ca s VAL 2 Cb 0.00 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.90 43ca s VAL 2 CO 0.00 -0.72 1.07 -0.69 0.00 0.00 0.00 175.10 174.76 43ca s VAL 3 N 3.77 4.30 -0.28 2.92 1.01 -1.26 -4.78 120.40 126.08 43ca s VAL 3 Ca 0.40 1.77 -0.04 0.00 0.00 0.00 0.00 61.98 64.11 43ca s VAL 3 Cb -0.10 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 32.17 43ca s VAL 3 CO 0.23 0.20 0.01 -0.04 0.00 0.00 0.00 175.10 175.50 43ca s MET 4 N 0.51 2.83 -0.18 2.72 -1.94 -1.26 -1.22 119.30 120.77 43ca s MET 4 Ca 0.53 -1.00 -0.02 0.00 -1.71 0.00 0.00 55.69 53.48 43ca s MET 4 Cb -0.26 -3.18 -0.01 0.00 2.01 0.00 0.00 34.83 33.39 43ca s MET 4 CO 0.30 -0.47 -0.08 0.99 -0.01 0.00 0.00 175.02 175.75 43ca s THR 5 N 1.37 3.26 -0.02 2.05 2.01 0.15 -3.79 115.64 120.67 43ca s THR 5 Ca -0.00 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.45 43ca s THR 5 Cb -0.18 -2.43 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 43ca s THR 5 CO -0.01 0.48 -0.03 -1.10 -0.69 0.00 0.00 174.62 173.27 43ca s GLN 6 N 0.89 2.74 -0.01 4.92 -0.21 -1.26 0.00 119.66 126.72 43ca s GLN 6 Ca -0.02 -0.60 -0.03 0.00 0.02 0.00 0.00 55.36 54.72 43ca s GLN 6 Cb -0.15 -2.62 0.00 0.00 1.00 0.00 0.00 33.01 31.24 43ca s GLN 6 CO 0.00 0.64 0.08 0.95 -2.12 0.00 0.00 175.29 174.84 43ca s THR 7 N -0.98 0.04 0.81 -0.19 -4.23 -0.75 -4.49 115.64 105.84 43ca s THR 7 Ca 0.17 -0.34 -0.07 0.00 -1.18 0.00 0.00 61.69 60.26 43ca s THR 7 Cb -0.11 -0.23 0.14 0.00 1.34 0.00 0.00 72.50 73.64 43ca s THR 7 CO 0.07 -0.19 1.12 -2.16 -0.54 0.00 0.00 174.62 172.92 43ca s PRO 8 N -0.58 1.37 0.30 3.99 0.04 -1.26 -1.74 135.00 137.12 43ca s PRO 8 Ca -0.07 -0.72 0.04 0.00 0.04 0.00 0.00 61.00 60.29 43ca s PRO 8 Cb -0.04 -2.13 0.49 0.00 0.04 0.00 0.00 34.50 32.87 43ca s PRO 8 CO 0.00 -1.78 1.77 0.77 0.04 0.00 0.00 177.00 177.81 43ca h SER 9 N -0.95 0.45 -4.80 6.66 0.02 -1.81 -3.41 113.55 109.70 43ca h SER 9 Ca -0.41 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.39 43ca h SER 9 Cb 1.26 -0.12 -0.19 0.00 0.14 0.00 0.00 62.40 63.49 43ca h SER 9 CO 0.42 0.65 0.28 -0.94 -1.14 0.00 0.00 176.83 176.11 43ca s SER 10 N -6.80 -0.58 -0.07 3.07 1.04 -1.26 -0.74 113.70 108.37 43ca s SER 10 Ca -0.07 0.55 -0.22 0.00 0.48 0.00 0.00 55.95 56.69 43ca s SER 10 Cb 0.14 0.49 0.05 0.00 0.10 0.00 0.00 66.02 66.80 43ca s SER 10 CO 0.78 -0.59 0.50 -1.48 0.98 0.00 0.00 173.24 173.43 43ca s LEU 11 N -1.39 0.08 -0.16 2.42 2.34 -0.90 -4.94 118.68 116.13 43ca s LEU 11 Ca -0.07 0.54 -0.03 0.00 0.06 0.00 0.00 54.13 54.63 43ca s LEU 11 Cb -0.00 1.88 -0.02 0.00 -0.56 0.00 0.00 46.19 47.48 43ca s LEU 11 CO 0.05 -0.45 -0.06 0.00 -1.06 0.00 0.00 176.35 174.82 43ca s ALA 12 N -0.93 2.84 0.36 1.48 0.00 -1.26 -0.91 121.76 123.34 43ca s ALA 12 Ca -0.10 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 50.97 43ca s ALA 12 Cb -0.03 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 43ca s ALA 12 CO 0.06 0.06 0.09 -1.64 0.00 0.00 0.00 175.76 174.33 43ca s MET 13 N 0.64 1.78 0.11 0.00 -1.94 -0.04 -4.98 119.30 114.86 43ca s MET 13 Ca -0.04 -2.04 0.10 0.00 -1.71 0.00 0.00 55.69 52.00 43ca s MET 13 Cb -0.15 -0.71 -0.04 0.00 2.01 0.00 0.00 34.83 35.94 43ca s MET 13 CO 0.02 -0.34 -0.26 -1.12 -0.01 0.00 0.00 175.02 173.32 43ca s SER 14 N -3.54 3.16 0.38 3.03 0.01 -1.26 -1.06 113.70 114.42 43ca s SER 14 Ca 0.30 -0.70 -0.24 0.00 1.31 0.00 0.00 55.95 56.61 43ca s SER 14 Cb 0.06 -0.22 -0.13 0.00 0.21 0.00 0.00 66.02 65.93 43ca s SER 14 CO 0.15 0.18 0.72 0.52 0.41 0.00 0.00 173.24 175.22 43ca n VAL 15 N 1.15 1.97 0.00 3.43 0.31 -1.26 -1.84 118.33 122.09 43ca n VAL 15 Ca -0.18 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.65 43ca n VAL 15 Cb 0.53 -0.70 0.00 0.00 -0.91 0.00 0.00 33.84 32.76 43ca n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 43ca n GLY 16 N 1.58 3.12 3.83 2.92 0.00 0.13 -4.93 105.19 111.84 43ca n GLY 16 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 43ca n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 43ca s GLN 17 N -0.29 2.69 -0.27 1.61 -0.21 -0.76 -4.33 119.66 118.10 43ca s GLN 17 Ca 0.00 0.72 -0.16 0.00 0.02 0.00 0.00 55.36 55.94 43ca s GLN 17 Cb 0.00 -1.98 -0.03 0.00 1.00 0.00 0.00 33.01 32.00 43ca s GLN 17 CO 0.00 -1.21 0.42 0.21 -2.12 0.00 0.00 175.29 172.59 43ca s LYS 18 N -5.16 4.03 0.06 2.91 2.20 -1.24 0.01 119.74 122.55 43ca s LYS 18 Ca 0.59 0.14 -0.04 0.00 -0.36 0.00 0.00 55.97 56.29 43ca s LYS 18 Cb -0.13 -3.66 -0.05 0.00 -1.51 0.00 0.00 37.83 32.48 43ca s LYS 18 CO 0.54 -0.31 0.29 0.08 -0.36 0.00 0.00 175.35 175.59 43ca s VAL 19 N 2.16 5.28 -0.06 4.02 1.01 -0.09 -4.95 120.40 127.76 43ca s VAL 19 Ca 0.17 -0.01 -0.03 0.00 0.00 0.00 0.00 61.98 62.11 43ca s VAL 19 Cb -0.16 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.66 43ca s VAL 19 CO 0.10 0.20 0.12 -0.89 0.00 0.00 0.00 175.10 174.63 43ca s THR 20 N -1.47 -0.16 -0.01 3.92 2.01 -1.26 -1.12 115.64 117.56 43ca s THR 20 Ca 0.34 0.31 0.02 0.00 0.31 0.00 0.00 61.69 62.67 43ca s THR 20 Cb -0.13 -0.23 0.00 0.00 0.01 0.00 0.00 72.50 72.16 43ca s THR 20 CO 0.22 0.13 -0.05 0.00 -0.69 0.00 0.00 174.62 174.23 43ca s MET 21 N 1.86 0.53 0.27 4.92 0.23 0.09 -4.86 119.30 122.34 43ca s MET 21 Ca -0.01 -0.17 0.03 0.00 -1.03 0.00 0.00 55.69 54.52 43ca s MET 21 Cb -0.12 -0.54 -0.03 0.00 -1.53 0.00 0.00 34.83 32.61 43ca s MET 21 CO -0.05 0.06 0.42 -1.12 -2.03 0.00 0.00 175.02 172.31 43ca s SER 22 N 0.16 6.32 -0.14 -1.18 0.01 -0.71 -0.48 113.70 117.67 43ca s SER 22 Ca -0.02 0.22 -0.07 0.00 1.31 0.00 0.00 55.95 57.40 43ca s SER 22 Cb -0.06 -1.93 0.06 0.00 0.21 0.00 0.00 66.02 64.30 43ca s SER 22 CO -0.00 -0.14 0.33 0.00 0.41 0.00 0.00 173.24 173.83 43ca s LYS 24 N 1.70 1.27 0.01 0.00 1.02 0.10 -0.96 119.74 122.89 43ca s LYS 24 Ca -0.06 -0.39 -0.01 0.00 0.02 0.00 0.00 55.97 55.53 43ca s LYS 24 Cb -0.10 -1.14 -0.04 0.00 -0.52 0.00 0.00 37.83 36.03 43ca s LYS 24 CO -0.10 0.13 0.15 -1.54 -0.92 0.00 0.00 175.35 173.06 43ca s SER 25 N 0.25 6.07 0.10 2.83 1.04 -0.58 -0.67 113.70 122.74 43ca s SER 25 Ca -0.05 0.23 0.15 0.00 0.48 0.00 0.00 55.95 56.77 43ca s SER 25 Cb -0.11 -1.83 0.68 0.00 0.10 0.00 0.00 66.02 64.86 43ca s SER 25 CO 0.01 0.24 1.48 -1.54 0.98 0.00 0.00 173.24 174.41 43ca n SER 26 N 0.85 0.24 -3.84 7.02 3.41 -0.36 -4.74 113.62 116.19 43ca n SER 26 Ca -0.10 0.57 -0.10 0.00 -0.26 0.00 0.00 58.87 58.97 43ca n SER 26 Cb 0.52 -0.61 -0.08 0.00 -0.26 0.00 0.00 64.21 63.78 43ca n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 43ca s GLN 27 N -3.13 0.72 0.01 4.33 -0.21 -1.26 -4.95 119.66 115.16 43ca s GLN 27 Ca 0.04 -0.67 -0.00 0.00 0.02 0.00 0.00 55.36 54.75 43ca s GLN 27 Cb 0.08 0.30 0.00 0.00 1.00 0.00 0.00 33.01 34.39 43ca s GLN 27 CO 0.26 -0.21 0.01 0.45 -2.12 0.00 0.00 175.29 173.67 43ca n SER 27 N 0.57 -1.99 -1.33 5.90 2.88 -1.26 -4.69 113.62 113.71 43ca n SER 27 Ca -0.18 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.34 43ca n SER 27 Cb 0.59 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 43ca n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 43ca n LEU 27 N 0.00 -4.80 -4.69 2.46 7.94 -1.26 -4.99 117.00 111.66 43ca n LEU 27 Ca 0.00 2.12 -0.40 0.00 -1.11 0.00 0.00 56.01 56.62 43ca n LEU 27 Cb 0.00 -1.97 -0.05 0.00 0.53 0.00 0.00 43.42 41.94 43ca n LEU 27 CO 0.00 -0.70 0.48 0.21 -1.11 0.00 0.00 177.39 176.27 43ca s ASN 27 N -1.13 6.91 0.17 1.96 2.47 0.85 -4.94 114.94 121.23 43ca s ASN 27 Ca 0.00 1.11 -0.15 0.00 0.42 0.00 0.00 52.86 54.25 43ca s ASN 27 Cb 0.00 -2.42 0.10 0.00 -1.45 0.00 0.00 41.25 37.48 43ca s ASN 27 CO 0.00 -0.26 1.77 0.40 -3.72 0.00 0.00 177.10 175.29 43ca h ILE 27 N 5.01 0.94 -0.08 -5.21 2.04 -1.99 0.12 117.51 118.35 43ca h ILE 27 Ca -0.34 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 43ca h ILE 27 Cb 1.16 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 43ca h ILE 27 CO 0.79 0.07 -0.07 0.28 0.00 0.00 0.00 178.15 179.22 43ca h SER 27 N 0.40 0.10 0.00 1.72 0.02 -1.98 -3.34 113.55 110.48 43ca h SER 27 Ca 0.19 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 43ca h SER 27 Cb 0.13 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.64 43ca h SER 27 CO -0.15 0.19 0.00 -0.46 -1.14 0.00 0.00 176.83 175.27 43ca n ASN 28 N -4.39 0.54 -3.89 3.07 6.94 -1.15 -5.04 115.26 111.34 43ca n ASN 28 Ca -0.02 -1.23 -0.26 0.00 -0.02 0.00 0.00 54.58 53.05 43ca n ASN 28 Cb 0.19 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.62 43ca n ASN 28 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 43ca n GLN 29 N -0.12 -4.43 -5.05 -3.83 1.13 0.42 -4.99 117.38 100.51 43ca n GLN 29 Ca 0.00 0.53 -0.28 0.00 -1.94 0.00 0.00 57.00 55.31 43ca n GLN 29 Cb 0.36 -5.07 -0.16 0.00 0.11 0.00 0.00 30.24 25.48 43ca n GLN 29 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 43ca s LYS 30 N -6.42 1.76 -0.24 -1.09 1.02 -1.24 -4.91 119.74 108.61 43ca s LYS 30 Ca 0.26 -0.81 -0.15 0.00 0.02 0.00 0.00 55.97 55.30 43ca s LYS 30 Cb -0.13 -1.72 -0.04 0.00 -0.52 0.00 0.00 37.83 35.42 43ca s LYS 30 CO 0.85 0.47 0.35 -0.80 -0.92 0.00 0.00 175.35 175.30 43ca s ASN 31 N -0.59 6.30 -1.23 2.83 0.01 -1.26 -0.10 114.94 120.89 43ca s ASN 31 Ca 0.09 0.35 -0.14 0.00 -0.71 0.00 0.00 52.86 52.44 43ca s ASN 31 Cb -0.09 -2.20 0.15 0.00 0.41 0.00 0.00 41.25 39.52 43ca s ASN 31 CO -0.01 -0.10 1.51 -1.22 -1.51 0.00 0.00 177.10 175.77 43ca n TYR 32 N 4.83 4.89 -3.77 2.20 4.02 -1.26 -3.42 117.16 124.65 43ca n TYR 32 Ca -0.09 -3.25 -0.16 0.00 -0.01 0.00 0.00 57.90 54.38 43ca n TYR 32 Cb 0.51 -2.28 -0.16 0.00 -0.02 0.00 0.00 39.34 37.39 43ca n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 43ca s LEU 33 N 2.08 0.90 0.13 7.72 2.96 -1.26 -0.58 118.68 130.64 43ca s LEU 33 Ca 0.45 0.04 0.07 0.00 -0.22 0.00 0.00 54.13 54.47 43ca s LEU 33 Cb -0.01 -0.10 -0.04 0.00 0.50 0.00 0.00 46.19 46.54 43ca s LEU 33 CO 0.02 -0.15 -0.06 0.00 -1.32 0.00 0.00 176.35 174.84 43ca s ALA 34 N 1.28 3.08 -0.04 5.97 0.00 0.29 -0.81 121.76 131.52 43ca s ALA 34 Ca -0.06 -1.30 0.03 0.00 0.00 0.00 0.00 51.96 50.63 43ca s ALA 34 Cb -0.13 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 22.05 43ca s ALA 34 CO -0.03 0.58 -0.13 -1.58 0.00 0.00 0.00 175.76 174.60 43ca s TRP 35 N -1.46 1.40 0.16 0.00 0.52 -0.13 -1.26 118.94 118.17 43ca s TRP 35 Ca 0.24 -0.43 0.06 0.00 0.02 0.00 0.00 56.10 56.00 43ca s TRP 35 Cb -0.10 -0.98 -0.04 0.00 -1.15 0.00 0.00 33.47 31.19 43ca s TRP 35 CO 0.16 -0.18 -0.13 0.71 0.02 0.00 0.00 176.95 177.52 43ca s TYR 36 N 0.29 1.49 0.01 -1.98 1.51 0.42 -0.09 117.35 118.99 43ca s TYR 36 Ca -0.07 -0.60 0.07 0.00 -1.01 0.00 0.00 57.07 55.46 43ca s TYR 36 Cb -0.12 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 40.97 43ca s TYR 36 CO 0.02 0.21 -0.23 -1.14 -1.11 0.00 0.00 175.55 173.30 43ca s GLN 37 N -3.23 1.70 -0.11 -0.62 0.74 -0.35 -1.57 119.66 116.22 43ca s GLN 37 Ca 0.15 -0.90 -0.03 0.00 0.05 0.00 0.00 55.36 54.64 43ca s GLN 37 Cb -0.02 -1.73 0.04 0.00 1.10 0.00 0.00 33.01 32.40 43ca s GLN 37 CO 0.04 0.46 0.04 -1.14 -0.55 0.00 0.00 175.29 174.14 43ca s GLN 38 N -0.83 0.33 0.31 1.67 0.74 0.46 -0.92 119.66 121.42 43ca s GLN 38 Ca 0.09 0.03 -0.02 0.00 0.05 0.00 0.00 55.36 55.51 43ca s GLN 38 Cb -0.09 -1.28 -0.04 0.00 1.10 0.00 0.00 33.01 32.70 43ca s GLN 38 CO 0.00 -0.46 0.53 0.15 -0.55 0.00 0.00 175.29 174.97 43ca s LYS 39 N 2.03 3.54 0.02 1.67 1.02 -1.26 -1.27 119.74 125.50 43ca s LYS 39 Ca 0.03 -0.20 -0.36 0.00 0.02 0.00 0.00 55.97 55.46 43ca s LYS 39 Cb -0.14 -2.68 -0.15 0.00 -0.52 0.00 0.00 37.83 34.34 43ca s LYS 39 CO -0.06 0.20 1.55 -2.30 -0.92 0.00 0.00 175.35 173.82 43ca n PRO 40 N -1.32 1.58 -2.38 -1.68 -0.02 -1.26 -2.77 135.00 127.15 43ca n PRO 40 Ca -0.04 0.57 -0.13 0.00 -2.02 0.00 0.00 63.50 61.89 43ca n PRO 40 Cb 0.55 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 43ca n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 43ca n GLY 41 N 3.33 -0.14 3.12 -1.23 0.00 -1.26 -5.03 105.19 103.97 43ca n GLY 41 Ca 0.20 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 43ca n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 43ca s GLN 42 N -4.82 0.68 0.55 1.61 -0.21 -1.11 -5.15 119.66 111.21 43ca s GLN 42 Ca 0.05 -1.18 -0.16 0.00 0.02 0.00 0.00 55.36 54.09 43ca s GLN 42 Cb -0.02 -0.03 -0.06 0.00 1.00 0.00 0.00 33.01 33.89 43ca s GLN 42 CO 0.06 -0.05 1.01 -1.54 -2.12 0.00 0.00 175.29 172.66 43ca s SER 43 N -2.74 6.33 0.85 5.90 1.04 -1.26 -4.68 113.70 119.14 43ca s SER 43 Ca 0.06 1.62 -0.11 0.00 0.48 0.00 0.00 55.95 58.00 43ca s SER 43 Cb 0.04 -2.51 0.10 0.00 0.10 0.00 0.00 66.02 63.75 43ca s SER 43 CO -0.06 -0.79 1.11 -2.84 0.98 0.00 0.00 173.24 171.64 43ca s PRO 44 N -4.23 1.59 -0.03 4.02 0.02 -1.26 -4.74 135.00 130.37 43ca s PRO 44 Ca 0.60 1.26 0.03 0.00 0.02 0.00 0.00 61.00 62.91 43ca s PRO 44 Cb -0.12 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.59 43ca s PRO 44 CO 0.36 -2.14 -0.11 -1.59 -0.33 0.00 0.00 177.00 173.19 43ca s LYS 45 N -4.80 1.11 0.14 5.54 -2.85 -0.10 -4.95 119.74 113.84 43ca s LYS 45 Ca 0.64 -0.37 -0.31 0.00 -1.00 0.00 0.00 55.97 54.92 43ca s LYS 45 Cb -0.20 -1.02 -0.09 0.00 -2.06 0.00 0.00 37.83 34.46 43ca s LYS 45 CO 0.57 0.15 1.47 -1.17 0.10 0.00 0.00 175.35 176.48 43ca s LEU 46 N 0.11 4.37 -0.17 2.77 2.96 -1.26 -1.21 118.68 126.26 43ca s LEU 46 Ca -0.02 2.46 0.06 0.00 -0.22 0.00 0.00 54.13 56.41 43ca s LEU 46 Cb -0.09 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 42.87 43ca s LEU 46 CO 0.01 -0.73 -0.07 0.18 -1.32 0.00 0.00 176.35 174.41 43ca n LEU 47 N 4.00 1.72 -3.75 -0.68 4.77 0.87 -4.77 117.00 119.16 43ca n LEU 47 Ca 0.13 -0.06 -0.12 0.00 -0.03 0.00 0.00 56.01 55.93 43ca n LEU 47 Cb 0.41 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 43ca n LEU 47 CO 0.60 0.62 -0.09 -0.69 -1.33 0.00 0.00 177.39 176.50 43ca s VAL 48 N -2.36 -0.02 0.31 4.08 1.01 -1.08 -1.58 120.40 120.77 43ca s VAL 48 Ca -0.17 0.08 0.08 0.00 0.00 0.00 0.00 61.98 61.98 43ca s VAL 48 Cb 0.05 -0.40 -0.06 0.00 0.00 0.00 0.00 36.38 35.98 43ca s VAL 48 CO 0.49 0.03 -0.09 -0.72 0.00 0.00 0.00 175.10 174.82 43ca s TYR 49 N 0.83 2.20 -1.46 5.22 1.13 0.54 -0.95 117.35 124.86 43ca s TYR 49 Ca -0.06 -0.57 -0.09 0.00 -1.41 0.00 0.00 57.07 54.94 43ca s TYR 49 Cb -0.07 -1.24 0.05 0.00 -1.10 0.00 0.00 41.96 39.60 43ca s TYR 49 CO -0.05 0.47 0.78 1.19 -2.51 0.00 0.00 175.55 175.42 43ca n PHE 50 N -0.69 -2.17 0.00 -3.49 3.72 -1.01 -0.22 117.46 113.60 43ca n PHE 50 Ca -0.05 0.70 0.00 0.00 -0.05 0.00 0.00 57.45 58.04 43ca n PHE 50 Cb 0.63 -4.07 0.00 0.00 -0.94 0.00 0.00 39.48 35.10 43ca n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 43ca n ALA 51 N -4.10 0.00 -0.40 4.37 0.00 0.01 -3.98 120.51 116.41 43ca n ALA 51 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 43ca n ALA 51 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 43ca n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 43ca n SER 52 N 0.08 0.00 -4.67 0.00 3.41 -1.13 -3.43 113.62 107.89 43ca n SER 52 Ca 0.00 -0.32 -0.42 0.00 -0.26 0.00 0.00 58.87 57.86 43ca n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 43ca n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 43ca s THR 53 N 0.00 4.76 0.12 6.66 2.01 0.70 -4.62 115.64 125.26 43ca s THR 53 Ca 0.00 1.91 -0.30 0.00 0.31 0.00 0.00 61.69 63.61 43ca s THR 53 Cb 0.00 -4.26 -0.06 0.00 0.01 0.00 0.00 72.50 68.19 43ca s THR 53 CO 0.00 -0.09 0.99 -0.60 -0.69 0.00 0.00 174.62 174.22 43ca s ARG 54 N 2.73 4.68 0.63 4.92 3.52 -1.26 -0.34 118.95 133.82 43ca s ARG 54 Ca 0.43 1.50 -0.14 0.00 -0.13 0.00 0.00 55.73 57.39 43ca s ARG 54 Cb -0.16 -3.36 -0.02 0.00 -1.56 0.00 0.00 34.95 29.85 43ca s ARG 54 CO 0.10 0.19 1.05 -2.00 -0.81 0.00 0.00 175.30 173.83 43ca s GLU 55 N -0.06 3.20 0.33 5.12 2.56 -0.61 -4.92 118.70 124.33 43ca s GLU 55 Ca 0.47 1.10 -0.28 0.00 0.00 0.00 0.00 54.97 56.26 43ca s GLU 55 Cb -0.24 -2.02 -0.13 0.00 2.00 0.00 0.00 34.13 33.74 43ca s GLU 55 CO 0.31 -0.90 1.25 0.43 -0.56 0.00 0.00 175.26 175.79 43ca n SER 56 N -2.43 2.58 0.00 -1.70 7.64 -1.26 -1.91 113.62 116.54 43ca n SER 56 Ca 0.08 1.20 0.00 0.00 1.01 0.00 0.00 58.87 61.17 43ca n SER 56 Cb 0.53 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 43ca n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 43ca n GLY 57 N 0.82 2.51 3.69 0.23 0.00 -1.26 -5.01 105.19 106.18 43ca n GLY 57 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 43ca n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 43ca s VAL 58 N -2.42 4.85 0.76 1.61 1.01 -0.80 -5.02 120.40 120.39 43ca s VAL 58 Ca 0.00 1.90 -0.15 0.00 0.00 0.00 0.00 61.98 63.73 43ca s VAL 58 Cb 0.00 -4.25 -0.00 0.00 0.00 0.00 0.00 36.38 32.13 43ca s VAL 58 CO 0.00 0.08 0.74 -2.65 0.00 0.00 0.00 175.10 173.26 43ca n PRO 59 N 4.64 0.29 0.25 2.72 -0.02 -1.26 -4.91 135.00 136.70 43ca n PRO 59 Ca 0.06 0.15 0.10 0.00 -2.02 0.00 0.00 63.50 61.79 43ca n PRO 59 Cb 0.50 -2.03 0.64 0.00 -0.02 0.00 0.00 33.50 32.58 43ca n PRO 59 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 43ca h ASP 60 N -0.53 0.00 0.21 2.55 3.32 -2.00 -2.98 116.42 116.99 43ca h ASP 60 Ca -0.46 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.59 43ca h ASP 60 Cb 1.33 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.88 43ca h ASP 60 CO 0.43 0.16 -0.02 0.08 -1.72 0.00 0.00 179.24 178.18 43ca h ARG 61 N 0.00 0.00 -5.91 3.56 0.11 -1.94 -3.40 114.38 106.81 43ca h ARG 61 Ca -0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 43ca h ARG 61 Cb 0.41 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.41 43ca h ARG 61 CO 0.02 0.02 0.51 -0.06 0.10 0.00 0.00 179.97 180.56 43ca s PHE 62 N -4.19 3.36 -0.08 4.08 0.08 -1.13 -0.69 117.98 119.41 43ca s PHE 62 Ca -0.04 1.25 -0.01 0.00 0.12 0.00 0.00 56.93 58.25 43ca s PHE 62 Cb 0.13 -3.08 0.03 0.00 -0.57 0.00 0.00 43.02 39.52 43ca s PHE 62 CO 0.49 -0.36 -0.02 0.42 -0.10 0.00 0.00 175.22 175.65 43ca s ILE 63 N 2.66 0.55 -0.20 0.64 1.01 1.00 -4.98 121.20 121.88 43ca s ILE 63 Ca 0.38 0.01 -0.12 0.00 0.00 0.00 0.00 60.65 60.92 43ca s ILE 63 Cb -0.16 -0.67 -0.05 0.00 0.01 0.00 0.00 42.46 41.60 43ca s ILE 63 CO 0.09 0.29 0.22 -0.83 0.00 0.00 0.00 174.94 174.71 43ca s GLY 64 N 1.87 2.08 0.40 6.18 0.00 -1.26 -1.00 107.32 115.59 43ca s GLY 64 Ca 0.05 -0.65 0.05 0.00 0.00 0.00 0.00 44.72 44.17 43ca s GLY 64 CO -0.06 0.39 0.18 -1.35 0.00 0.00 0.00 173.10 172.26 43ca s SER 65 N 0.67 2.63 0.00 1.64 1.04 -0.21 -4.21 113.70 115.26 43ca s SER 65 Ca 0.12 -1.74 0.00 0.00 0.48 0.00 0.00 55.95 54.81 43ca s SER 65 Cb -0.13 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.59 43ca s SER 65 CO 0.03 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.85 43ca n GLY 66 N -0.88 1.47 3.50 7.32 0.00 -1.26 -1.69 105.19 113.64 43ca n GLY 66 Ca -0.03 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 43ca n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 43ca s SER 67 N 0.00 -0.49 0.00 1.61 1.04 -1.15 -4.93 113.70 109.78 43ca s SER 67 Ca 0.00 0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.68 43ca s SER 67 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.59 43ca s SER 67 CO 0.00 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.17 43ca n GLY 68 N 0.19 2.21 0.00 7.32 0.00 -1.26 -3.51 105.19 110.13 43ca n GLY 68 Ca -0.14 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.83 43ca n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 43ca n THR 69 N 0.00 0.00 -3.83 2.61 -2.24 -1.26 -4.18 114.28 105.38 43ca n THR 69 Ca 0.00 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 43ca n THR 69 Cb 0.00 0.21 -0.13 0.00 -2.10 0.00 0.00 70.33 68.30 43ca n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 43ca s ASP 70 N -1.53 4.84 0.33 3.42 1.01 -1.23 -1.52 116.67 121.99 43ca s ASP 70 Ca 0.00 -0.73 0.10 0.00 0.71 0.00 0.00 52.55 52.63 43ca s ASP 70 Cb 0.00 -1.81 -0.06 0.00 1.01 0.00 0.00 42.92 42.06 43ca s ASP 70 CO 0.00 -0.16 -0.11 -0.36 0.21 0.00 0.00 175.17 174.75 43ca s PHE 71 N 1.45 2.39 -0.12 4.23 0.08 -0.13 -2.95 117.98 122.92 43ca s PHE 71 Ca 0.02 -0.46 -0.11 0.00 0.12 0.00 0.00 56.93 56.50 43ca s PHE 71 Cb -0.17 -1.30 0.03 0.00 -0.57 0.00 0.00 43.02 41.01 43ca s PHE 71 CO 0.00 0.61 0.32 0.99 -0.10 0.00 0.00 175.22 177.04 43ca s THR 72 N -2.59 -0.00 -0.18 0.64 2.01 -0.68 -1.62 115.64 113.22 43ca s THR 72 Ca 0.32 0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.32 43ca s THR 72 Cb 0.01 -0.45 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 43ca s THR 72 CO 0.16 0.01 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.79 43ca s LEU 73 N 0.31 2.78 -0.00 4.42 2.96 0.36 -1.05 118.68 128.47 43ca s LEU 73 Ca -0.01 -0.37 0.08 0.00 -0.22 0.00 0.00 54.13 53.61 43ca s LEU 73 Cb -0.03 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.97 43ca s LEU 73 CO -0.01 0.07 -0.25 -0.89 -1.32 0.00 0.00 176.35 173.95 43ca s THR 74 N 0.93 2.20 -0.32 3.68 2.01 -0.17 -0.73 115.64 123.23 43ca s THR 74 Ca -0.02 -1.16 0.02 0.00 0.31 0.00 0.00 61.69 60.85 43ca s THR 74 Cb -0.15 -1.80 0.10 0.00 0.01 0.00 0.00 72.50 70.65 43ca s THR 74 CO -0.00 0.51 0.05 -0.63 -0.69 0.00 0.00 174.62 173.86 43ca s ILE 75 N -0.69 1.80 0.23 1.82 1.01 -0.27 -0.00 121.20 125.10 43ca s ILE 75 Ca 0.11 -1.95 -0.10 0.00 0.00 0.00 0.00 60.65 58.70 43ca s ILE 75 Cb -0.10 -2.30 0.27 0.00 0.01 0.00 0.00 42.46 40.34 43ca s ILE 75 CO 0.00 -0.56 1.62 0.77 0.00 0.00 0.00 174.94 176.78 43ca h SER 76 N 7.78 -0.53 -2.56 3.58 4.64 -1.17 -0.21 113.55 125.10 43ca h SER 76 Ca -0.09 0.20 -0.57 0.00 -0.47 0.00 0.00 61.79 60.87 43ca h SER 76 Cb 1.02 0.39 -0.39 0.00 -0.31 0.00 0.00 62.40 63.12 43ca h SER 76 CO 0.49 -0.21 -0.84 -0.55 -0.87 0.00 0.00 176.83 174.86 43ca s SER 77 N -5.22 2.89 0.26 4.97 0.15 -1.25 -3.69 113.70 111.80 43ca s SER 77 Ca -0.14 -2.11 -0.31 0.00 0.70 0.00 0.00 55.95 54.10 43ca s SER 77 Cb 0.21 -0.34 -0.13 0.00 -1.71 0.00 0.00 66.02 64.06 43ca s SER 77 CO 0.75 -0.31 1.49 0.55 1.20 0.00 0.00 173.24 176.92 43ca n VAL 78 N 4.12 0.93 -4.23 4.45 3.14 0.10 -4.60 118.33 122.24 43ca n VAL 78 Ca 0.11 -0.23 -0.23 0.00 -2.96 0.00 0.00 64.34 61.03 43ca n VAL 78 Cb 0.38 -1.68 -0.06 0.00 -1.06 0.00 0.00 33.84 31.42 43ca n VAL 78 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 43ca s GLN 79 N -0.37 2.44 0.19 1.45 -0.21 -1.26 0.17 119.66 122.08 43ca s GLN 79 Ca 0.67 -1.36 -0.12 0.00 0.02 0.00 0.00 55.36 54.57 43ca s GLN 79 Cb -0.59 -2.25 0.22 0.00 1.00 0.00 0.00 33.01 31.39 43ca s GLN 79 CO 0.48 0.33 1.70 0.00 -2.12 0.00 0.00 175.29 175.68 43ca h ALA 80 N 1.75 0.56 0.00 6.09 0.00 -1.96 -0.59 119.26 125.11 43ca h ALA 80 Ca -0.45 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.59 43ca h ALA 80 Cb 1.25 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.24 43ca h ALA 80 CO 0.61 -0.35 0.00 -0.85 0.00 0.00 0.00 179.25 178.66 43ca n GLU 81 N -5.17 0.07 0.02 0.00 0.28 -1.26 -1.59 120.64 112.98 43ca n GLU 81 Ca 0.06 0.13 0.12 0.00 -0.16 0.00 0.00 57.16 57.32 43ca n GLU 81 Cb 0.28 -1.50 0.31 0.00 1.43 0.00 0.00 31.44 31.96 43ca n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 43ca n ASP 82 N -1.14 0.46 -4.68 -1.84 8.00 -0.23 -4.85 116.55 112.27 43ca n ASP 82 Ca 0.02 0.03 -0.46 0.00 0.71 0.00 0.00 54.79 55.09 43ca n ASP 82 Cb 0.02 0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.10 43ca n ASP 82 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 43ca n GLN 83 N -1.68 2.32 -3.14 -1.24 7.27 -0.62 -4.85 117.38 115.44 43ca n GLN 83 Ca 0.05 0.84 0.00 0.00 0.07 0.00 0.00 57.00 57.96 43ca n GLN 83 Cb 0.37 -2.65 0.00 0.00 2.41 0.00 0.00 30.24 30.36 43ca n GLN 83 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 43ca n ALA 84 N 4.52 0.00 -2.86 1.69 0.00 -1.04 -4.87 120.51 117.95 43ca n ALA 84 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.26 43ca n ALA 84 Cb 0.31 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.69 43ca n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 43ca s ASP 85 N -0.07 6.26 -0.09 0.00 1.01 -0.39 -0.70 116.67 122.68 43ca s ASP 85 Ca 0.00 0.43 0.03 0.00 0.71 0.00 0.00 52.55 53.72 43ca s ASP 85 Cb 0.00 -2.00 0.00 0.00 1.01 0.00 0.00 42.92 41.94 43ca s ASP 85 CO 0.00 0.40 -0.20 -0.31 0.21 0.00 0.00 175.17 175.28 43ca s TYR 86 N -1.02 2.15 0.15 4.23 1.51 0.42 -0.40 117.35 124.38 43ca s TYR 86 Ca 0.15 -0.86 0.09 0.00 -1.01 0.00 0.00 57.07 55.44 43ca s TYR 86 Cb -0.12 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.22 43ca s TYR 86 CO 0.04 -0.37 -0.19 -0.06 -1.11 0.00 0.00 175.55 173.86 43ca s PHE 87 N 0.46 1.86 0.10 2.71 0.08 -0.61 -0.69 117.98 121.89 43ca s PHE 87 Ca -0.17 -0.45 0.09 0.00 0.12 0.00 0.00 56.93 56.52 43ca s PHE 87 Cb -0.17 -0.94 -0.03 0.00 -0.57 0.00 0.00 43.02 41.30 43ca s PHE 87 CO 0.07 0.32 -0.24 0.00 -0.10 0.00 0.00 175.22 175.27 43ca s GLN 89 N -1.77 0.06 -0.04 0.00 0.74 -0.39 -0.42 119.66 117.84 43ca s GLN 89 Ca 0.11 0.18 -0.14 0.00 0.05 0.00 0.00 55.36 55.55 43ca s GLN 89 Cb -0.10 -0.07 -0.05 0.00 1.10 0.00 0.00 33.01 33.89 43ca s GLN 89 CO 0.04 -0.08 0.38 1.14 -0.55 0.00 0.00 175.29 176.22 43ca s GLN 90 N 0.50 3.94 -0.11 1.67 1.03 -0.71 -0.55 119.66 125.43 43ca s GLN 90 Ca -0.04 0.33 0.15 0.00 0.04 0.00 0.00 55.36 55.84 43ca s GLN 90 Cb -0.05 -3.25 0.29 0.00 0.03 0.00 0.00 33.01 30.02 43ca s GLN 90 CO -0.02 0.61 1.18 0.72 -2.54 0.00 0.00 175.29 175.25 43ca n HIS 91 N 2.16 0.20 0.21 9.60 8.25 0.25 -3.79 115.22 132.10 43ca n HIS 91 Ca -0.14 -0.87 -0.10 0.00 -0.26 0.00 0.00 57.72 56.36 43ca n HIS 91 Cb 0.52 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.43 43ca n HIS 91 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 43ca h TYR 92 N 0.45 -0.55 -3.59 4.41 3.20 -1.94 -3.47 116.97 115.47 43ca h TYR 92 Ca 0.00 -0.01 -0.42 0.00 3.14 0.00 0.00 58.73 61.44 43ca h TYR 92 Cb 0.99 0.18 -0.18 0.00 1.54 0.00 0.00 36.73 39.26 43ca h TYR 92 CO 0.11 -0.32 -0.76 1.03 -1.64 0.00 0.00 178.16 176.57 43ca s ARG 93 N -3.58 1.02 0.26 1.82 1.81 -1.26 -5.10 118.95 113.93 43ca s ARG 93 Ca -0.09 -1.23 -0.24 0.00 -1.72 0.00 0.00 55.73 52.45 43ca s ARG 93 Cb 0.01 -0.91 -0.09 0.00 -0.45 0.00 0.00 34.95 33.51 43ca s ARG 93 CO 0.29 0.18 0.84 0.00 -0.68 0.00 0.00 175.30 175.92 43ca s ALA 94 N -2.10 3.32 0.16 2.13 0.00 -1.26 -3.41 121.76 120.60 43ca s ALA 94 Ca 0.09 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 43ca s ALA 94 Cb -0.05 -3.01 -0.07 0.00 0.00 0.00 0.00 23.12 19.98 43ca s ALA 94 CO 0.03 0.25 1.14 -1.25 0.00 0.00 0.00 175.76 175.93 43ca s PRO 95 N -1.89 4.54 -1.15 0.00 0.04 -1.26 -4.61 135.00 130.68 43ca s PRO 95 Ca 0.45 1.76 -0.22 0.00 0.04 0.00 0.00 61.00 63.03 43ca s PRO 95 Cb -0.19 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 43ca s PRO 95 CO 0.23 -0.01 1.86 1.03 0.04 0.00 0.00 177.00 180.15 43ca s ARG 96 N -0.12 2.90 0.69 4.56 0.52 -1.22 -4.60 118.95 121.67 43ca s ARG 96 Ca 0.51 -1.19 -0.16 0.00 -0.52 0.00 0.00 55.73 54.38 43ca s ARG 96 Cb -0.30 -5.28 0.01 0.00 0.52 0.00 0.00 34.95 29.90 43ca s ARG 96 CO 0.34 -3.38 1.20 0.95 0.02 0.00 0.00 175.30 174.43 43ca s THR 97 N 8.98 2.49 0.26 0.02 -4.23 -1.25 -4.72 115.64 117.19 43ca s THR 97 Ca 0.64 0.26 0.08 0.00 -1.18 0.00 0.00 61.69 61.48 43ca s THR 97 Cb -0.01 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 43ca s THR 97 CO 0.08 -0.11 0.15 -0.36 -0.54 0.00 0.00 174.62 173.83 43ca s PHE 98 N -1.92 3.01 0.79 3.99 0.40 -1.26 -1.74 117.98 121.25 43ca s PHE 98 Ca 0.74 -0.14 -0.07 0.00 -0.60 0.00 0.00 56.93 56.86 43ca s PHE 98 Cb -0.29 -1.35 0.13 0.00 0.51 0.00 0.00 43.02 42.02 43ca s PHE 98 CO 0.42 0.54 1.10 0.20 0.70 0.00 0.00 175.22 178.18 43ca s GLY 99 N -3.80 1.75 0.33 4.36 0.00 0.43 -4.55 107.32 105.84 43ca s GLY 99 Ca 0.33 -1.31 0.12 0.00 0.00 0.00 0.00 44.72 43.86 43ca s GLY 99 CO 0.24 -0.73 1.74 -1.33 0.00 0.00 0.00 173.10 173.01 43ca h GLY 100 N -0.90 0.00 0.00 0.20 0.00 -1.89 -3.44 103.07 97.04 43ca h GLY 100 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 43ca h GLY 100 CO 0.46 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.61 43ca n GLY 101 N -0.14 2.43 2.99 4.60 0.00 -1.26 -5.04 105.19 108.78 43ca n GLY 101 Ca -0.01 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 43ca n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 43ca s THR 102 N -1.87 1.46 -0.36 2.61 2.01 0.14 -4.61 115.64 115.02 43ca s THR 102 Ca 0.00 -0.59 -0.18 0.00 0.31 0.00 0.00 61.69 61.23 43ca s THR 102 Cb 0.00 -1.40 -0.00 0.00 0.01 0.00 0.00 72.50 71.11 43ca s THR 102 CO 0.00 0.42 0.51 -0.75 -0.69 0.00 0.00 174.62 174.11 43ca s LYS 103 N 1.53 3.57 -0.30 4.92 2.20 0.08 -0.44 119.74 131.30 43ca s LYS 103 Ca 0.05 -0.22 -0.17 0.00 -0.36 0.00 0.00 55.97 55.27 43ca s LYS 103 Cb -0.13 -3.83 -0.02 0.00 -1.51 0.00 0.00 37.83 32.34 43ca s LYS 103 CO -0.10 -0.67 0.46 -1.17 -0.36 0.00 0.00 175.35 173.50 43ca s LEU 104 N 2.39 4.18 -0.16 5.43 2.96 0.12 -2.12 118.68 131.48 43ca s LEU 104 Ca 0.18 0.20 -0.06 0.00 -0.22 0.00 0.00 54.13 54.24 43ca s LEU 104 Cb -0.15 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 43ca s LEU 104 CO 0.14 -0.32 0.03 -0.70 -1.32 0.00 0.00 176.35 174.17 43ca s GLU 105 N 2.24 3.77 -0.19 1.98 2.12 -0.09 -2.50 118.70 126.02 43ca s GLU 105 Ca 0.18 -0.40 -0.02 0.00 0.36 0.00 0.00 54.97 55.09 43ca s GLU 105 Cb -0.16 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 31.15 43ca s GLU 105 CO 0.11 0.33 -0.09 0.42 -0.54 0.00 0.00 175.26 175.49 43ca s ILE 106 N 0.19 3.12 -2.16 -3.70 -1.09 -1.26 -0.86 121.20 115.44 43ca s ILE 106 Ca 0.02 -0.59 0.31 0.00 -2.23 0.00 0.00 60.65 58.16 43ca s ILE 106 Cb -0.13 -2.38 0.79 0.00 -1.58 0.00 0.00 42.46 39.16 43ca s ILE 106 CO 0.01 0.47 2.07 0.29 -1.23 0.00 0.00 174.94 176.55