#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qte n LYS 4 N 0.00 2.73 -2.74 0.38 0.00 -1.26 -4.96 118.16 112.32 2qte n LYS 4 Ca 0.00 1.00 -0.38 0.00 0.00 0.00 0.00 58.31 58.92 2qte n LYS 4 Cb 0.00 -2.90 -0.06 0.00 0.00 0.00 0.00 35.03 32.07 2qte n LYS 4 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2qte s GLU 5 N 3.29 4.66 0.46 1.64 2.56 -1.26 -4.99 118.70 125.07 2qte s GLU 5 Ca 0.85 1.42 -0.23 0.00 0.00 0.00 0.00 54.97 57.02 2qte s GLU 5 Cb -0.50 -2.98 -0.07 0.00 2.00 0.00 0.00 34.13 32.58 2qte s GLU 5 CO 0.40 0.34 1.16 -0.51 -0.56 0.00 0.00 175.26 176.09 2qte s LEU 6 N -1.74 4.00 0.26 2.70 1.43 -1.26 -4.68 118.68 119.39 2qte s LEU 6 Ca 0.47 2.30 -0.30 0.00 -1.03 0.00 0.00 54.13 55.57 2qte s LEU 6 Cb -0.22 -4.26 -0.09 0.00 0.03 0.00 0.00 46.19 41.65 2qte s LEU 6 CO 0.28 -0.93 1.04 -1.00 0.23 0.00 0.00 176.35 175.97 2qte s HIS 7 N -1.56 3.73 -0.19 0.29 3.76 -0.07 -4.88 115.29 116.37 2qte s HIS 7 Ca 0.64 1.77 -0.06 0.00 -0.15 0.00 0.00 55.06 57.26 2qte s HIS 7 Cb -0.28 -3.17 -0.03 0.00 1.11 0.00 0.00 32.58 30.20 2qte s HIS 7 CO 0.34 -0.19 0.02 0.08 -0.85 0.00 0.00 174.74 174.15 2qte s VAL 8 N -1.10 4.31 -0.15 -0.90 1.01 -1.26 -0.56 120.40 121.76 2qte s VAL 8 Ca 0.44 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2qte s VAL 8 Cb -0.30 -2.94 0.02 0.00 0.00 0.00 0.00 36.38 33.16 2qte s VAL 8 CO 0.37 0.44 -0.14 -0.54 0.00 0.00 0.00 175.10 175.23 2qte s LYS 9 N 0.68 2.31 -0.21 2.72 1.02 -0.61 -4.96 119.74 120.69 2qte s LYS 9 Ca 0.01 -0.56 -0.05 0.00 0.02 0.00 0.00 55.97 55.39 2qte s LYS 9 Cb -0.14 -2.10 -0.02 0.00 -0.52 0.00 0.00 37.83 35.05 2qte s LYS 9 CO 0.02 -0.22 -0.00 0.99 -0.92 0.00 0.00 175.35 175.22 2qte s THR 10 N 1.45 3.87 0.12 2.17 2.01 -1.26 -0.88 115.64 123.12 2qte s THR 10 Ca 0.04 -0.33 0.04 0.00 0.31 0.00 0.00 61.69 61.75 2qte s THR 10 Cb -0.13 -2.76 -0.04 0.00 0.01 0.00 0.00 72.50 69.58 2qte s THR 10 CO -0.10 0.42 -0.10 0.68 -0.69 0.00 0.00 174.62 174.82 2qte s VAL 11 N 1.17 1.06 0.21 3.82 -7.23 -0.67 -5.00 120.40 113.76 2qte s VAL 11 Ca 0.03 -1.88 0.02 0.00 -1.81 0.00 0.00 61.98 58.33 2qte s VAL 11 Cb -0.14 -1.65 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 2qte s VAL 11 CO 0.01 -0.67 0.37 -0.54 -0.31 0.00 0.00 175.10 173.96 2qte s LYS 12 N -3.35 3.47 -0.11 4.82 1.02 -1.26 -4.36 119.74 119.97 2qte s LYS 12 Ca 0.12 -0.52 -0.41 0.00 0.02 0.00 0.00 55.97 55.18 2qte s LYS 12 Cb 0.00 -2.87 -0.19 0.00 -0.52 0.00 0.00 37.83 34.25 2qte s LYS 12 CO 0.00 0.41 1.26 -2.13 -0.92 0.00 0.00 175.35 173.97 2qte n ARG 13 N -0.95 0.23 -0.62 1.68 3.00 -1.26 -1.39 116.66 117.35 2qte n ARG 13 Ca -0.06 0.08 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 2qte n ARG 13 Cb 0.55 -1.61 0.00 0.00 0.00 0.00 0.00 32.46 31.40 2qte n ARG 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qte n GLY 14 N 2.31 0.82 3.80 5.14 0.00 0.67 -4.90 105.19 113.04 2qte n GLY 14 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 2qte n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qte s GLU 15 N -0.37 3.90 -0.02 1.61 2.12 -0.48 -4.12 118.70 121.33 2qte s GLU 15 Ca 0.00 1.36 -0.16 0.00 0.36 0.00 0.00 54.97 56.53 2qte s GLU 15 Cb 0.00 -2.18 -0.05 0.00 0.26 0.00 0.00 34.13 32.16 2qte s GLU 15 CO 0.00 -0.34 0.44 -0.80 -0.54 0.00 0.00 175.26 174.01 2qte s ASN 16 N -1.93 6.80 0.02 -1.70 0.01 -1.26 -0.86 114.94 116.02 2qte s ASN 16 Ca 0.65 0.95 0.00 0.00 -0.71 0.00 0.00 52.86 53.76 2qte s ASN 16 Cb -0.17 -2.27 -0.02 0.00 0.41 0.00 0.00 41.25 39.21 2qte s ASN 16 CO 0.20 0.25 -0.03 0.54 -1.51 0.00 0.00 177.10 176.55 2qte s VAL 17 N -0.69 0.16 -0.11 1.60 0.11 -0.35 -4.99 120.40 116.14 2qte s VAL 17 Ca 0.24 -0.77 0.01 0.00 -2.93 0.00 0.00 61.98 58.53 2qte s VAL 17 Cb -0.17 -0.27 0.02 0.00 -1.53 0.00 0.00 36.38 34.43 2qte s VAL 17 CO 0.13 -0.39 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.48 2qte s THR 18 N -1.18 1.42 -0.16 5.04 2.01 -1.26 -0.11 115.64 121.41 2qte s THR 18 Ca -0.12 -0.59 -0.05 0.00 0.31 0.00 0.00 61.69 61.24 2qte s THR 18 Cb -0.08 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 2qte s THR 18 CO -0.01 0.43 0.02 -0.04 -0.69 0.00 0.00 174.62 174.33 2qte s MET 19 N 1.11 3.70 0.01 4.92 -1.94 0.58 -4.95 119.30 122.73 2qte s MET 19 Ca -0.04 -0.40 -0.04 0.00 -1.71 0.00 0.00 55.69 53.50 2qte s MET 19 Cb -0.14 -3.05 -0.04 0.00 2.01 0.00 0.00 34.83 33.60 2qte s MET 19 CO -0.03 0.35 0.22 -1.21 -0.01 0.00 0.00 175.02 174.35 2qte s GLU 20 N 0.10 3.49 -0.11 2.03 8.01 -1.26 -0.67 118.70 130.29 2qte s GLU 20 Ca 0.03 -0.24 -0.05 0.00 0.01 0.00 0.00 54.97 54.72 2qte s GLU 20 Cb -0.13 -3.07 0.05 0.00 -4.31 0.00 0.00 34.13 26.67 2qte s GLU 20 CO 0.01 0.65 0.26 0.00 0.01 0.00 0.00 175.26 176.19 2qte s SER 22 N 1.62 6.72 -0.07 0.00 0.15 -1.26 -1.04 113.70 119.82 2qte s SER 22 Ca -0.06 1.56 0.16 0.00 0.70 0.00 0.00 55.95 58.31 2qte s SER 22 Cb -0.11 -2.50 -0.24 0.00 -1.71 0.00 0.00 66.02 61.47 2qte s SER 22 CO -0.09 -0.49 0.26 0.80 1.20 0.00 0.00 173.24 174.93 2qte n MET 23 N -1.22 0.84 -0.31 5.44 1.56 -0.69 -4.70 117.12 118.04 2qte n MET 23 Ca 0.06 -0.10 0.15 0.00 -0.27 0.00 0.00 57.70 57.54 2qte n MET 23 Cb 0.54 -1.40 0.31 0.00 2.15 0.00 0.00 33.22 34.82 2qte n MET 23 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 2qte h SER 24 N 0.00 -0.09 -2.48 6.12 4.64 -1.74 -1.89 113.55 118.10 2qte h SER 24 Ca -0.15 0.22 -0.69 0.00 -0.47 0.00 0.00 61.79 60.70 2qte h SER 24 Cb 1.20 0.32 -0.36 0.00 -0.31 0.00 0.00 62.40 63.25 2qte h SER 24 CO 0.01 -0.23 -0.02 2.29 -0.87 0.00 0.00 176.83 178.01 2qte n LYS 25 N -5.29 3.37 -4.72 4.77 0.00 -1.26 -4.99 118.16 110.03 2qte n LYS 25 Ca 0.23 -4.63 -0.33 0.00 -0.00 0.00 0.00 58.31 53.58 2qte n LYS 25 Cb 0.75 -2.36 -0.15 0.00 -0.00 0.00 0.00 35.03 33.27 2qte n LYS 25 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2qte s VAL 26 N -2.67 2.91 -0.05 0.58 1.01 -0.71 -5.04 120.40 116.42 2qte s VAL 26 Ca 0.37 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.39 2qte s VAL 26 Cb 0.11 -2.22 -0.22 0.00 0.00 0.00 0.00 36.38 34.05 2qte s VAL 26 CO 0.04 0.52 1.08 0.74 0.00 0.00 0.00 175.10 177.48 2qte h THR 27 N 5.49 1.52 -2.91 3.92 2.02 -1.94 -3.41 112.91 117.61 2qte h THR 27 Ca -0.27 -1.74 -0.60 0.00 0.77 0.00 0.00 66.41 64.56 2qte h THR 27 Cb 1.21 2.62 -0.40 0.00 -1.74 0.00 0.00 68.15 69.84 2qte h THR 27 CO 0.55 0.47 -0.76 0.21 0.37 0.00 0.00 175.52 176.36 2qte s ASN 28 N -6.13 3.52 0.40 4.18 3.84 -1.26 -4.98 114.94 114.51 2qte s ASN 28 Ca -0.16 -2.52 0.33 0.00 0.21 0.00 0.00 52.86 50.72 2qte s ASN 28 Cb 0.01 -0.90 1.31 0.00 -0.55 0.00 0.00 41.25 41.12 2qte s ASN 28 CO 0.72 -0.28 1.28 0.29 -2.79 0.00 0.00 177.10 176.32 2qte n LYS 29 N 3.66 -0.02 0.25 0.43 4.01 -1.26 0.00 118.16 125.23 2qte n LYS 29 Ca 0.09 0.96 0.16 0.00 -0.51 0.00 0.00 58.31 59.01 2qte n LYS 29 Cb 0.35 -2.03 0.62 0.00 -0.51 0.00 0.00 35.03 33.45 2qte n LYS 29 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 2qte h ASP 30 N 0.00 0.00 -0.62 4.39 3.32 -1.93 -2.76 116.42 118.81 2qte h ASP 30 Ca 0.74 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.55 2qte h ASP 30 Cb 2.67 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 42.08 2qte h ASP 30 CO -0.21 0.00 0.22 0.59 -1.72 0.00 0.00 179.24 178.12 2qte n ASN 31 N -2.92 3.81 -4.71 6.45 4.13 0.10 -4.83 115.26 117.30 2qte n ASN 31 Ca 0.01 -3.43 -0.35 0.00 1.68 0.00 0.00 54.58 52.49 2qte n ASN 31 Cb 0.31 -0.71 -0.09 0.00 -1.54 0.00 0.00 39.78 37.75 2qte n ASN 31 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2qte s LEU 32 N -3.11 3.76 0.08 3.41 2.96 -1.04 -0.95 118.68 123.79 2qte s LEU 32 Ca 0.51 0.19 -0.26 0.00 -0.22 0.00 0.00 54.13 54.35 2qte s LEU 32 Cb 0.43 -1.89 0.09 0.00 0.50 0.00 0.00 46.19 45.31 2qte s LEU 32 CO 0.08 0.34 0.74 0.00 -1.32 0.00 0.00 176.35 176.19 2qte s ALA 33 N -0.65 -1.71 -0.10 5.97 0.00 -0.75 -0.37 121.76 124.15 2qte s ALA 33 Ca 0.11 0.74 -0.03 0.00 0.00 0.00 0.00 51.96 52.78 2qte s ALA 33 Cb -0.12 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.63 2qte s ALA 33 CO 0.02 -0.73 0.03 -1.58 0.00 0.00 0.00 175.76 173.51 2qte s TRP 34 N -3.44 3.25 0.15 0.00 0.52 0.28 -1.67 118.94 118.02 2qte s TRP 34 Ca 0.03 0.23 0.08 0.00 0.02 0.00 0.00 56.10 56.46 2qte s TRP 34 Cb -0.01 -1.85 -0.04 0.00 -1.15 0.00 0.00 33.47 30.42 2qte s TRP 34 CO -0.11 0.48 -0.09 0.71 0.02 0.00 0.00 176.95 177.96 2qte s TYR 35 N -0.76 2.68 -0.04 -1.98 1.51 0.11 -1.29 117.35 117.59 2qte s TYR 35 Ca 0.12 -0.20 0.04 0.00 -1.01 0.00 0.00 57.07 56.02 2qte s TYR 35 Cb -0.12 -1.34 -0.00 0.00 -0.11 0.00 0.00 41.96 40.39 2qte s TYR 35 CO 0.02 0.48 -0.14 0.50 -1.11 0.00 0.00 175.55 175.30 2qte s ARG 36 N -2.62 1.51 -0.17 -0.62 3.52 -0.18 -1.18 118.95 119.22 2qte s ARG 36 Ca 0.24 -0.51 0.00 0.00 -0.13 0.00 0.00 55.73 55.33 2qte s ARG 36 Cb -0.10 -1.34 0.03 0.00 -1.56 0.00 0.00 34.95 31.99 2qte s ARG 36 CO 0.15 0.20 -0.11 -1.14 -0.81 0.00 0.00 175.30 173.59 2qte s GLN 37 N 0.10 2.03 0.58 5.12 0.74 0.84 -0.95 119.66 128.12 2qte s GLN 37 Ca -0.04 -0.65 -0.15 0.00 0.05 0.00 0.00 55.36 54.58 2qte s GLN 37 Cb -0.11 -2.19 -0.05 0.00 1.10 0.00 0.00 33.01 31.77 2qte s GLN 37 CO 0.02 -0.34 1.03 -1.12 -0.55 0.00 0.00 175.29 174.32 2qte s SER 38 N 1.48 6.08 0.22 6.67 0.01 -1.26 -1.08 113.70 125.81 2qte s SER 38 Ca 0.02 1.65 -0.32 0.00 1.31 0.00 0.00 55.95 58.61 2qte s SER 38 Cb -0.14 -2.51 -0.14 0.00 0.21 0.00 0.00 66.02 63.44 2qte s SER 38 CO -0.09 -0.97 1.36 0.33 0.41 0.00 0.00 173.24 174.29 2qte n PHE 39 N -2.13 1.97 -0.90 2.43 -0.00 -1.26 -1.95 117.46 115.62 2qte n PHE 39 Ca 0.07 0.48 0.00 0.00 -0.00 0.00 0.00 57.45 58.00 2qte n PHE 39 Cb 0.53 -2.42 0.00 0.00 -0.00 0.00 0.00 39.48 37.59 2qte n PHE 39 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2qte n GLY 40 N 2.20 0.49 3.61 7.13 0.00 -1.26 -5.01 105.19 112.35 2qte n GLY 40 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2qte n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qte s LYS 41 N -0.53 2.08 0.42 1.61 -0.14 -0.82 -5.13 119.74 117.23 2qte s LYS 41 Ca 0.00 -1.63 -0.24 0.00 -1.36 0.00 0.00 55.97 52.74 2qte s LYS 41 Cb 0.00 -1.98 -0.08 0.00 -1.68 0.00 0.00 37.83 34.08 2qte s LYS 41 CO 0.00 0.25 1.10 0.08 -0.76 0.00 0.00 175.35 176.02 2qte s VAL 42 N -2.45 3.45 0.67 3.17 1.01 -1.26 -4.69 120.40 120.30 2qte s VAL 42 Ca 0.33 1.11 -0.14 0.00 0.00 0.00 0.00 61.98 63.27 2qte s VAL 42 Cb -0.03 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.78 2qte s VAL 42 CO 0.19 0.00 1.11 -2.84 0.00 0.00 0.00 175.10 173.56 2qte s PRO 43 N -2.57 2.75 0.00 2.72 0.02 -1.26 -4.69 135.00 131.98 2qte s PRO 43 Ca 0.60 1.35 0.00 0.00 0.02 0.00 0.00 61.00 62.98 2qte s PRO 43 Cb -0.25 -1.95 -0.00 0.00 0.02 0.00 0.00 34.50 32.32 2qte s PRO 43 CO 0.31 -1.28 -0.01 -0.65 -0.33 0.00 0.00 177.00 175.04 2qte s GLN 44 N -4.20 0.11 -0.01 5.54 -0.21 -0.13 -4.94 119.66 115.83 2qte s GLN 44 Ca 0.66 -0.16 -0.37 0.00 0.02 0.00 0.00 55.36 55.51 2qte s GLN 44 Cb -0.20 -0.01 -0.16 0.00 1.00 0.00 0.00 33.01 33.63 2qte s GLN 44 CO 0.43 -0.00 1.47 0.98 -2.12 0.00 0.00 175.29 176.06 2qte n TYR 45 N 2.73 1.71 -0.05 0.91 9.36 -1.26 -1.01 117.16 129.55 2qte n TYR 45 Ca -0.15 0.58 -0.11 0.00 3.32 0.00 0.00 57.90 61.54 2qte n TYR 45 Cb 0.59 -2.38 -0.04 0.00 -0.63 0.00 0.00 39.34 36.88 2qte n TYR 45 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2qte n PHE 46 N 3.44 0.00 -3.67 2.98 7.35 -0.41 -4.77 117.46 122.37 2qte n PHE 46 Ca 0.21 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.79 2qte n PHE 46 Cb 0.18 -0.37 -0.09 0.00 0.35 0.00 0.00 39.48 39.55 2qte n PHE 46 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2qte s VAL 47 N -2.24 -0.01 0.22 -2.13 0.11 -1.13 -0.94 120.40 114.29 2qte s VAL 47 Ca -0.15 0.02 0.10 0.00 -2.93 0.00 0.00 61.98 59.02 2qte s VAL 47 Cb 0.05 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 34.05 2qte s VAL 47 CO 0.19 0.01 -0.12 0.00 -3.33 0.00 0.00 175.10 171.86 2qte s ARG 48 N 0.96 1.96 0.47 1.54 1.70 -0.23 -0.56 118.95 124.79 2qte s ARG 48 Ca -0.05 -1.43 -0.24 0.00 -0.47 0.00 0.00 55.73 53.53 2qte s ARG 48 Cb -0.05 -2.04 -0.07 0.00 -0.57 0.00 0.00 34.95 32.21 2qte s ARG 48 CO -0.09 0.40 1.38 -0.47 -1.08 0.00 0.00 175.30 175.44 2qte s TYR 49 N -1.98 2.47 -0.12 5.89 6.14 0.50 -0.84 117.35 129.42 2qte s TYR 49 Ca 0.27 1.32 -0.14 0.00 0.64 0.00 0.00 57.07 59.16 2qte s TYR 49 Cb -0.07 -3.84 0.04 0.00 0.42 0.00 0.00 41.96 38.50 2qte s TYR 49 CO 0.15 -2.77 0.37 -0.47 0.64 0.00 0.00 175.55 173.48 2qte s TYR 50 N -1.25 -0.38 -0.95 4.97 6.14 0.09 -4.72 117.35 121.26 2qte s TYR 50 Ca 0.63 0.88 -0.24 0.00 0.64 0.00 0.00 57.07 58.99 2qte s TYR 50 Cb -0.42 0.14 0.05 0.00 0.42 0.00 0.00 41.96 42.16 2qte s TYR 50 CO 0.52 -0.25 1.39 -1.12 0.64 0.00 0.00 175.55 176.73 2qte s SER 51 N -0.12 6.43 0.22 4.32 0.01 -1.26 -3.68 113.70 119.61 2qte s SER 51 Ca -0.03 -1.26 -0.22 0.00 1.31 0.00 0.00 55.95 55.76 2qte s SER 51 Cb -0.03 -2.56 0.07 0.00 0.21 0.00 0.00 66.02 63.71 2qte s SER 51 CO 0.01 -1.56 0.96 -0.94 0.41 0.00 0.00 173.24 172.12 2qte s SER 52 N 4.62 -0.06 0.13 2.44 1.04 -1.26 -5.00 113.70 115.62 2qte s SER 52 Ca 0.43 -0.68 -0.17 0.00 0.48 0.00 0.00 55.95 56.00 2qte s SER 52 Cb -0.02 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 2qte s SER 52 CO -0.04 -1.11 1.72 -1.13 0.98 0.00 0.00 173.24 173.66 2qte h ASN 53 N 2.00 0.43 -0.49 7.02 -1.24 -1.97 -2.83 115.58 118.50 2qte h ASN 53 Ca -0.27 -0.10 -0.07 0.00 0.71 0.00 0.00 56.30 56.57 2qte h ASN 53 Cb 1.23 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 40.15 2qte h ASN 53 CO 0.33 0.41 0.07 0.77 -1.29 0.00 0.00 177.43 177.72 2qte h SER 54 N 0.41 0.83 0.00 1.15 4.64 -1.96 -3.47 113.55 115.15 2qte h SER 54 Ca 0.12 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2qte h SER 54 Cb 0.08 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 2qte h SER 54 CO -0.02 0.85 0.00 0.61 -0.87 0.00 0.00 176.83 177.41 2qte n GLY 55 N -0.70 0.55 3.45 -0.77 0.00 -1.07 -4.63 105.19 102.02 2qte n GLY 55 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2qte n GLY 55 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2qte s TYR 56 N -2.23 -0.56 -0.12 1.61 -0.85 -1.24 -0.73 117.35 113.23 2qte s TYR 56 Ca 0.00 0.54 -0.05 0.00 -0.52 0.00 0.00 57.07 57.04 2qte s TYR 56 Cb 0.00 0.52 0.06 0.00 0.38 0.00 0.00 41.96 42.91 2qte s TYR 56 CO 0.00 -0.76 0.25 0.21 -1.52 0.00 0.00 175.55 173.72 2qte s LYS 57 N -3.00 0.15 0.78 -3.49 2.20 -0.02 -4.76 119.74 111.60 2qte s LYS 57 Ca -0.02 0.67 -0.11 0.00 -0.36 0.00 0.00 55.97 56.15 2qte s LYS 57 Cb -0.01 -0.08 0.06 0.00 -1.51 0.00 0.00 37.83 36.29 2qte s LYS 57 CO -0.06 -0.25 1.08 -0.06 -0.36 0.00 0.00 175.35 175.70 2qte s PHE 58 N 2.06 2.69 0.46 4.03 0.08 -1.26 -1.07 117.98 124.97 2qte s PHE 58 Ca -0.02 1.42 -0.24 0.00 0.12 0.00 0.00 56.93 58.21 2qte s PHE 58 Cb -0.12 -3.04 -0.08 0.00 -0.57 0.00 0.00 43.02 39.22 2qte s PHE 58 CO -0.08 -1.76 1.29 0.00 -0.10 0.00 0.00 175.22 174.56 2qte n ALA 59 N -3.48 1.37 -1.65 5.36 0.00 -0.12 -4.84 120.51 117.15 2qte n ALA 59 Ca 0.08 0.22 -0.45 0.00 0.00 0.00 0.00 53.44 53.29 2qte n ALA 59 Cb 0.54 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.67 2qte n ALA 59 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2qte n GLU 60 N -0.24 1.83 -0.98 0.00 4.07 -1.26 -1.52 120.64 122.53 2qte n GLU 60 Ca 0.08 0.65 0.00 0.00 -0.06 0.00 0.00 57.16 57.83 2qte n GLU 60 Cb 0.41 -2.26 0.00 0.00 -0.06 0.00 0.00 31.44 29.53 2qte n GLU 60 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qte n GLY 61 N 2.04 0.39 3.62 8.31 0.00 -1.26 -4.97 105.19 113.31 2qte n GLY 61 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2qte n GLY 61 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2qte s PHE 62 N -1.84 2.38 -0.86 1.61 5.36 -0.58 -4.97 117.98 119.09 2qte s PHE 62 Ca 0.00 0.71 0.01 0.00 -0.96 0.00 0.00 56.93 56.68 2qte s PHE 62 Cb 0.00 -4.08 0.25 0.00 -0.34 0.00 0.00 43.02 38.86 2qte s PHE 62 CO 0.00 -2.20 0.96 1.63 -1.46 0.00 0.00 175.22 174.15 2qte n LYS 63 N 7.74 3.09 -3.25 10.12 5.02 -1.26 -4.95 118.16 134.67 2qte n LYS 63 Ca 0.17 -4.57 -0.04 0.00 -2.02 0.00 0.00 58.31 51.85 2qte n LYS 63 Cb 0.47 -2.38 -0.03 0.00 -0.02 0.00 0.00 35.03 33.06 2qte n LYS 63 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2qte s ASP 64 N -1.44 -0.47 0.00 4.39 -1.08 -1.26 -5.02 116.67 111.79 2qte s ASP 64 Ca 0.33 -0.38 0.04 0.00 -0.52 0.00 0.00 52.55 52.02 2qte s ASP 64 Cb 0.04 1.48 0.25 0.00 -1.46 0.00 0.00 42.92 43.23 2qte s ASP 64 CO -0.02 -0.30 1.14 -1.20 0.52 0.00 0.00 175.17 175.30 2qte n SER 65 N 5.12 0.00 0.17 -0.34 7.64 -1.26 -2.58 113.62 122.38 2qte n SER 65 Ca 0.05 -1.81 0.03 0.00 1.01 0.00 0.00 58.87 58.14 2qte n SER 65 Cb 0.52 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 64.01 2qte n SER 65 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2qte h ARG 66 N 0.00 0.00 -6.62 1.43 3.08 -1.95 -3.45 114.38 106.87 2qte h ARG 66 Ca 0.00 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.54 2qte h ARG 66 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2qte h ARG 66 CO 0.00 0.46 0.09 -0.06 -1.07 0.00 0.00 179.97 179.38 2qte s PHE 67 N -3.78 3.52 0.39 3.04 0.40 -1.06 -1.29 117.98 119.19 2qte s PHE 67 Ca -0.01 1.28 -0.11 0.00 -0.60 0.00 0.00 56.93 57.49 2qte s PHE 67 Cb 0.13 -2.56 0.04 0.00 0.51 0.00 0.00 43.02 41.14 2qte s PHE 67 CO 0.72 0.24 0.70 -1.54 0.70 0.00 0.00 175.22 176.04 2qte s SER 68 N -1.94 0.37 0.04 1.36 1.04 -0.85 -5.01 113.70 108.71 2qte s SER 68 Ca 0.48 -1.32 -0.01 0.00 0.48 0.00 0.00 55.95 55.58 2qte s SER 68 Cb -0.14 0.81 -0.03 0.00 0.10 0.00 0.00 66.02 66.76 2qte s SER 68 CO 0.19 -1.61 -0.03 -0.04 0.98 0.00 0.00 173.24 172.73 2qte s MET 69 N -2.35 0.53 -0.35 4.02 -1.94 -1.26 -1.06 119.30 116.89 2qte s MET 69 Ca 0.21 -1.04 -0.08 0.00 -1.71 0.00 0.00 55.69 53.07 2qte s MET 69 Cb -0.04 0.16 0.03 0.00 2.01 0.00 0.00 34.83 36.99 2qte s MET 69 CO 0.15 -0.09 0.15 0.99 -0.01 0.00 0.00 175.02 176.21 2qte s THR 70 N -3.14 4.14 -0.16 2.05 2.01 0.06 -4.94 115.64 115.66 2qte s THR 70 Ca 0.00 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 61.04 2qte s THR 70 Cb 0.02 -3.31 0.02 0.00 0.01 0.00 0.00 72.50 69.24 2qte s THR 70 CO -0.07 -0.18 -0.20 -0.69 -0.69 0.00 0.00 174.62 172.79 2qte s VAL 71 N 1.48 2.00 0.00 3.82 1.01 -1.26 -1.10 120.40 126.34 2qte s VAL 71 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.07 2qte s VAL 71 Cb -0.19 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.39 2qte s VAL 71 CO 0.04 0.53 0.00 -0.46 0.00 0.00 0.00 175.10 175.22 2qte n ASN 72 N 4.47 0.00 0.25 3.32 0.23 -0.76 -4.94 115.26 117.83 2qte n ASN 72 Ca -0.20 0.00 0.17 0.00 -0.53 0.00 0.00 54.58 54.02 2qte n ASN 72 Cb 0.50 0.00 0.78 0.00 -2.08 0.00 0.00 39.78 38.99 2qte n ASN 72 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2qte h ASP 73 N 0.00 0.00 0.00 0.53 3.45 -2.00 -3.27 116.42 115.14 2qte h ASP 73 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2qte h ASP 73 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2qte h ASP 73 CO 0.00 0.00 -1.01 0.00 -1.57 0.00 0.00 179.24 176.66 2qte n GLN 74 N -2.79 0.13 -4.51 3.56 3.00 -1.26 -4.27 117.38 111.24 2qte n GLN 74 Ca -0.00 -0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.76 2qte n GLN 74 Cb 0.18 -1.00 -0.14 0.00 0.00 0.00 0.00 30.24 29.28 2qte n GLN 74 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2qte s LYS 75 N -2.02 1.09 -0.39 -1.09 1.02 -1.23 -1.70 119.74 115.41 2qte s LYS 75 Ca -0.00 -0.70 0.11 0.00 0.02 0.00 0.00 55.97 55.39 2qte s LYS 75 Cb 0.00 -1.09 0.32 0.00 -0.52 0.00 0.00 37.83 36.54 2qte s LYS 75 CO 0.02 0.28 0.69 0.34 -0.92 0.00 0.00 175.35 175.77 2qte n PHE 76 N 2.18 0.32 -3.74 3.18 7.35 -0.20 -1.83 117.46 124.72 2qte n PHE 76 Ca -0.17 -3.77 -0.37 0.00 -0.76 0.00 0.00 57.45 52.38 2qte n PHE 76 Cb 0.55 -0.41 -0.06 0.00 0.35 0.00 0.00 39.48 39.91 2qte n PHE 76 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2qte s ASP 77 N -2.19 6.54 -0.21 -2.13 1.01 -0.26 -3.80 116.67 115.63 2qte s ASP 77 Ca 0.39 0.64 -0.11 0.00 0.71 0.00 0.00 52.55 54.18 2qte s ASP 77 Cb 0.30 -2.13 -0.05 0.00 1.01 0.00 0.00 42.92 42.05 2qte s ASP 77 CO -0.09 0.34 0.17 -0.22 0.21 0.00 0.00 175.17 175.58 2qte s LEU 78 N -1.25 4.17 0.11 1.23 2.96 0.16 -0.76 118.68 125.31 2qte s LEU 78 Ca 0.21 0.23 0.07 0.00 -0.22 0.00 0.00 54.13 54.42 2qte s LEU 78 Cb -0.14 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 2qte s LEU 78 CO 0.10 0.12 -0.10 0.20 -1.32 0.00 0.00 176.35 175.35 2qte s ASN 79 N 0.67 4.40 -0.08 3.68 0.01 -0.22 -0.30 114.94 123.09 2qte s ASN 79 Ca 0.09 -0.40 0.03 0.00 -0.71 0.00 0.00 52.86 51.87 2qte s ASN 79 Cb -0.12 -0.83 0.01 0.00 0.41 0.00 0.00 41.25 40.71 2qte s ASN 79 CO 0.01 0.17 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.99 2qte s ILE 80 N -1.27 1.42 -0.27 0.60 1.09 0.85 -2.01 121.20 121.61 2qte s ILE 80 Ca 0.22 -0.64 -0.10 0.00 -1.10 0.00 0.00 60.65 59.03 2qte s ILE 80 Cb -0.11 -1.27 -0.04 0.00 -1.06 0.00 0.00 42.46 39.98 2qte s ILE 80 CO 0.14 0.42 0.15 -0.63 -0.10 0.00 0.00 174.94 174.92 2qte s ILE 81 N 0.59 5.05 -0.12 2.92 1.01 -0.41 -1.21 121.20 129.03 2qte s ILE 81 Ca -0.15 0.08 -0.01 0.00 0.00 0.00 0.00 60.65 60.57 2qte s ILE 81 Cb -0.16 -3.39 -0.01 0.00 0.01 0.00 0.00 42.46 38.91 2qte s ILE 81 CO 0.05 0.28 0.10 0.61 0.00 0.00 0.00 174.94 175.99 2qte n GLY 82 N 4.93 0.38 3.64 6.18 0.00 -1.11 -4.80 105.19 114.43 2qte n GLY 82 Ca -0.15 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 2qte n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qte n ALA 83 N -1.54 0.56 -2.37 4.61 0.00 -0.04 -4.52 120.51 117.21 2qte n ALA 83 Ca -0.01 0.36 -0.19 0.00 0.00 0.00 0.00 53.44 53.61 2qte n ALA 83 Cb 0.51 -2.14 -0.10 0.00 0.00 0.00 0.00 19.45 17.72 2qte n ALA 83 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2qte s ARG 84 N -1.76 1.30 0.31 0.00 1.70 -1.26 -0.23 118.95 119.00 2qte s ARG 84 Ca 0.57 -1.54 0.05 0.00 -0.47 0.00 0.00 55.73 54.35 2qte s ARG 84 Cb -0.62 -1.13 0.82 0.00 -0.57 0.00 0.00 34.95 33.45 2qte s ARG 84 CO 0.61 0.20 1.61 0.93 -1.08 0.00 0.00 175.30 177.56 2qte h GLU 85 N 2.73 0.10 0.00 3.89 5.08 -1.97 0.33 114.58 124.73 2qte h GLU 85 Ca -0.39 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2qte h GLU 85 Cb 1.22 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2qte h GLU 85 CO 0.60 0.06 0.00 -0.25 -1.00 0.00 0.00 179.01 178.42 2qte n ASP 86 N -5.33 0.00 0.23 1.42 9.92 -1.26 -1.54 116.55 119.98 2qte n ASP 86 Ca 0.25 -0.39 0.12 0.00 -0.53 0.00 0.00 54.79 54.23 2qte n ASP 86 Cb 0.81 -0.12 0.32 0.00 -0.64 0.00 0.00 41.12 41.49 2qte n ASP 86 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 2qte h ASP 87 N 0.00 0.00 -3.15 -2.24 3.32 -0.75 -3.46 116.42 110.14 2qte h ASP 87 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2qte h ASP 87 Cb 0.08 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.77 2qte h ASP 87 CO 0.00 0.09 0.11 0.61 -1.72 0.00 0.00 179.24 178.34 2qte n GLY 88 N 0.72 -0.33 0.00 2.75 0.00 -0.59 -4.88 105.19 102.86 2qte n GLY 88 Ca 0.02 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2qte n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qte n GLY 89 N 1.25 0.13 3.47 -0.02 0.00 -0.43 -4.72 105.19 104.87 2qte n GLY 89 Ca 0.10 -1.58 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 2qte n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qte s GLU 90 N -2.00 2.21 -0.08 1.61 2.02 -0.24 -0.87 118.70 121.34 2qte s GLU 90 Ca 0.00 -0.90 0.01 0.00 0.02 0.00 0.00 54.97 54.10 2qte s GLU 90 Cb 0.00 -2.25 0.02 0.00 0.10 0.00 0.00 34.13 32.00 2qte s GLU 90 CO 0.00 0.56 -0.08 0.71 0.02 0.00 0.00 175.26 176.48 2qte s TYR 91 N -0.88 1.28 -0.08 1.61 1.51 -0.39 -0.11 117.35 120.28 2qte s TYR 91 Ca 0.14 -0.54 0.05 0.00 -1.01 0.00 0.00 57.07 55.71 2qte s TYR 91 Cb -0.11 -1.05 -0.01 0.00 -0.11 0.00 0.00 41.96 40.68 2qte s TYR 91 CO 0.04 -0.37 -0.23 -0.06 -1.11 0.00 0.00 175.55 173.82 2qte s PHE 92 N 1.30 2.54 -0.21 2.71 0.08 -0.33 -0.63 117.98 123.43 2qte s PHE 92 Ca -0.03 -0.77 -0.09 0.00 0.12 0.00 0.00 56.93 56.16 2qte s PHE 92 Cb -0.14 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.61 2qte s PHE 92 CO -0.03 -0.25 0.10 0.00 -0.10 0.00 0.00 175.22 174.95 2qte s GLY 94 N 0.76 0.22 -0.11 0.00 0.00 -0.67 -0.84 107.32 106.67 2qte s GLY 94 Ca 0.05 -0.63 0.02 0.00 0.00 0.00 0.00 44.72 44.17 2qte s GLY 94 CO 0.02 -0.67 -0.16 1.85 0.00 0.00 0.00 173.10 174.13 2qte s GLU 95 N -3.91 2.30 0.00 2.90 2.12 -0.17 -1.80 118.70 120.14 2qte s GLU 95 Ca 0.12 -0.60 -0.30 0.00 0.36 0.00 0.00 54.97 54.55 2qte s GLU 95 Cb 0.03 -1.92 -0.05 0.00 0.26 0.00 0.00 34.13 32.44 2qte s GLU 95 CO -0.04 -0.03 1.36 0.08 -0.54 0.00 0.00 175.26 176.09 2qte s VAL 96 N 0.89 3.78 -0.36 3.70 1.01 -0.12 -1.57 120.40 127.73 2qte s VAL 96 Ca -0.08 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.07 2qte s VAL 96 Cb -0.15 -3.75 0.12 0.00 0.00 0.00 0.00 36.38 32.59 2qte s VAL 96 CO -0.00 0.01 0.17 -0.70 0.00 0.00 0.00 175.10 174.58 2qte s GLU 97 N 2.22 0.83 5.53 2.72 -6.30 0.12 -4.81 118.70 119.01 2qte s GLU 97 Ca 0.62 -1.40 0.00 0.00 -2.50 0.00 0.00 54.97 51.69 2qte s GLU 97 Cb -0.31 -1.88 0.00 0.00 0.00 0.00 0.00 34.13 31.95 2qte s GLU 97 CO 0.26 -1.10 0.00 0.41 0.02 0.00 0.00 175.26 174.85 2qte n GLY 98 N 4.25 0.29 1.15 -1.50 0.00 -1.26 -3.36 105.19 104.77 2qte n GLY 98 Ca 0.04 -0.76 0.07 0.00 0.00 0.00 0.00 46.02 45.38 2qte n GLY 98 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qte n ILE 99 N 0.00 1.14 -4.16 -0.61 -5.35 -1.26 -4.90 119.36 104.21 2qte n ILE 99 Ca 0.00 -0.80 -0.14 0.00 -0.27 0.00 0.00 62.75 61.54 2qte n ILE 99 Cb 0.00 0.11 -0.11 0.00 -1.74 0.00 0.00 39.64 37.90 2qte n ILE 99 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2qte s ILE 100 N -1.63 0.88 -0.05 7.28 1.09 -1.21 -5.17 121.20 122.39 2qte s ILE 100 Ca 0.36 -1.58 0.06 0.00 -1.10 0.00 0.00 60.65 58.40 2qte s ILE 100 Cb 0.22 -1.28 -0.02 0.00 -1.06 0.00 0.00 42.46 40.33 2qte s ILE 100 CO 0.19 -0.54 -0.22 -0.51 -0.10 0.00 0.00 174.94 173.76 2qte s ILE 101 N -2.34 2.33 -0.19 2.92 -1.16 -1.26 0.13 121.20 121.63 2qte s ILE 101 Ca 0.04 -0.98 -0.04 0.00 -0.51 0.00 0.00 60.65 59.16 2qte s ILE 101 Cb -0.03 -1.86 -0.02 0.00 0.61 0.00 0.00 42.46 41.16 2qte s ILE 101 CO -0.00 0.58 -0.05 -0.54 -2.81 0.00 0.00 174.94 172.12 2qte s LYS 102 N -0.40 3.47 -0.19 3.50 1.02 -0.61 -4.94 119.74 121.59 2qte s LYS 102 Ca 0.04 -0.60 -0.15 0.00 0.02 0.00 0.00 55.97 55.28 2qte s LYS 102 Cb -0.12 -2.95 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2qte s LYS 102 CO 0.02 -0.02 0.37 -0.06 -0.92 0.00 0.00 175.35 174.73 2qte s PHE 103 N 1.04 3.39 -0.73 3.18 0.08 -1.26 -1.00 117.98 122.68 2qte s PHE 103 Ca 0.01 0.60 0.18 0.00 0.12 0.00 0.00 56.93 57.83 2qte s PHE 103 Cb -0.15 -2.48 -0.21 0.00 -0.57 0.00 0.00 43.02 39.61 2qte s PHE 103 CO 0.00 0.04 0.71 0.25 -0.10 0.00 0.00 175.22 176.12 2qte n THR 104 N 4.20 0.00 -3.67 0.64 -2.24 -0.02 -4.95 114.28 108.24 2qte n THR 104 Ca -0.09 -0.13 -0.07 0.00 -2.27 0.00 0.00 64.05 61.50 2qte n THR 104 Cb 0.51 0.87 -0.02 0.00 -2.10 0.00 0.00 70.33 69.59 2qte n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qte s SER 105 N -2.90 -0.30 0.10 3.42 1.04 -1.23 -5.02 113.70 108.81 2qte s SER 105 Ca 0.05 -0.29 -0.27 0.00 0.48 0.00 0.00 55.95 55.92 2qte s SER 105 Cb 0.13 0.53 0.08 0.00 0.10 0.00 0.00 66.02 66.86 2qte s SER 105 CO 0.74 -0.94 1.05 -0.83 0.98 0.00 0.00 173.24 174.24 2qte s GLY 106 N -2.80 -0.29 -0.00 7.32 0.00 -1.26 -1.05 107.32 109.24 2qte s GLY 106 Ca 0.09 0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.15 2qte s GLY 106 CO -0.02 0.06 0.00 -1.59 0.00 0.00 0.00 173.10 171.55 2qte s THR 107 N -3.04 0.02 -0.41 0.90 2.01 0.19 -0.89 115.64 114.42 2qte s THR 107 Ca 0.12 0.03 -0.14 0.00 0.31 0.00 0.00 61.69 62.01 2qte s THR 107 Cb 0.00 -0.05 0.03 0.00 0.01 0.00 0.00 72.50 72.50 2qte s THR 107 CO -0.00 0.03 0.29 -0.60 -0.69 0.00 0.00 174.62 173.65 2qte s ARG 108 N 0.22 2.92 -0.20 4.92 3.52 0.28 -1.26 118.95 129.34 2qte s ARG 108 Ca -0.02 -1.09 -0.16 0.00 -0.13 0.00 0.00 55.73 54.33 2qte s ARG 108 Cb -0.03 -3.94 -0.04 0.00 -1.56 0.00 0.00 34.95 29.39 2qte s ARG 108 CO -0.01 -0.78 0.41 -1.17 -0.81 0.00 0.00 175.30 172.95 2qte s LEU 109 N 1.64 4.15 0.06 -0.88 2.96 -0.05 -1.57 118.68 124.98 2qte s LEU 109 Ca 0.04 0.53 0.00 0.00 -0.22 0.00 0.00 54.13 54.49 2qte s LEU 109 Cb -0.20 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.92 2qte s LEU 109 CO 0.09 -0.09 -0.04 0.00 -1.32 0.00 0.00 176.35 174.98 2qte s GLN 110 N 1.36 0.61 0.00 1.98 -2.07 -0.06 -1.32 119.66 120.16 2qte s GLN 110 Ca 0.20 -1.11 0.13 0.00 -1.82 0.00 0.00 55.36 52.76 2qte s GLN 110 Cb -0.15 0.06 0.11 0.00 -1.09 0.00 0.00 33.01 31.94 2qte s GLN 110 CO 0.08 -0.07 0.92 1.19 -1.32 0.00 0.00 175.29 176.10