#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fns s ILE 2 N 0.00 4.93 -0.16 0.53 1.01 -1.26 -5.04 121.20 121.21 1fns s ILE 2 Ca 0.00 1.27 -0.15 0.00 0.00 0.00 0.00 60.65 61.77 1fns s ILE 2 Cb 0.00 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1fns s ILE 2 CO 0.00 0.39 0.37 -1.10 0.00 0.00 0.00 174.94 174.60 1fns s GLN 3 N 0.00 4.25 -0.18 2.79 -1.52 -1.26 -4.78 119.66 118.97 1fns s GLN 3 Ca 0.32 0.21 -0.05 0.00 -1.95 0.00 0.00 55.36 53.89 1fns s GLN 3 Cb -0.18 -3.47 -0.03 0.00 -0.22 0.00 0.00 33.01 29.12 1fns s GLN 3 CO 0.17 0.13 -0.01 -1.64 -0.25 0.00 0.00 175.29 173.69 1fns s MET 4 N 0.79 3.69 -0.14 2.91 -1.94 -1.26 -1.10 119.30 122.24 1fns s MET 4 Ca 0.19 -0.49 0.01 0.00 -1.71 0.00 0.00 55.69 53.69 1fns s MET 4 Cb -0.14 -3.02 -0.00 0.00 2.01 0.00 0.00 34.83 33.67 1fns s MET 4 CO 0.07 0.16 -0.16 0.99 -0.01 0.00 0.00 175.02 176.06 1fns s THR 5 N 0.62 2.61 -0.41 2.05 2.01 -0.02 -4.11 115.64 118.38 1fns s THR 5 Ca -0.01 -0.80 -0.04 0.00 0.31 0.00 0.00 61.69 61.15 1fns s THR 5 Cb -0.14 -2.08 0.11 0.00 0.01 0.00 0.00 72.50 70.39 1fns s THR 5 CO 0.02 0.52 0.22 -1.10 -0.69 0.00 0.00 174.62 173.59 1fns s GLN 6 N 0.69 2.08 0.23 4.92 -0.21 -1.26 -1.46 119.66 124.64 1fns s GLN 6 Ca -0.08 -1.80 -0.07 0.00 0.02 0.00 0.00 55.36 53.44 1fns s GLN 6 Cb -0.16 -3.62 0.38 0.00 1.00 0.00 0.00 33.01 30.62 1fns s GLN 6 CO 0.02 -1.08 1.71 0.77 -2.12 0.00 0.00 175.29 174.59 1fns h SER 7 N 8.10 0.08 -3.77 5.90 0.02 -1.94 -3.38 113.55 118.57 1fns h SER 7 Ca -0.14 0.12 -0.63 0.00 -0.84 0.00 0.00 61.79 60.29 1fns h SER 7 Cb 1.05 0.15 -0.15 0.00 0.14 0.00 0.00 62.40 63.58 1fns h SER 7 CO 0.72 0.02 -0.32 -2.84 -1.14 0.00 0.00 176.83 173.27 1fns s PRO 8 N -6.07 3.97 0.26 3.45 0.02 -1.26 -4.92 135.00 130.45 1fns s PRO 8 Ca -0.13 -0.09 0.21 0.00 0.02 0.00 0.00 61.00 61.00 1fns s PRO 8 Cb 0.19 -3.67 0.08 0.00 0.02 0.00 0.00 34.50 31.13 1fns s PRO 8 CO 0.75 -0.27 1.22 0.66 -0.33 0.00 0.00 177.00 179.03 1fns h SER 9 N 8.25 0.00 -3.24 2.53 4.64 -1.74 -3.39 113.55 120.59 1fns h SER 9 Ca -0.32 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.51 1fns h SER 9 Cb 1.17 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.89 1fns h SER 9 CO 0.62 0.17 -0.79 -0.55 -0.87 0.00 0.00 176.83 175.41 1fns s SER 10 N -5.83 1.85 -0.14 4.97 0.15 -1.26 -0.91 113.70 112.54 1fns s SER 10 Ca 0.02 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.45 1fns s SER 10 Cb 0.08 -0.68 0.02 0.00 -1.71 0.00 0.00 66.02 63.73 1fns s SER 10 CO 0.75 -0.13 -0.13 -0.22 1.20 0.00 0.00 173.24 174.72 1fns s LEU 11 N 1.65 1.55 0.08 3.45 2.96 -0.59 -4.95 118.68 122.84 1fns s LEU 11 Ca 0.02 -0.43 -0.14 0.00 -0.22 0.00 0.00 54.13 53.36 1fns s LEU 11 Cb -0.13 -1.08 -0.06 0.00 0.50 0.00 0.00 46.19 45.42 1fns s LEU 11 CO -0.06 -0.07 0.48 -0.44 -1.32 0.00 0.00 176.35 174.95 1fns s SER 12 N 1.50 6.81 0.23 3.68 0.01 -1.26 -1.13 113.70 123.54 1fns s SER 12 Ca 0.04 1.00 -0.20 0.00 1.31 0.00 0.00 55.95 58.10 1fns s SER 12 Cb -0.13 -2.26 0.03 0.00 0.21 0.00 0.00 66.02 63.87 1fns s SER 12 CO -0.09 0.20 0.63 0.00 0.41 0.00 0.00 173.24 174.39 1fns s ALA 13 N -1.30 -1.18 0.06 1.44 0.00 -0.38 -4.93 121.76 115.46 1fns s ALA 13 Ca 0.32 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 52.17 1fns s ALA 13 Cb -0.16 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 1fns s ALA 13 CO 0.17 -0.92 -0.03 -1.12 0.00 0.00 0.00 175.76 173.87 1fns s SER 14 N -2.88 4.86 0.50 0.00 0.01 -1.26 -0.86 113.70 114.07 1fns s SER 14 Ca 0.09 -0.17 -0.23 0.00 1.31 0.00 0.00 55.95 56.95 1fns s SER 14 Cb -0.03 -1.14 -0.07 0.00 0.21 0.00 0.00 66.02 64.98 1fns s SER 14 CO 0.00 0.22 1.31 0.18 0.41 0.00 0.00 173.24 175.36 1fns n LEU 15 N 0.96 4.82 0.00 2.44 4.77 -1.26 -1.43 117.00 127.30 1fns n LEU 15 Ca -0.13 1.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.88 1fns n LEU 15 Cb 0.52 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 1fns n LEU 15 CO 0.35 -0.65 0.00 0.61 -1.33 0.00 0.00 177.39 176.37 1fns n GLY 16 N 0.79 2.79 3.79 -0.72 0.00 0.29 -4.90 105.19 107.23 1fns n GLY 16 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1fns n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fns s ASP 17 N -1.40 4.96 -0.15 1.61 1.01 -0.51 -4.21 116.67 117.97 1fns s ASP 17 Ca 0.00 1.76 -0.19 0.00 0.71 0.00 0.00 52.55 54.82 1fns s ASP 17 Cb 0.00 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 1fns s ASP 17 CO 0.00 -1.73 0.54 -0.60 0.21 0.00 0.00 175.17 173.59 1fns s ARG 18 N -4.85 4.29 -0.01 8.23 3.52 -1.25 0.48 118.95 129.37 1fns s ARG 18 Ca 0.60 0.52 0.07 0.00 -0.13 0.00 0.00 55.73 56.79 1fns s ARG 18 Cb -0.16 -3.50 -0.02 0.00 -1.56 0.00 0.00 34.95 29.72 1fns s ARG 18 CO 0.53 -0.00 -0.22 0.08 -0.81 0.00 0.00 175.30 174.88 1fns s VAL 19 N 1.13 1.75 -0.08 7.11 1.01 -0.06 -4.98 120.40 126.29 1fns s VAL 19 Ca 0.27 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1fns s VAL 19 Cb -0.16 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.78 1fns s VAL 19 CO 0.11 0.46 -0.12 -0.89 0.00 0.00 0.00 175.10 174.66 1fns s THR 20 N -0.55 1.15 -0.16 3.92 2.01 -1.26 -0.18 115.64 120.56 1fns s THR 20 Ca 0.09 -0.46 -0.02 0.00 0.31 0.00 0.00 61.69 61.60 1fns s THR 20 Cb -0.09 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 1fns s THR 20 CO -0.00 0.36 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.57 1fns s ILE 21 N 0.83 3.35 0.11 1.82 1.01 0.80 -4.96 121.20 124.17 1fns s ILE 21 Ca -0.11 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.02 1fns s ILE 21 Cb -0.15 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 1fns s ILE 21 CO 0.02 0.49 0.17 -0.94 0.00 0.00 0.00 174.94 174.67 1fns s SER 22 N 0.63 5.88 -0.10 3.58 1.04 -1.26 -0.97 113.70 122.50 1fns s SER 22 Ca -0.05 0.06 -0.07 0.00 0.48 0.00 0.00 55.95 56.37 1fns s SER 22 Cb -0.15 -1.67 0.03 0.00 0.10 0.00 0.00 66.02 64.33 1fns s SER 22 CO 0.03 0.12 0.25 0.00 0.98 0.00 0.00 173.24 174.61 1fns s SER 24 N 0.53 0.62 0.19 0.00 1.04 -0.54 -0.18 113.70 115.36 1fns s SER 24 Ca -0.03 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.23 1fns s SER 24 Cb -0.05 -0.04 -0.04 0.00 0.10 0.00 0.00 66.02 65.99 1fns s SER 24 CO -0.03 0.01 0.36 0.00 0.98 0.00 0.00 173.24 174.55 1fns s ALA 25 N -0.37 3.88 -1.11 5.32 0.00 0.30 -0.84 121.76 128.94 1fns s ALA 25 Ca -0.01 -0.93 0.18 0.00 0.00 0.00 0.00 51.96 51.20 1fns s ALA 25 Cb -0.03 -1.91 0.80 0.00 0.00 0.00 0.00 23.12 21.98 1fns s ALA 25 CO -0.00 0.44 1.56 -1.13 0.00 0.00 0.00 175.76 176.64 1fns n SER 26 N -0.71 0.00 -3.64 0.00 3.41 -0.26 -4.81 113.62 107.62 1fns n SER 26 Ca -0.06 0.38 -0.10 0.00 -0.26 0.00 0.00 58.87 58.83 1fns n SER 26 Cb 0.54 -0.44 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 1fns n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fns s GLN 27 N -2.89 1.36 0.00 4.33 -2.07 -1.26 -4.99 119.66 114.14 1fns s GLN 27 Ca 0.11 -0.73 -0.37 0.00 -1.82 0.00 0.00 55.36 52.55 1fns s GLN 27 Cb 0.12 0.55 -0.16 0.00 -1.09 0.00 0.00 33.01 32.43 1fns s GLN 27 CO 0.31 -0.59 1.51 -3.47 -1.32 0.00 0.00 175.29 171.74 1fns n ASP 28 N -0.36 2.20 -0.38 12.60 4.64 -1.26 -4.62 116.55 129.37 1fns n ASP 28 Ca -0.12 1.09 0.06 0.00 -1.38 0.00 0.00 54.79 54.44 1fns n ASP 28 Cb 0.63 -1.23 0.14 0.00 -1.04 0.00 0.00 41.12 39.62 1fns n ASP 28 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 1fns n ILE 29 N 3.35 1.61 -3.50 5.18 -5.35 -0.88 -4.98 119.36 114.78 1fns n ILE 29 Ca 0.20 -1.62 -0.26 0.00 -0.27 0.00 0.00 62.75 60.81 1fns n ILE 29 Cb 0.20 0.08 0.02 0.00 -1.74 0.00 0.00 39.64 38.20 1fns n ILE 29 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1fns n ASN 30 N -0.60 -4.94 0.00 7.28 3.02 -1.26 -0.84 115.26 117.92 1fns n ASN 30 Ca 0.13 -0.52 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 1fns n ASN 30 Cb 0.57 -3.99 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 1fns n ASN 30 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1fns n LYS 31 N -4.26 -1.33 -2.07 3.52 5.02 -1.26 -4.89 118.16 112.89 1fns n LYS 31 Ca -0.01 0.33 -0.42 0.00 -2.02 0.00 0.00 58.31 56.18 1fns n LYS 31 Cb 0.56 -4.38 0.00 0.00 -0.02 0.00 0.00 35.03 31.19 1fns n LYS 31 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1fns n TYR 32 N -2.28 3.72 -4.14 2.13 0.53 -0.02 -3.11 117.16 113.99 1fns n TYR 32 Ca 0.00 -2.94 -0.19 0.00 -1.02 0.00 0.00 57.90 53.75 1fns n TYR 32 Cb 0.33 -2.44 -0.16 0.00 -1.03 0.00 0.00 39.34 36.04 1fns n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 1fns s LEU 33 N 2.12 1.42 0.24 7.72 2.96 -1.26 -1.25 118.68 130.63 1fns s LEU 33 Ca 0.47 -0.11 0.11 0.00 -0.22 0.00 0.00 54.13 54.38 1fns s LEU 33 Cb 0.10 -0.39 -0.05 0.00 0.50 0.00 0.00 46.19 46.36 1fns s LEU 33 CO -0.04 -0.04 -0.18 0.20 -1.32 0.00 0.00 176.35 174.97 1fns s ASN 34 N 0.74 3.71 -0.04 3.68 0.01 -0.23 0.16 114.94 122.97 1fns s ASN 34 Ca -0.09 -0.88 0.05 0.00 -0.71 0.00 0.00 52.86 51.22 1fns s ASN 34 Cb -0.12 -0.39 -0.01 0.00 0.41 0.00 0.00 41.25 41.14 1fns s ASN 34 CO -0.00 0.07 -0.17 0.26 -1.51 0.00 0.00 177.10 175.75 1fns s TRP 35 N -2.11 1.68 0.16 2.20 0.52 0.27 -1.03 118.94 120.63 1fns s TRP 35 Ca 0.26 -0.45 0.09 0.00 0.02 0.00 0.00 56.10 56.03 1fns s TRP 35 Cb -0.07 -1.12 -0.04 0.00 -1.15 0.00 0.00 33.47 31.09 1fns s TRP 35 CO 0.14 -0.13 -0.20 0.71 0.02 0.00 0.00 176.95 177.48 1fns s TYR 36 N -0.06 1.95 -0.16 -1.98 1.51 0.75 -0.57 117.35 118.78 1fns s TYR 36 Ca -0.01 -0.43 0.01 0.00 -1.01 0.00 0.00 57.07 55.62 1fns s TYR 36 Cb -0.10 -0.98 0.00 0.00 -0.11 0.00 0.00 41.96 40.77 1fns s TYR 36 CO 0.02 0.35 -0.17 -1.14 -1.11 0.00 0.00 175.55 173.50 1fns s GLN 37 N -2.62 3.15 -0.26 -0.62 0.74 -0.29 -1.08 119.66 118.69 1fns s GLN 37 Ca 0.16 -0.78 -0.04 0.00 0.05 0.00 0.00 55.36 54.75 1fns s GLN 37 Cb -0.07 -2.60 0.01 0.00 1.10 0.00 0.00 33.01 31.45 1fns s GLN 37 CO 0.07 -0.03 -0.02 -1.14 -0.55 0.00 0.00 175.29 173.62 1fns s GLN 38 N 0.91 3.04 0.67 1.67 0.74 0.11 -1.31 119.66 125.49 1fns s GLN 38 Ca -0.04 -0.86 -0.11 0.00 0.05 0.00 0.00 55.36 54.40 1fns s GLN 38 Cb -0.15 -3.10 -0.01 0.00 1.10 0.00 0.00 33.01 30.85 1fns s GLN 38 CO -0.02 -0.36 1.05 0.15 -0.55 0.00 0.00 175.29 175.56 1fns s LYS 39 N 1.41 3.13 0.50 1.67 1.02 -0.36 -0.98 119.74 126.13 1fns s LYS 39 Ca 0.02 0.92 0.30 0.00 0.02 0.00 0.00 55.97 57.24 1fns s LYS 39 Cb -0.16 -2.02 1.41 0.00 -0.52 0.00 0.00 37.83 36.54 1fns s LYS 39 CO -0.02 -0.95 1.80 -1.35 -0.92 0.00 0.00 175.35 173.91 1fns h PRO 40 N -0.55 0.12 0.00 -1.68 0.11 -1.91 0.29 132.00 128.37 1fns h PRO 40 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1fns h PRO 40 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1fns h PRO 40 CO 0.58 0.08 0.00 -0.40 -0.21 0.00 0.00 178.00 178.05 1fns n ASP 41 N -4.33 0.00 0.00 -2.05 3.85 -1.26 -4.91 116.55 107.85 1fns n ASP 41 Ca 0.25 -1.08 0.00 0.00 -0.71 0.00 0.00 54.79 53.24 1fns n ASP 41 Cb 1.11 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.88 1fns n ASP 41 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1fns n GLY 42 N 0.62 2.51 3.71 6.12 0.00 0.10 -5.05 105.19 113.21 1fns n GLY 42 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1fns n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fns s ALA 43 N -2.50 3.71 -0.10 4.61 0.00 -1.26 -4.70 121.76 121.53 1fns s ALA 43 Ca 0.00 1.26 -0.02 0.00 0.00 0.00 0.00 51.96 53.20 1fns s ALA 43 Cb 0.00 -3.63 -0.03 0.00 0.00 0.00 0.00 23.12 19.46 1fns s ALA 43 CO 0.00 -0.85 -0.01 0.08 0.00 0.00 0.00 175.76 174.98 1fns s VAL 44 N 1.62 4.17 0.02 0.00 1.01 -1.26 -1.22 120.40 124.74 1fns s VAL 44 Ca 0.70 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.36 1fns s VAL 44 Cb -0.41 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 1fns s VAL 44 CO 0.31 0.58 0.03 -1.59 0.00 0.00 0.00 175.10 174.44 1fns s LYS 45 N -0.63 0.44 0.15 2.72 -2.85 -0.43 -4.98 119.74 114.15 1fns s LYS 45 Ca 0.10 -0.65 -0.30 0.00 -1.00 0.00 0.00 55.97 54.12 1fns s LYS 45 Cb -0.12 0.17 -0.07 0.00 -2.06 0.00 0.00 37.83 35.75 1fns s LYS 45 CO 0.02 -0.09 0.97 -1.17 0.10 0.00 0.00 175.35 175.18 1fns s LEU 46 N -1.72 4.53 -0.13 2.77 2.96 -1.26 -1.13 118.68 124.70 1fns s LEU 46 Ca -0.11 1.86 -0.05 0.00 -0.22 0.00 0.00 54.13 55.61 1fns s LEU 46 Cb -0.06 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 42.98 1fns s LEU 46 CO -0.02 -0.04 -0.16 0.18 -1.32 0.00 0.00 176.35 175.00 1fns n LEU 47 N 2.46 1.16 -3.98 -0.68 4.77 0.26 -4.73 117.00 116.26 1fns n LEU 47 Ca 0.01 0.13 -0.18 0.00 -0.03 0.00 0.00 56.01 55.94 1fns n LEU 47 Cb 0.48 -0.38 -0.15 0.00 -2.33 0.00 0.00 43.42 41.05 1fns n LEU 47 CO 0.51 0.32 -0.42 -0.63 -1.33 0.00 0.00 177.39 175.84 1fns s ILE 48 N -2.23 0.56 0.12 -0.08 -1.09 -1.03 -1.13 121.20 116.32 1fns s ILE 48 Ca -0.17 -0.28 0.06 0.00 -2.23 0.00 0.00 60.65 58.03 1fns s ILE 48 Cb 0.06 -0.49 -0.04 0.00 -1.58 0.00 0.00 42.46 40.42 1fns s ILE 48 CO 0.23 0.17 -0.15 0.72 -1.23 0.00 0.00 174.94 174.68 1fns s PHE 49 N -0.01 1.48 -1.22 3.97 -0.12 -0.01 -0.57 117.98 121.50 1fns s PHE 49 Ca 0.01 -0.53 -0.17 0.00 -0.05 0.00 0.00 56.93 56.19 1fns s PHE 49 Cb -0.05 -0.77 -0.00 0.00 -0.63 0.00 0.00 43.02 41.57 1fns s PHE 49 CO -0.00 0.17 0.68 0.98 -0.05 0.00 0.00 175.22 177.00 1fns n TYR 50 N 0.57 -1.79 0.00 3.49 -0.00 -1.11 -1.12 117.16 117.20 1fns n TYR 50 Ca -0.16 0.49 0.00 0.00 -0.00 0.00 0.00 57.90 58.24 1fns n TYR 50 Cb 0.57 -3.47 0.00 0.00 -0.00 0.00 0.00 39.34 36.44 1fns n TYR 50 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.86 179.27 1fns n THR 51 N -4.33 0.00 -0.71 2.97 -1.04 0.12 -4.06 114.28 107.24 1fns n THR 51 Ca -0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1fns n THR 51 Cb 0.61 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.12 1fns n THR 51 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1fns n SER 52 N 0.49 0.12 -4.70 8.00 3.41 -1.16 -3.41 113.62 116.37 1fns n SER 52 Ca 0.00 -0.84 -0.41 0.00 -0.26 0.00 0.00 58.87 57.36 1fns n SER 52 Cb 0.00 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 1fns n SER 52 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1fns s SER 53 N -0.02 7.21 0.12 4.04 0.01 -0.27 -4.53 113.70 120.25 1fns s SER 53 Ca 0.00 1.47 -0.30 0.00 1.31 0.00 0.00 55.95 58.43 1fns s SER 53 Cb 0.00 -2.52 -0.06 0.00 0.21 0.00 0.00 66.02 63.65 1fns s SER 53 CO 0.00 -0.26 0.99 -0.76 0.41 0.00 0.00 173.24 173.62 1fns s LEU 54 N 1.20 4.50 0.77 2.44 1.02 -1.26 -0.83 118.68 126.51 1fns s LEU 54 Ca 0.46 1.85 -0.11 0.00 0.02 0.00 0.00 54.13 56.35 1fns s LEU 54 Cb -0.19 -3.59 0.05 0.00 0.02 0.00 0.00 46.19 42.48 1fns s LEU 54 CO 0.23 -0.09 1.09 -2.28 0.02 0.00 0.00 176.35 175.31 1fns s HIS 55 N -0.04 2.92 0.31 0.29 2.46 -0.29 -4.93 115.29 116.02 1fns s HIS 55 Ca 0.47 1.20 -0.29 0.00 0.47 0.00 0.00 55.06 56.92 1fns s HIS 55 Cb -0.24 -3.07 -0.13 0.00 -0.13 0.00 0.00 32.58 29.01 1fns s HIS 55 CO 0.31 -1.62 1.25 0.43 -2.47 0.00 0.00 174.74 172.64 1fns n SER 56 N -3.34 2.45 0.00 9.88 7.64 -1.26 -2.02 113.62 126.97 1fns n SER 56 Ca 0.07 1.19 0.00 0.00 1.01 0.00 0.00 58.87 61.14 1fns n SER 56 Cb 0.56 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 1fns n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fns n GLY 57 N 1.09 3.01 3.71 0.23 0.00 -1.26 -5.01 105.19 106.96 1fns n GLY 57 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1fns n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fns s VAL 58 N -1.33 4.02 0.59 1.61 1.01 -0.86 -5.01 120.40 120.43 1fns s VAL 58 Ca 0.00 1.45 -0.17 0.00 0.00 0.00 0.00 61.98 63.26 1fns s VAL 58 Cb 0.00 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1fns s VAL 58 CO 0.00 0.11 1.08 -2.16 0.00 0.00 0.00 175.10 174.13 1fns s PRO 59 N 1.10 3.24 0.31 2.72 0.04 -1.26 -4.90 135.00 136.25 1fns s PRO 59 Ca 0.59 1.36 0.21 0.00 0.04 0.00 0.00 61.00 63.20 1fns s PRO 59 Cb -0.30 -2.01 1.13 0.00 0.04 0.00 0.00 34.50 33.37 1fns s PRO 59 CO 0.29 -0.89 1.65 0.43 0.04 0.00 0.00 177.00 178.52 1fns n SER 60 N -1.84 0.55 0.18 6.66 7.64 -1.26 -2.02 113.62 123.53 1fns n SER 60 Ca 0.10 0.75 0.13 0.00 1.01 0.00 0.00 58.87 60.86 1fns n SER 60 Cb 0.52 -0.83 0.62 0.00 -1.01 0.00 0.00 64.21 63.52 1fns n SER 60 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1fns h ARG 61 N 0.00 0.00 -5.80 1.43 0.11 -1.94 -3.41 114.38 104.77 1fns h ARG 61 Ca 0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 1fns h ARG 61 Cb 0.02 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.03 1fns h ARG 61 CO 0.00 0.00 -0.19 -0.06 0.10 0.00 0.00 179.97 179.82 1fns s PHE 62 N -3.52 3.58 0.04 4.08 0.40 -0.86 -0.38 117.98 121.32 1fns s PHE 62 Ca 0.00 0.89 -0.11 0.00 -0.60 0.00 0.00 56.93 57.11 1fns s PHE 62 Cb 0.08 -2.43 0.01 0.00 0.51 0.00 0.00 43.02 41.19 1fns s PHE 62 CO 0.33 0.35 0.24 -1.54 0.70 0.00 0.00 175.22 175.29 1fns s SER 63 N -0.01 -0.03 0.06 1.36 1.04 -0.63 -4.99 113.70 110.49 1fns s SER 63 Ca 0.24 -0.28 0.05 0.00 0.48 0.00 0.00 55.95 56.45 1fns s SER 63 Cb -0.15 0.31 -0.03 0.00 0.10 0.00 0.00 66.02 66.25 1fns s SER 63 CO 0.10 -0.56 -0.15 -0.83 0.98 0.00 0.00 173.24 172.78 1fns s GLY 64 N -2.01 0.87 0.29 7.32 0.00 -1.26 -0.66 107.32 111.87 1fns s GLY 64 Ca -0.06 -0.94 -0.06 0.00 0.00 0.00 0.00 44.72 43.66 1fns s GLY 64 CO -0.03 -0.94 0.43 -1.35 0.00 0.00 0.00 173.10 171.22 1fns s SER 65 N -1.44 0.43 0.00 1.64 1.04 -0.32 -4.24 113.70 110.81 1fns s SER 65 Ca 0.01 -1.26 0.00 0.00 0.48 0.00 0.00 55.95 55.18 1fns s SER 65 Cb -0.09 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1fns s SER 65 CO 0.02 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 173.67 1fns n GLY 66 N -0.46 1.73 3.75 7.32 0.00 -1.26 -1.04 105.19 115.23 1fns n GLY 66 Ca 0.00 -2.04 -0.02 0.00 0.00 0.00 0.00 46.02 43.96 1fns n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fns s SER 67 N 0.00 -0.11 1.80 1.61 1.04 -1.06 -4.89 113.70 112.09 1fns s SER 67 Ca 0.00 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.06 1fns s SER 67 Cb 0.00 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1fns s SER 67 CO 0.00 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.10 1fns n GLY 68 N -0.53 4.15 0.04 7.32 0.00 -1.26 -2.34 105.19 112.57 1fns n GLY 68 Ca -0.06 0.16 0.07 0.00 0.00 0.00 0.00 46.02 46.19 1fns n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fns n THR 69 N 0.00 0.32 -3.81 2.61 -2.24 -1.26 -2.08 114.28 107.82 1fns n THR 69 Ca 0.00 -0.57 -0.36 0.00 -2.27 0.00 0.00 64.05 60.85 1fns n THR 69 Cb 0.00 -0.13 -0.11 0.00 -2.10 0.00 0.00 70.33 67.99 1fns n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1fns s ASP 70 N -4.79 5.48 0.13 3.42 1.11 -0.99 -0.54 116.67 120.49 1fns s ASP 70 Ca -0.08 -0.07 0.07 0.00 0.18 0.00 0.00 52.55 52.65 1fns s ASP 70 Cb 0.12 -1.98 -0.04 0.00 1.07 0.00 0.00 42.92 42.10 1fns s ASP 70 CO 0.88 0.03 -0.16 -0.31 1.18 0.00 0.00 175.17 176.80 1fns s TYR 71 N 1.23 1.54 -0.03 4.23 1.51 0.75 -2.55 117.35 124.03 1fns s TYR 71 Ca 0.05 -0.52 -0.04 0.00 -1.01 0.00 0.00 57.07 55.55 1fns s TYR 71 Cb -0.14 -0.80 0.01 0.00 -0.11 0.00 0.00 41.96 40.91 1fns s TYR 71 CO 0.04 0.20 0.11 -1.12 -1.11 0.00 0.00 175.55 173.68 1fns s SER 72 N -2.46 -0.07 -0.17 2.29 0.01 -0.20 -1.11 113.70 111.98 1fns s SER 72 Ca 0.10 0.11 -0.01 0.00 1.31 0.00 0.00 55.95 57.47 1fns s SER 72 Cb -0.06 0.23 -0.00 0.00 0.21 0.00 0.00 66.02 66.40 1fns s SER 72 CO 0.04 -0.12 -0.11 -0.22 0.41 0.00 0.00 173.24 173.24 1fns s LEU 73 N -0.29 2.65 -0.07 2.44 2.96 -0.14 -1.17 118.68 125.04 1fns s LEU 73 Ca -0.04 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.48 1fns s LEU 73 Cb -0.03 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 1fns s LEU 73 CO 0.00 0.06 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.05 1fns s THR 74 N 0.98 2.90 -0.29 3.68 2.01 0.16 -0.14 115.64 124.93 1fns s THR 74 Ca -0.02 -0.76 -0.03 0.00 0.31 0.00 0.00 61.69 61.19 1fns s THR 74 Cb -0.15 -2.15 0.04 0.00 0.01 0.00 0.00 72.50 70.25 1fns s THR 74 CO -0.01 0.57 0.01 -0.63 -0.69 0.00 0.00 174.62 173.87 1fns s ILE 75 N -0.33 3.24 0.32 1.82 1.01 0.75 -1.61 121.20 126.40 1fns s ILE 75 Ca 0.03 -1.15 0.02 0.00 0.00 0.00 0.00 60.65 59.54 1fns s ILE 75 Cb -0.13 -2.78 0.19 0.00 0.01 0.00 0.00 42.46 39.75 1fns s ILE 75 CO 0.02 -0.02 1.89 0.77 0.00 0.00 0.00 174.94 177.61 1fns h SER 76 N 8.07 0.66 -2.07 3.58 4.64 -0.99 -0.11 113.55 127.33 1fns h SER 76 Ca -0.26 -0.09 -0.24 0.00 -0.47 0.00 0.00 61.79 60.73 1fns h SER 76 Cb 1.09 -0.17 -0.32 0.00 -0.31 0.00 0.00 62.40 62.69 1fns h SER 76 CO 0.57 0.63 -0.56 0.54 -0.87 0.00 0.00 176.83 177.13 1fns s ASN 77 N -6.61 0.92 0.16 4.97 4.22 -1.23 -3.76 114.94 113.61 1fns s ASN 77 Ca -0.09 -0.24 -0.31 0.00 -2.14 0.00 0.00 52.86 50.07 1fns s ASN 77 Cb 0.16 0.78 -0.11 0.00 1.28 0.00 0.00 41.25 43.36 1fns s ASN 77 CO 0.78 -0.34 1.73 -0.22 -2.04 0.00 0.00 177.10 177.01 1fns s LEU 78 N 2.45 4.38 0.19 3.54 2.96 0.18 -4.72 118.68 127.65 1fns s LEU 78 Ca 0.10 2.76 0.08 0.00 -0.22 0.00 0.00 54.13 56.85 1fns s LEU 78 Cb -0.15 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1fns s LEU 78 CO -0.22 -0.95 -0.00 -1.61 -1.32 0.00 0.00 176.35 172.25 1fns s GLU 79 N 1.82 2.37 0.26 1.98 0.41 -1.26 -0.55 118.70 123.74 1fns s GLU 79 Ca 0.76 -1.17 -0.01 0.00 -0.41 0.00 0.00 54.97 54.14 1fns s GLU 79 Cb -0.47 -2.32 0.56 0.00 -1.78 0.00 0.00 34.13 30.13 1fns s GLU 79 CO 0.33 0.44 1.72 -1.00 -0.49 0.00 0.00 175.26 176.26 1fns h PRO 80 N 2.56 0.43 0.00 0.39 0.13 -2.00 -0.15 132.00 133.36 1fns h PRO 80 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1fns h PRO 80 Cb 1.21 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1fns h PRO 80 CO 0.58 0.29 0.00 -0.85 -0.23 0.00 0.00 178.00 177.79 1fns n GLU 81 N -5.01 0.12 0.00 0.86 0.00 -1.26 -2.24 120.64 113.12 1fns n GLU 81 Ca 0.17 0.51 0.14 0.00 0.00 0.00 0.00 57.16 57.99 1fns n GLU 81 Cb 0.50 -1.82 0.63 0.00 0.00 0.00 0.00 31.44 30.75 1fns n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1fns n ASP 82 N -2.06 0.65 -4.62 -1.84 8.00 -0.07 -4.79 116.55 111.81 1fns n ASP 82 Ca 0.00 -0.86 -0.43 0.00 0.71 0.00 0.00 54.79 54.22 1fns n ASP 82 Cb 0.10 -0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.15 1fns n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1fns s ILE 83 N -2.30 3.73 0.05 0.53 -1.09 -0.95 -4.82 121.20 116.35 1fns s ILE 83 Ca 0.33 0.80 -0.16 0.00 -2.23 0.00 0.00 60.65 59.39 1fns s ILE 83 Cb 0.20 -3.81 0.05 0.00 -1.58 0.00 0.00 42.46 37.33 1fns s ILE 83 CO 0.43 -0.40 0.74 0.00 -1.23 0.00 0.00 174.94 174.48 1fns n ALA 84 N 8.76 -2.01 -2.79 9.38 0.00 -1.26 -4.43 120.51 128.16 1fns n ALA 84 Ca 0.19 -0.59 -0.34 0.00 0.00 0.00 0.00 53.44 52.70 1fns n ALA 84 Cb 0.46 0.24 -0.11 0.00 0.00 0.00 0.00 19.45 20.03 1fns n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fns s THR 85 N -2.16 3.96 -0.09 0.00 2.01 -0.15 -1.08 115.64 118.13 1fns s THR 85 Ca 0.17 -0.36 0.02 0.00 0.31 0.00 0.00 61.69 61.83 1fns s THR 85 Cb -0.01 -2.69 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 1fns s THR 85 CO 0.02 0.55 -0.15 -0.31 -0.69 0.00 0.00 174.62 174.03 1fns s TYR 86 N -0.23 2.73 -0.04 4.92 1.51 0.05 0.05 117.35 126.34 1fns s TYR 86 Ca 0.04 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.71 1fns s TYR 86 Cb -0.13 -1.73 -0.01 0.00 -0.11 0.00 0.00 41.96 39.99 1fns s TYR 86 CO 0.02 -0.04 -0.19 0.71 -1.11 0.00 0.00 175.55 174.94 1fns s TYR 87 N -0.17 1.84 0.39 2.71 2.02 -0.24 -0.98 117.35 122.93 1fns s TYR 87 Ca -0.01 -0.50 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 1fns s TYR 87 Cb -0.13 -1.22 -0.01 0.00 -0.40 0.00 0.00 41.96 40.20 1fns s TYR 87 CO 0.03 -0.15 0.58 0.00 -1.57 0.00 0.00 175.55 174.44 1fns s GLN 89 N -4.38 0.55 0.07 0.00 -0.44 -0.20 -0.79 119.66 114.48 1fns s GLN 89 Ca 0.46 0.94 0.01 0.00 -2.50 0.00 0.00 55.36 54.27 1fns s GLN 89 Cb -0.10 0.09 -0.04 0.00 -1.64 0.00 0.00 33.01 31.33 1fns s GLN 89 CO 0.35 -0.14 0.21 1.14 0.50 0.00 0.00 175.29 177.35 1fns s GLN 90 N 1.29 3.40 -0.07 1.67 1.03 -0.59 -1.07 119.66 125.32 1fns s GLN 90 Ca -0.08 -0.48 0.21 0.00 0.04 0.00 0.00 55.36 55.05 1fns s GLN 90 Cb -0.06 -3.01 0.43 0.00 0.03 0.00 0.00 33.01 30.40 1fns s GLN 90 CO -0.13 0.59 1.18 2.48 -2.54 0.00 0.00 175.29 176.88 1fns n TYR 91 N 0.19 0.07 -0.06 9.60 4.11 -0.38 -3.65 117.16 127.04 1fns n TYR 91 Ca -0.06 -0.87 -0.06 0.00 -0.00 0.00 0.00 57.90 56.92 1fns n TYR 91 Cb 0.51 -0.18 0.13 0.00 -0.00 0.00 0.00 39.34 39.80 1fns n TYR 91 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.86 178.35 1fns h GLU 92 N 1.06 0.69 -2.03 -3.48 4.57 -1.81 -3.46 114.58 110.12 1fns h GLU 92 Ca -0.15 -0.26 -0.05 0.00 -1.18 0.00 0.00 59.36 57.72 1fns h GLU 92 Cb 1.61 -0.04 -0.20 0.00 -0.16 0.00 0.00 28.75 29.96 1fns h GLU 92 CO 0.08 0.84 0.14 0.21 -1.18 0.00 0.00 179.01 179.10 1fns s LYS 93 N -4.62 0.92 0.47 1.92 2.20 -1.26 -5.13 119.74 114.23 1fns s LYS 93 Ca -0.09 0.68 -0.22 0.00 -0.36 0.00 0.00 55.97 55.98 1fns s LYS 93 Cb 0.13 0.44 -0.07 0.00 -1.51 0.00 0.00 37.83 36.82 1fns s LYS 93 CO 0.82 -0.19 1.13 -0.51 -0.36 0.00 0.00 175.35 176.24 1fns s LEU 94 N -0.28 3.96 0.48 5.43 1.43 -1.26 -4.14 118.68 124.31 1fns s LEU 94 Ca -0.05 2.21 -0.19 0.00 -1.03 0.00 0.00 54.13 55.08 1fns s LEU 94 Cb -0.03 -4.33 -0.09 0.00 0.03 0.00 0.00 46.19 41.77 1fns s LEU 94 CO 0.05 -0.90 0.98 -2.16 0.23 0.00 0.00 176.35 174.54 1fns s PRO 95 N -2.83 4.03 0.60 1.29 0.04 -1.26 -4.90 135.00 131.97 1fns s PRO 95 Ca 0.65 1.06 -0.19 0.00 0.04 0.00 0.00 61.00 62.56 1fns s PRO 95 Cb -0.26 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 1fns s PRO 95 CO 0.31 -0.21 1.28 -1.58 0.04 0.00 0.00 177.00 176.84 1fns s TRP 96 N -2.39 2.24 0.02 0.56 0.23 -1.26 -4.73 118.94 113.61 1fns s TRP 96 Ca 0.61 1.47 0.00 0.00 -2.03 0.00 0.00 56.10 56.15 1fns s TRP 96 Cb -0.10 -3.65 -0.02 0.00 0.03 0.00 0.00 33.47 29.73 1fns s TRP 96 CO 0.23 -2.68 -0.04 0.95 0.96 0.00 0.00 176.95 176.37 1fns s THR 97 N -1.43 0.19 0.18 2.01 -4.23 -1.24 -5.01 115.64 106.11 1fns s THR 97 Ca 0.78 -0.92 0.08 0.00 -1.18 0.00 0.00 61.69 60.45 1fns s THR 97 Cb -0.36 -0.32 -0.04 0.00 1.34 0.00 0.00 72.50 73.12 1fns s THR 97 CO 0.39 -0.46 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.61 1fns s PHE 98 N -1.40 2.76 0.95 3.99 0.40 -1.26 -1.54 117.98 121.87 1fns s PHE 98 Ca -0.14 -0.17 -0.12 0.00 -0.60 0.00 0.00 56.93 55.89 1fns s PHE 98 Cb -0.10 -1.34 0.16 0.00 0.51 0.00 0.00 43.02 42.25 1fns s PHE 98 CO -0.01 0.51 1.10 0.20 0.70 0.00 0.00 175.22 177.73 1fns s GLY 99 N -2.88 1.58 0.00 4.36 0.00 0.03 -4.54 107.32 105.87 1fns s GLY 99 Ca 0.26 -0.32 0.30 0.00 0.00 0.00 0.00 44.72 44.96 1fns s GLY 99 CO 0.17 0.24 2.12 0.61 0.00 0.00 0.00 173.10 176.25 1fns n GLY 100 N -1.38 -0.94 0.00 0.20 0.00 -1.26 -4.72 105.19 97.09 1fns n GLY 100 Ca 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1fns n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fns n GLY 101 N 0.88 0.16 2.80 -0.02 0.00 -1.26 -5.03 105.19 102.73 1fns n GLY 101 Ca 0.22 -1.52 -0.28 0.00 0.00 0.00 0.00 46.02 44.45 1fns n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fns s THR 102 N -2.37 0.80 -0.26 2.61 2.01 -0.15 -4.27 115.64 114.01 1fns s THR 102 Ca 0.00 -0.66 -0.14 0.00 0.31 0.00 0.00 61.69 61.21 1fns s THR 102 Cb 0.00 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 1fns s THR 102 CO 0.00 -0.11 0.31 -0.75 -0.69 0.00 0.00 174.62 173.38 1fns s LYS 103 N 1.74 4.04 0.36 4.92 2.20 -0.08 -0.77 119.74 132.15 1fns s LYS 103 Ca -0.01 -0.05 -0.24 0.00 -0.36 0.00 0.00 55.97 55.31 1fns s LYS 103 Cb -0.17 -3.62 -0.10 0.00 -1.51 0.00 0.00 37.83 32.43 1fns s LYS 103 CO -0.07 -0.17 0.95 -0.51 -0.36 0.00 0.00 175.35 175.19 1fns s LEU 104 N 1.73 4.19 0.03 5.43 1.43 -0.24 -1.54 118.68 129.72 1fns s LEU 104 Ca 0.13 1.80 0.01 0.00 -1.03 0.00 0.00 54.13 55.04 1fns s LEU 104 Cb -0.15 -4.20 -0.02 0.00 0.03 0.00 0.00 46.19 41.84 1fns s LEU 104 CO 0.09 -0.19 -0.06 -0.70 0.23 0.00 0.00 176.35 175.72 1fns s GLU 105 N -2.46 0.43 -0.11 1.70 2.12 -0.28 -4.40 118.70 115.70 1fns s GLU 105 Ca 0.55 -0.67 -0.16 0.00 0.36 0.00 0.00 54.97 55.04 1fns s GLU 105 Cb -0.15 -0.14 -0.05 0.00 0.26 0.00 0.00 34.13 34.05 1fns s GLU 105 CO 0.20 0.01 0.41 0.08 -0.54 0.00 0.00 175.26 175.43 1fns s VAL 106 N -1.34 5.19 0.40 3.70 1.01 -1.26 -1.25 120.40 126.85 1fns s VAL 106 Ca -0.12 0.81 -0.23 0.00 0.00 0.00 0.00 61.98 62.44 1fns s VAL 106 Cb -0.10 -3.74 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 1fns s VAL 106 CO -0.00 0.39 1.02 -0.54 0.00 0.00 0.00 175.10 175.97 1fns s LYS 107 N 0.26 4.20 0.28 2.72 1.02 -0.04 -4.88 119.74 123.31 1fns s LYS 107 Ca 0.23 1.41 -0.13 0.00 0.02 0.00 0.00 55.97 57.49 1fns s LYS 107 Cb -0.15 -2.48 0.01 0.00 -0.52 0.00 0.00 37.83 34.69 1fns s LYS 107 CO 0.09 -0.09 0.56 -0.98 -0.92 0.00 0.00 175.35 174.01 1fns s ARG 108 N -2.60 1.72 0.42 1.68 1.70 -1.26 -4.92 118.95 115.69 1fns s ARG 108 Ca 0.58 -1.30 -0.26 0.00 -0.47 0.00 0.00 55.73 54.28 1fns s ARG 108 Cb -0.19 0.51 -0.09 0.00 -0.57 0.00 0.00 34.95 34.61 1fns s ARG 108 CO 0.24 -0.74 1.35 0.00 -1.08 0.00 0.00 175.30 175.06 1fns s ALA 109 N -3.66 3.27 0.48 7.88 0.00 -1.26 -4.94 121.76 123.52 1fns s ALA 109 Ca 0.21 1.31 -0.23 0.00 0.00 0.00 0.00 51.96 53.25 1fns s ALA 109 Cb -0.02 -3.52 -0.08 0.00 0.00 0.00 0.00 23.12 19.50 1fns s ALA 109 CO 0.11 -0.94 1.16 -0.25 0.00 0.00 0.00 175.76 175.83 1fns n ASP 110 N 0.05 1.89 -3.75 0.00 8.00 -1.26 -4.82 116.55 116.67 1fns n ASP 110 Ca 0.04 1.01 -0.14 0.00 0.71 0.00 0.00 54.79 56.41 1fns n ASP 110 Cb 0.43 -1.45 -0.14 0.00 -0.02 0.00 0.00 41.12 39.93 1fns n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fns s ALA 111 N -1.30 -0.28 0.50 2.24 0.00 0.54 -4.91 121.76 118.57 1fns s ALA 111 Ca 0.66 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 53.12 1fns s ALA 111 Cb -0.49 -0.46 -0.08 0.00 0.00 0.00 0.00 23.12 22.09 1fns s ALA 111 CO 0.54 -0.16 1.04 0.00 0.00 0.00 0.00 175.76 177.18 1fns s ALA 112 N 1.18 2.86 0.51 0.00 0.00 -1.26 -0.85 121.76 124.19 1fns s ALA 112 Ca -0.09 0.56 -0.20 0.00 0.00 0.00 0.00 51.96 52.23 1fns s ALA 112 Cb -0.12 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 1fns s ALA 112 CO -0.06 -0.39 1.07 -1.25 0.00 0.00 0.00 175.76 175.13 1fns s PRO 113 N -3.39 3.65 -0.33 0.00 0.04 -1.26 -4.53 135.00 129.18 1fns s PRO 113 Ca 0.66 1.44 -0.16 0.00 0.04 0.00 0.00 61.00 62.99 1fns s PRO 113 Cb -0.16 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.30 1fns s PRO 113 CO 0.23 -0.57 0.39 0.99 0.04 0.00 0.00 177.00 178.08 1fns s THR 114 N -1.91 5.14 -0.13 1.26 2.01 0.04 -4.83 115.64 117.22 1fns s THR 114 Ca 0.69 0.19 -0.05 0.00 0.31 0.00 0.00 61.69 62.83 1fns s THR 114 Cb -0.19 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 1fns s THR 114 CO 0.22 -0.07 0.04 -0.69 -0.69 0.00 0.00 174.62 173.43 1fns s VAL 115 N 2.09 4.60 -0.00 3.82 1.01 -1.26 -1.01 120.40 129.65 1fns s VAL 115 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1fns s VAL 115 Cb -0.16 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1fns s VAL 115 CO 0.12 0.55 -0.01 -0.44 0.00 0.00 0.00 175.10 175.32 1fns s SER 116 N -0.36 0.09 0.08 3.32 0.01 -0.71 -4.97 113.70 111.17 1fns s SER 116 Ca 0.08 -0.01 0.10 0.00 1.31 0.00 0.00 55.95 57.43 1fns s SER 116 Cb -0.12 -0.01 -0.03 0.00 0.21 0.00 0.00 66.02 66.06 1fns s SER 116 CO 0.02 0.00 -0.26 -0.51 0.41 0.00 0.00 173.24 172.90 1fns s ILE 117 N 0.03 2.14 -0.07 1.44 2.07 -1.26 -1.18 121.20 124.37 1fns s ILE 117 Ca -0.00 -1.54 0.00 0.00 -1.41 0.00 0.00 60.65 57.71 1fns s ILE 117 Cb -0.01 -1.86 0.02 0.00 0.13 0.00 0.00 42.46 40.74 1fns s ILE 117 CO -0.00 0.23 -0.06 -0.36 -1.91 0.00 0.00 174.94 172.83 1fns s PHE 118 N -0.92 1.10 0.86 3.50 0.40 0.96 -5.00 117.98 118.87 1fns s PHE 118 Ca 0.12 -0.42 -0.11 0.00 -0.60 0.00 0.00 56.93 55.91 1fns s PHE 118 Cb -0.10 -0.94 0.11 0.00 0.51 0.00 0.00 43.02 42.60 1fns s PHE 118 CO 0.04 -0.33 1.09 -2.14 0.70 0.00 0.00 175.22 174.58 1fns s PRO 119 N 1.28 1.55 0.49 0.24 0.02 -1.26 -1.70 135.00 135.61 1fns s PRO 119 Ca -0.04 0.77 -0.24 0.00 0.02 0.00 0.00 61.00 61.51 1fns s PRO 119 Cb -0.14 -1.85 -0.07 0.00 0.02 0.00 0.00 34.50 32.47 1fns s PRO 119 CO -0.02 -2.03 1.38 -2.14 -0.33 0.00 0.00 177.00 173.86 1fns s PRO 120 N -5.00 3.48 0.69 5.54 0.02 -1.15 -4.81 135.00 133.76 1fns s PRO 120 Ca 0.62 2.30 -0.12 0.00 0.02 0.00 0.00 61.00 63.82 1fns s PRO 120 Cb -0.17 -2.48 0.01 0.00 0.02 0.00 0.00 34.50 31.88 1fns s PRO 120 CO 0.56 -0.94 1.07 -1.54 -0.33 0.00 0.00 177.00 175.82 1fns s SER 121 N -0.75 5.17 0.33 2.53 1.04 -1.26 -4.91 113.70 115.85 1fns s SER 121 Ca 0.65 1.77 0.06 0.00 0.48 0.00 0.00 55.95 58.91 1fns s SER 121 Cb -0.41 -2.52 0.57 0.00 0.10 0.00 0.00 66.02 63.76 1fns s SER 121 CO 0.51 -1.59 1.80 0.77 0.98 0.00 0.00 173.24 175.72 1fns h SER 122 N -0.51 0.34 -0.08 7.02 4.64 -1.99 -2.28 113.55 120.68 1fns h SER 122 Ca -0.45 -0.10 0.01 0.00 -0.47 0.00 0.00 61.79 60.78 1fns h SER 122 Cb 1.22 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 1fns h SER 122 CO 0.55 0.57 0.01 -0.33 -0.87 0.00 0.00 176.83 176.76 1fns h GLU 123 N 0.31 0.05 -0.82 4.77 5.08 -1.99 -1.47 114.58 120.51 1fns h GLU 123 Ca 0.05 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1fns h GLU 123 Cb 0.56 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 1fns h GLU 123 CO 0.04 0.03 0.42 0.37 -1.00 0.00 0.00 179.01 178.87 1fns h GLN 124 N 0.05 1.17 -1.00 2.33 4.15 -1.82 -2.24 115.11 117.74 1fns h GLN 124 Ca 0.03 -0.16 0.06 0.00 0.77 0.00 0.00 58.65 59.36 1fns h GLN 124 Cb 0.03 -0.22 -0.07 0.00 0.21 0.00 0.00 27.48 27.43 1fns h GLN 124 CO -0.05 0.88 0.65 -0.07 -1.93 0.00 0.00 178.83 178.32 1fns h LEU 125 N 1.15 1.05 -1.90 -2.39 3.38 -0.92 -1.06 115.31 114.62 1fns h LEU 125 Ca 0.28 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.34 1fns h LEU 125 Cb 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1fns h LEU 125 CO -0.04 0.68 0.44 0.74 0.09 0.00 0.00 178.44 180.35 1fns h THR 126 N 1.19 0.21 -0.65 0.22 2.02 -0.64 0.27 112.91 115.54 1fns h THR 126 Ca 0.43 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.61 1fns h THR 126 Cb 0.14 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1fns h THR 126 CO -0.16 0.00 0.00 -1.54 0.37 0.00 0.00 175.52 174.19 1fns n SER 127 N -3.36 3.80 0.00 4.18 3.41 -0.41 -4.94 113.62 116.30 1fns n SER 127 Ca 0.04 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.66 1fns n SER 127 Cb 0.57 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1fns n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fns n GLY 128 N 1.54 0.57 3.68 5.00 0.00 0.96 -5.04 105.19 111.91 1fns n GLY 128 Ca 0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 1fns n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fns s GLY 129 N -2.00 1.71 -0.30 -0.02 0.00 -1.13 -1.88 107.32 103.70 1fns s GLY 129 Ca 0.00 -1.38 0.01 0.00 0.00 0.00 0.00 44.72 43.35 1fns s GLY 129 CO 0.00 -1.40 0.33 0.00 0.00 0.00 0.00 173.10 172.03 1fns s ALA 130 N -1.80 -0.65 -0.16 3.20 0.00 -0.57 -3.14 121.76 118.65 1fns s ALA 130 Ca 0.28 -0.26 -0.07 0.00 0.00 0.00 0.00 51.96 51.91 1fns s ALA 130 Cb -0.09 -1.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 1fns s ALA 130 CO 0.19 -1.77 0.09 -1.12 0.00 0.00 0.00 175.76 173.15 1fns s SER 131 N 2.30 5.93 -0.18 0.00 0.01 -1.26 -1.10 113.70 119.41 1fns s SER 131 Ca 0.10 0.23 -0.05 0.00 1.31 0.00 0.00 55.95 57.55 1fns s SER 131 Cb -0.14 -1.96 -0.03 0.00 0.21 0.00 0.00 66.02 64.10 1fns s SER 131 CO -0.29 0.27 -0.01 -0.69 0.41 0.00 0.00 173.24 172.92 1fns s VAL 132 N -0.17 4.01 -0.07 3.43 1.01 0.96 -2.94 120.40 126.63 1fns s VAL 132 Ca 0.09 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.78 1fns s VAL 132 Cb -0.12 -2.79 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1fns s VAL 132 CO 0.01 0.46 -0.12 -0.69 0.00 0.00 0.00 175.10 174.76 1fns s VAL 133 N 0.65 3.27 -0.06 2.92 1.01 -0.69 -0.78 120.40 126.71 1fns s VAL 133 Ca -0.01 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1fns s VAL 133 Cb -0.14 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 33.94 1fns s VAL 133 CO 0.02 0.58 -0.07 0.00 0.00 0.00 0.00 175.10 175.63 1fns s PHE 135 N 1.07 3.07 -0.31 0.00 0.08 -0.33 -0.56 117.98 121.01 1fns s PHE 135 Ca -0.08 0.01 0.02 0.00 0.12 0.00 0.00 56.93 57.00 1fns s PHE 135 Cb -0.14 -1.84 0.09 0.00 -0.57 0.00 0.00 43.02 40.56 1fns s PHE 135 CO -0.01 0.28 0.03 -0.51 -0.10 0.00 0.00 175.22 174.91 1fns s LEU 136 N -0.44 3.59 0.03 -0.37 1.02 0.56 -1.74 118.68 121.34 1fns s LEU 136 Ca 0.07 -1.79 0.04 0.00 0.02 0.00 0.00 54.13 52.48 1fns s LEU 136 Cb -0.12 -1.33 -0.04 0.00 0.02 0.00 0.00 46.19 44.72 1fns s LEU 136 CO 0.02 -0.35 -0.07 0.20 0.02 0.00 0.00 176.35 176.17 1fns s ASN 137 N 1.20 4.57 -1.23 2.29 0.01 -0.18 -0.67 114.94 120.93 1fns s ASN 137 Ca 0.06 -0.21 -0.04 0.00 -0.71 0.00 0.00 52.86 51.96 1fns s ASN 137 Cb -0.19 -1.01 -0.01 0.00 0.41 0.00 0.00 41.25 40.45 1fns s ASN 137 CO -0.12 0.25 0.78 0.59 -1.51 0.00 0.00 177.10 177.09 1fns n ASN 138 N 1.30 -2.72 -4.84 -1.22 4.13 -0.83 -0.78 115.26 110.29 1fns n ASN 138 Ca -0.15 -0.81 -0.21 0.00 1.68 0.00 0.00 54.58 55.09 1fns n ASN 138 Cb 0.52 -4.26 -0.04 0.00 -1.54 0.00 0.00 39.78 34.47 1fns n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1fns s PHE 139 N -3.56 2.75 -0.28 3.10 -0.71 0.09 -4.61 117.98 114.76 1fns s PHE 139 Ca 0.14 -0.44 -0.21 0.00 -1.04 0.00 0.00 56.93 55.38 1fns s PHE 139 Cb -0.04 -2.00 0.10 0.00 -1.21 0.00 0.00 43.02 39.87 1fns s PHE 139 CO 0.80 0.03 0.82 -0.47 -1.34 0.00 0.00 175.22 175.06 1fns s TYR 140 N -2.44 -0.77 1.11 3.49 5.04 -0.03 -1.24 117.35 122.51 1fns s TYR 140 Ca 0.45 1.70 -0.18 0.00 -2.44 0.00 0.00 57.07 56.60 1fns s TYR 140 Cb -0.03 0.41 0.25 0.00 0.35 0.00 0.00 41.96 42.94 1fns s TYR 140 CO 0.27 -0.37 1.17 -1.25 -1.34 0.00 0.00 175.55 174.02 1fns s PRO 141 N 0.86 -0.48 0.57 4.97 0.04 -1.26 -0.34 135.00 139.36 1fns s PRO 141 Ca -0.04 -0.11 0.37 0.00 0.04 0.00 0.00 61.00 61.27 1fns s PRO 141 Cb -0.05 -1.69 1.75 0.00 0.04 0.00 0.00 34.50 34.56 1fns s PRO 141 CO -0.09 -3.21 2.11 1.57 0.04 0.00 0.00 177.00 177.42 1fns h LYS 142 N -2.22 0.00 -6.36 4.56 2.10 -1.97 -3.44 116.57 109.24 1fns h LYS 142 Ca -0.46 0.00 -0.55 0.00 -2.00 0.00 0.00 60.65 57.65 1fns h LYS 142 Cb 1.28 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.61 1fns h LYS 142 CO 0.38 0.00 0.80 -0.51 -2.00 0.00 0.00 179.45 178.13 1fns s ASP 143 N -5.36 6.89 0.05 7.07 1.01 -1.26 -4.98 116.67 120.09 1fns s ASP 143 Ca -0.01 2.05 -0.22 0.00 0.71 0.00 0.00 52.55 55.08 1fns s ASP 143 Cb 0.10 -2.56 0.05 0.00 1.01 0.00 0.00 42.92 41.52 1fns s ASP 143 CO 0.47 -0.69 0.51 -0.51 0.21 0.00 0.00 175.17 175.16 1fns s ILE 144 N 2.36 0.03 -0.01 0.77 2.07 -1.26 -4.63 121.20 120.54 1fns s ILE 144 Ca 0.62 -0.27 0.03 0.00 -1.41 0.00 0.00 60.65 59.63 1fns s ILE 144 Cb -0.30 -0.97 -0.01 0.00 0.13 0.00 0.00 42.46 41.31 1fns s ILE 144 CO 0.25 -0.15 -0.11 0.21 -1.91 0.00 0.00 174.94 173.24 1fns s ASN 145 N -1.96 1.29 -0.07 4.50 2.47 -0.67 -4.97 114.94 115.52 1fns s ASN 145 Ca -0.05 -0.20 0.06 0.00 0.42 0.00 0.00 52.86 53.08 1fns s ASN 145 Cb -0.01 -0.14 -0.01 0.00 -1.45 0.00 0.00 41.25 39.64 1fns s ASN 145 CO -0.02 0.13 -0.25 -0.69 -3.72 0.00 0.00 177.10 172.56 1fns s VAL 146 N -0.26 2.06 -0.04 -5.21 1.01 -1.26 -0.42 120.40 116.29 1fns s VAL 146 Ca 0.04 -1.05 0.05 0.00 0.00 0.00 0.00 61.98 61.02 1fns s VAL 146 Cb -0.04 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 1fns s VAL 146 CO -0.00 0.57 -0.18 -0.75 0.00 0.00 0.00 175.10 174.73 1fns s LYS 147 N -0.05 1.75 0.01 2.72 2.20 0.66 -4.96 119.74 122.06 1fns s LYS 147 Ca -0.07 -0.64 0.02 0.00 -0.36 0.00 0.00 55.97 54.91 1fns s LYS 147 Cb -0.15 -1.56 -0.04 0.00 -1.51 0.00 0.00 37.83 34.58 1fns s LYS 147 CO 0.05 0.30 0.00 -1.58 -0.36 0.00 0.00 175.35 173.76 1fns s TRP 148 N -0.12 3.07 -0.01 4.03 0.52 -1.26 0.27 118.94 125.45 1fns s TRP 148 Ca -0.01 0.07 0.01 0.00 0.02 0.00 0.00 56.10 56.20 1fns s TRP 148 Cb -0.10 -1.66 0.00 0.00 -1.15 0.00 0.00 33.47 30.56 1fns s TRP 148 CO 0.01 0.46 -0.05 0.15 0.02 0.00 0.00 176.95 177.55 1fns s LYS 149 N -1.63 0.48 -0.16 4.98 1.02 -0.70 -0.88 119.74 122.86 1fns s LYS 149 Ca 0.20 -0.16 -0.01 0.00 0.02 0.00 0.00 55.97 56.03 1fns s LYS 149 Cb -0.12 -0.49 -0.00 0.00 -0.52 0.00 0.00 37.83 36.70 1fns s LYS 149 CO 0.11 0.07 -0.13 0.42 -0.92 0.00 0.00 175.35 174.90 1fns s ILE 150 N 0.12 2.84 -1.47 2.17 1.01 0.52 -1.12 121.20 125.27 1fns s ILE 150 Ca -0.01 -0.71 -0.01 0.00 0.00 0.00 0.00 60.65 59.92 1fns s ILE 150 Cb -0.05 -2.22 0.00 0.00 0.01 0.00 0.00 42.46 40.20 1fns s ILE 150 CO -0.00 0.50 0.22 0.47 0.00 0.00 0.00 174.94 176.13 1fns n ASP 151 N 4.09 0.16 0.00 3.58 10.43 0.59 -0.53 116.55 134.87 1fns n ASP 151 Ca -0.19 -1.15 0.00 0.00 2.57 0.00 0.00 54.79 56.02 1fns n ASP 151 Cb 0.52 -2.31 0.00 0.00 1.84 0.00 0.00 41.12 41.16 1fns n ASP 151 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1fns n GLY 152 N -2.28 3.00 3.67 0.44 0.00 -1.26 -5.00 105.19 103.75 1fns n GLY 152 Ca -0.31 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 1fns n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fns s SER 153 N -3.12 5.85 0.40 1.61 0.01 0.31 -5.00 113.70 113.76 1fns s SER 153 Ca 0.00 0.13 -0.27 0.00 1.31 0.00 0.00 55.95 57.12 1fns s SER 153 Cb 0.00 -2.01 -0.10 0.00 0.21 0.00 0.00 66.02 64.11 1fns s SER 153 CO 0.00 0.17 1.37 1.21 0.41 0.00 0.00 173.24 176.39 1fns n GLU 154 N 3.59 2.23 -4.36 12.44 2.13 -1.26 -0.36 120.64 135.06 1fns n GLU 154 Ca -0.16 0.79 -0.27 0.00 0.66 0.00 0.00 57.16 58.18 1fns n GLU 154 Cb 0.52 -2.50 -0.17 0.00 0.27 0.00 0.00 31.44 29.56 1fns n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1fns s ARG 155 N -2.18 1.90 -0.11 5.31 6.06 -0.06 -4.84 118.95 125.04 1fns s ARG 155 Ca 0.58 -0.45 0.09 0.00 -2.50 0.00 0.00 55.73 53.45 1fns s ARG 155 Cb -0.50 -1.67 -0.13 0.00 0.06 0.00 0.00 34.95 32.71 1fns s ARG 155 CO 0.60 -0.08 0.02 1.04 -2.50 0.00 0.00 175.30 174.38 1fns n GLN 156 N 4.26 2.08 -2.53 5.12 6.02 -1.26 -4.37 117.38 126.69 1fns n GLN 156 Ca -0.19 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.44 1fns n GLN 156 Cb 0.51 -1.27 -0.04 0.00 1.02 0.00 0.00 30.24 30.46 1fns n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1fns s ASN 157 N -4.41 6.70 0.00 1.08 -0.87 -1.26 -3.93 114.94 112.25 1fns s ASN 157 Ca -0.06 2.04 0.00 0.00 -1.57 0.00 0.00 52.86 53.26 1fns s ASN 157 Cb 0.03 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.68 1fns s ASN 157 CO 0.43 -0.53 0.00 0.61 -2.57 0.00 0.00 177.10 175.03 1fns n GLY 158 N 0.28 0.64 3.67 0.66 0.00 -1.26 -4.86 105.19 104.31 1fns n GLY 158 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1fns n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fns s VAL 159 N -2.34 5.35 -0.10 1.61 1.01 -1.25 -1.17 120.40 123.50 1fns s VAL 159 Ca 0.00 0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.25 1fns s VAL 159 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.86 1fns s VAL 159 CO 0.00 0.34 -0.23 -0.76 0.00 0.00 0.00 175.10 174.45 1fns s LEU 160 N 1.03 2.08 0.10 3.92 1.43 0.05 -4.96 118.68 122.32 1fns s LEU 160 Ca 0.09 -0.56 0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1fns s LEU 160 Cb -0.13 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1fns s LEU 160 CO 0.04 0.15 -0.06 0.20 0.23 0.00 0.00 176.35 176.91 1fns s ASN 161 N 0.41 4.67 -0.07 2.29 0.01 -1.26 -0.97 114.94 120.03 1fns s ASN 161 Ca -0.17 -0.29 -0.05 0.00 -0.71 0.00 0.00 52.86 51.63 1fns s ASN 161 Cb -0.18 -1.00 0.03 0.00 0.41 0.00 0.00 41.25 40.51 1fns s ASN 161 CO 0.07 0.18 0.17 -0.55 -1.51 0.00 0.00 177.10 175.46 1fns s SER 162 N -2.25 -0.17 -0.05 -1.22 0.15 -0.32 -4.99 113.70 104.85 1fns s SER 162 Ca 0.23 0.35 0.06 0.00 0.70 0.00 0.00 55.95 57.29 1fns s SER 162 Cb -0.11 0.31 -0.02 0.00 -1.71 0.00 0.00 66.02 64.49 1fns s SER 162 CO 0.16 -0.10 -0.21 0.26 1.20 0.00 0.00 173.24 174.55 1fns s TRP 163 N 0.52 2.50 0.52 3.44 0.51 -1.26 -0.07 118.94 125.11 1fns s TRP 163 Ca -0.04 -0.46 -0.05 0.00 -2.12 0.00 0.00 56.10 53.43 1fns s TRP 163 Cb -0.05 -1.59 -0.01 0.00 -0.81 0.00 0.00 33.47 31.00 1fns s TRP 163 CO -0.03 -0.04 0.82 0.95 -0.51 0.00 0.00 176.95 178.14 1fns s THR 164 N -0.43 4.27 0.65 2.01 -4.23 -0.53 -5.01 115.64 112.37 1fns s THR 164 Ca 0.05 0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.48 1fns s THR 164 Cb -0.12 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 70.05 1fns s THR 164 CO 0.01 -0.63 1.04 -0.62 -0.54 0.00 0.00 174.62 173.89 1fns s ASP 165 N -4.20 5.92 0.21 3.99 2.15 -1.26 -4.53 116.67 118.94 1fns s ASP 165 Ca 0.50 1.49 -0.31 0.00 0.43 0.00 0.00 52.55 54.66 1fns s ASP 165 Cb -0.10 -2.48 -0.15 0.00 -0.30 0.00 0.00 42.92 39.89 1fns s ASP 165 CO 0.44 -1.08 1.17 1.67 -0.17 0.00 0.00 175.17 177.21 1fns n GLN 166 N -2.89 1.36 -2.43 4.34 7.27 -1.26 -4.80 117.38 118.97 1fns n GLN 166 Ca 0.07 0.48 -0.43 0.00 0.07 0.00 0.00 57.00 57.19 1fns n GLN 166 Cb 0.54 -1.98 -0.02 0.00 2.41 0.00 0.00 30.24 31.18 1fns n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1fns s ASP 167 N -0.07 6.98 0.24 1.69 -1.08 0.15 -4.91 116.67 119.68 1fns s ASP 167 Ca 0.69 1.76 -0.04 0.00 -0.52 0.00 0.00 52.55 54.44 1fns s ASP 167 Cb -0.78 -2.55 0.41 0.00 -1.46 0.00 0.00 42.92 38.54 1fns s ASP 167 CO 0.53 -0.68 1.79 -1.28 0.52 0.00 0.00 175.17 176.05 1fns h SER 168 N 7.88 0.61 -0.01 -0.34 0.87 -1.89 0.22 113.55 120.88 1fns h SER 168 Ca -0.30 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.30 1fns h SER 168 Cb 1.13 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1fns h SER 168 CO 0.93 0.33 -0.05 0.11 -0.53 0.00 0.00 176.83 177.62 1fns h LYS 169 N 0.72 0.05 -0.33 2.24 1.57 -1.98 -3.37 116.57 115.47 1fns h LYS 169 Ca 0.40 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1fns h LYS 169 Cb 0.42 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1fns h LYS 169 CO -0.27 0.72 0.00 -0.40 -0.57 0.00 0.00 179.45 178.92 1fns n ASP 170 N -4.71 2.88 -1.54 0.86 5.68 -1.22 -4.99 116.55 113.51 1fns n ASP 170 Ca -0.09 -1.96 -0.19 0.00 -0.50 0.00 0.00 54.79 52.05 1fns n ASP 170 Cb 0.36 -0.22 -0.08 0.00 -1.14 0.00 0.00 41.12 40.04 1fns n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1fns n SER 171 N 0.55 -5.15 -5.00 -1.12 7.64 0.76 -4.98 113.62 106.32 1fns n SER 171 Ca 0.12 0.47 -0.18 0.00 1.01 0.00 0.00 58.87 60.29 1fns n SER 171 Cb 0.42 -4.55 0.03 0.00 -1.01 0.00 0.00 64.21 59.10 1fns n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1fns s THR 172 N -2.62 2.67 0.24 0.44 -4.23 -1.26 -4.68 115.64 106.20 1fns s THR 172 Ca 0.00 -0.96 0.10 0.00 -1.18 0.00 0.00 61.69 59.66 1fns s THR 172 Cb 0.00 -2.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.08 1fns s THR 172 CO 0.00 0.00 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.58 1fns s TYR 173 N -2.51 2.09 0.06 3.99 2.02 -0.38 0.34 117.35 122.96 1fns s TYR 173 Ca 0.58 -0.41 -0.00 0.00 -0.37 0.00 0.00 57.07 56.86 1fns s TYR 173 Cb -0.08 -0.95 -0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1fns s TYR 173 CO 0.36 0.56 -0.04 -1.12 -1.57 0.00 0.00 175.55 173.73 1fns s SER 174 N -3.26 0.67 -0.01 2.29 0.01 -1.26 -0.73 113.70 111.41 1fns s SER 174 Ca 0.25 -0.97 -0.11 0.00 1.31 0.00 0.00 55.95 56.44 1fns s SER 174 Cb -0.04 0.16 0.01 0.00 0.21 0.00 0.00 66.02 66.36 1fns s SER 174 CO 0.11 -0.54 0.22 -0.32 0.41 0.00 0.00 173.24 173.12 1fns s MET 175 N -3.72 0.56 0.01 12.44 1.75 0.16 -1.45 119.30 129.04 1fns s MET 175 Ca 0.07 -0.29 0.09 0.00 -1.25 0.00 0.00 55.69 54.31 1fns s MET 175 Cb 0.06 0.24 -0.02 0.00 2.84 0.00 0.00 34.83 37.95 1fns s MET 175 CO -0.08 -0.14 -0.26 0.45 -0.65 0.00 0.00 175.02 174.34 1fns s SER 176 N -1.31 3.12 -0.05 1.11 0.15 0.91 -0.32 113.70 117.30 1fns s SER 176 Ca -0.14 -0.52 -0.01 0.00 0.70 0.00 0.00 55.95 55.98 1fns s SER 176 Cb -0.06 -0.32 0.03 0.00 -1.71 0.00 0.00 66.02 63.95 1fns s SER 176 CO 0.03 0.29 0.02 -0.55 1.20 0.00 0.00 173.24 174.23 1fns s SER 177 N -0.91 1.15 -0.12 5.45 0.15 0.28 -1.17 113.70 118.52 1fns s SER 177 Ca 0.11 -0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.76 1fns s SER 177 Cb -0.10 -0.29 0.01 0.00 -1.71 0.00 0.00 66.02 63.94 1fns s SER 177 CO 0.00 -0.19 -0.17 -0.89 1.20 0.00 0.00 173.24 173.20 1fns s THR 178 N 1.79 1.67 -0.30 6.45 2.01 -0.14 -0.67 115.64 126.46 1fns s THR 178 Ca 0.01 -0.74 -0.09 0.00 0.31 0.00 0.00 61.69 61.18 1fns s THR 178 Cb -0.12 -1.52 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 1fns s THR 178 CO -0.04 0.48 0.13 -0.22 -0.69 0.00 0.00 174.62 174.28 1fns s LEU 179 N 0.99 3.95 -0.16 4.42 2.96 0.04 -0.77 118.68 130.10 1fns s LEU 179 Ca -0.06 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.37 1fns s LEU 179 Cb -0.15 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1fns s LEU 179 CO -0.03 -0.15 -0.03 -0.89 -1.32 0.00 0.00 176.35 173.93 1fns s THR 180 N 1.61 3.92 0.24 3.68 2.01 -0.32 -0.03 115.64 126.76 1fns s THR 180 Ca 0.05 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 61.72 1fns s THR 180 Cb -0.17 -2.73 -0.05 0.00 0.01 0.00 0.00 72.50 69.56 1fns s THR 180 CO 0.06 0.48 0.06 -0.76 -0.69 0.00 0.00 174.62 173.77 1fns s LEU 181 N 0.47 1.83 0.57 4.42 1.02 -0.26 -4.69 118.68 122.04 1fns s LEU 181 Ca -0.03 -1.32 -0.12 0.00 0.02 0.00 0.00 54.13 52.68 1fns s LEU 181 Cb -0.14 -0.06 -0.05 0.00 0.02 0.00 0.00 46.19 45.96 1fns s LEU 181 CO 0.03 -0.67 0.99 0.42 0.02 0.00 0.00 176.35 177.14 1fns s THR 182 N -3.66 4.69 0.25 5.49 -4.23 -1.26 -1.50 115.64 115.41 1fns s THR 182 Ca 0.34 0.89 -0.03 0.00 -1.18 0.00 0.00 61.69 61.71 1fns s THR 182 Cb 0.07 -3.83 0.23 0.00 1.34 0.00 0.00 72.50 70.32 1fns s THR 182 CO 0.11 -0.98 1.83 0.50 -0.54 0.00 0.00 174.62 175.55 1fns h LYS 183 N 0.11 0.89 -0.49 3.99 3.64 -1.61 -0.94 116.57 122.16 1fns h LYS 183 Ca -0.45 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 58.80 1fns h LYS 183 Cb 1.19 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.79 1fns h LYS 183 CO 0.62 0.59 -0.00 -0.44 -2.27 0.00 0.00 179.45 177.94 1fns h ASP 184 N 0.92 0.85 -0.46 4.20 3.45 -1.93 0.23 116.42 123.68 1fns h ASP 184 Ca 0.41 -0.31 -0.08 0.00 0.43 0.00 0.00 57.03 57.48 1fns h ASP 184 Cb 0.31 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 38.83 1fns h ASP 184 CO -0.22 0.95 -0.01 -0.08 -1.57 0.00 0.00 179.24 178.31 1fns h GLU 185 N 0.73 0.83 -0.46 3.56 4.81 -1.89 -0.84 114.58 121.31 1fns h GLU 185 Ca 0.14 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1fns h GLU 185 Cb 0.52 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 1fns h GLU 185 CO 0.03 0.88 0.27 -0.92 -0.73 0.00 0.00 179.01 178.54 1fns h TYR 186 N 0.68 0.61 0.00 0.92 5.03 -0.95 -1.05 116.97 122.21 1fns h TYR 186 Ca 0.13 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.44 1fns h TYR 186 Cb 0.52 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.60 1fns h TYR 186 CO 0.04 0.43 0.00 0.39 -1.32 0.00 0.00 178.16 177.70 1fns n GLU 187 N -4.72 0.38 0.00 1.82 1.02 0.81 -2.17 120.64 117.78 1fns n GLU 187 Ca 0.01 0.07 0.13 0.00 -0.02 0.00 0.00 57.16 57.36 1fns n GLU 187 Cb 0.06 -1.50 0.47 0.00 -0.02 0.00 0.00 31.44 30.45 1fns n GLU 187 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1fns n ARG 188 N -1.21 0.67 -4.26 3.49 0.63 -0.34 -4.93 116.66 110.71 1fns n ARG 188 Ca 0.11 -0.32 -0.14 0.00 -0.92 0.00 0.00 57.85 56.57 1fns n ARG 188 Cb 0.14 -1.49 -0.10 0.00 0.45 0.00 0.00 32.46 31.45 1fns n ARG 188 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1fns s HIS 189 N -2.55 1.35 -0.08 -0.14 3.76 -0.92 -5.08 115.29 111.62 1fns s HIS 189 Ca 0.25 -1.21 -0.03 0.00 -0.15 0.00 0.00 55.06 53.92 1fns s HIS 189 Cb 0.19 -0.75 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 1fns s HIS 189 CO 0.52 -0.40 -0.10 -1.71 -0.85 0.00 0.00 174.74 172.20 1fns n ASN 190 N -0.35 1.43 -4.79 1.40 5.15 -1.26 -4.73 115.26 112.10 1fns n ASN 190 Ca -0.01 0.06 -0.37 0.00 -0.60 0.00 0.00 54.58 53.66 1fns n ASN 190 Cb 0.66 -0.21 -0.06 0.00 -0.53 0.00 0.00 39.78 39.63 1fns n ASN 190 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1fns s SER 191 N -5.47 6.63 -0.08 1.20 0.01 -1.26 -0.53 113.70 114.20 1fns s SER 191 Ca -0.12 0.75 0.01 0.00 1.31 0.00 0.00 55.95 57.90 1fns s SER 191 Cb 0.04 -2.22 0.02 0.00 0.21 0.00 0.00 66.02 64.08 1fns s SER 191 CO 0.16 0.21 -0.08 -0.31 0.41 0.00 0.00 173.24 173.63 1fns s TYR 192 N -0.33 1.29 -0.01 2.43 1.51 -0.24 -0.30 117.35 121.69 1fns s TYR 192 Ca 0.21 -0.53 0.04 0.00 -1.01 0.00 0.00 57.07 55.78 1fns s TYR 192 Cb -0.15 -1.04 -0.01 0.00 -0.11 0.00 0.00 41.96 40.65 1fns s TYR 192 CO 0.09 -0.36 -0.13 0.99 -1.11 0.00 0.00 175.55 175.03 1fns s THR 193 N 1.20 1.05 -0.19 -0.71 2.01 -0.28 -1.57 115.64 117.16 1fns s THR 193 Ca -0.05 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 1fns s THR 193 Cb -0.14 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1fns s THR 193 CO -0.02 0.30 -0.12 0.00 -0.69 0.00 0.00 174.62 174.09 1fns s GLU 195 N 1.19 3.10 -0.16 0.00 2.02 0.14 -1.54 118.70 123.46 1fns s GLU 195 Ca 0.02 -0.81 -0.03 0.00 0.02 0.00 0.00 54.97 54.17 1fns s GLU 195 Cb -0.14 -2.41 -0.02 0.00 0.10 0.00 0.00 34.13 31.66 1fns s GLU 195 CO -0.05 0.23 -0.05 0.00 0.02 0.00 0.00 175.26 175.41 1fns s ALA 196 N 0.26 2.92 -0.20 5.21 0.00 0.59 -0.25 121.76 130.28 1fns s ALA 196 Ca -0.14 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 50.92 1fns s ALA 196 Cb -0.17 -1.51 -0.01 0.00 0.00 0.00 0.00 23.12 21.43 1fns s ALA 196 CO 0.07 0.15 -0.05 0.99 0.00 0.00 0.00 175.76 176.92 1fns s THR 197 N 0.48 3.42 0.05 0.00 2.01 0.44 -1.10 115.64 120.94 1fns s THR 197 Ca -0.04 -0.49 -0.09 0.00 0.31 0.00 0.00 61.69 61.38 1fns s THR 197 Cb -0.15 -2.53 0.00 0.00 0.01 0.00 0.00 72.50 69.83 1fns s THR 197 CO 0.03 0.44 0.18 -2.28 -0.69 0.00 0.00 174.62 172.31 1fns s HIS 198 N 1.18 0.08 0.60 4.92 5.04 -1.26 -1.67 115.29 124.18 1fns s HIS 198 Ca 0.02 -0.34 0.41 0.00 -1.54 0.00 0.00 55.06 53.61 1fns s HIS 198 Cb -0.14 -0.05 2.22 0.00 0.04 0.00 0.00 32.58 34.65 1fns s HIS 198 CO -0.01 -0.44 2.31 1.57 -2.34 0.00 0.00 174.74 175.84 1fns h LYS 199 N 3.38 0.00 0.00 2.88 2.10 -1.95 -2.26 116.57 120.73 1fns h LYS 199 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1fns h LYS 199 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1fns h LYS 199 CO 0.50 0.01 0.00 0.25 -2.00 0.00 0.00 179.45 178.20 1fns n THR 200 N -3.22 0.93 -3.85 0.07 -2.24 -1.26 -4.68 114.28 100.03 1fns n THR 200 Ca -0.03 0.41 -0.12 0.00 -2.27 0.00 0.00 64.05 62.04 1fns n THR 200 Cb 0.10 -1.36 -0.13 0.00 -2.10 0.00 0.00 70.33 66.84 1fns n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1fns s SER 201 N -4.12 -0.08 0.00 3.42 0.15 -0.85 -4.96 113.70 107.25 1fns s SER 201 Ca 0.02 0.15 0.26 0.00 0.70 0.00 0.00 55.95 57.08 1fns s SER 201 Cb 0.08 0.19 0.72 0.00 -1.71 0.00 0.00 66.02 65.30 1fns s SER 201 CO 0.32 -0.06 1.55 0.35 1.20 0.00 0.00 173.24 176.60 1fns n THR 202 N 2.90 0.00 -4.55 6.45 -2.24 -1.26 -4.47 114.28 111.11 1fns n THR 202 Ca -0.13 -0.23 -0.31 0.00 -2.27 0.00 0.00 64.05 61.11 1fns n THR 202 Cb 0.59 0.66 -0.12 0.00 -2.10 0.00 0.00 70.33 69.36 1fns n THR 202 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1fns s SER 203 N -2.25 3.91 0.59 3.42 0.01 -1.26 -5.11 113.70 113.02 1fns s SER 203 Ca 0.29 -0.43 -0.19 0.00 1.31 0.00 0.00 55.95 56.93 1fns s SER 203 Cb 0.20 -0.65 -0.03 0.00 0.21 0.00 0.00 66.02 65.75 1fns s SER 203 CO 0.43 0.24 1.24 -2.16 0.41 0.00 0.00 173.24 173.40 1fns s PRO 204 N -1.62 2.95 -0.28 12.44 0.04 -1.26 -4.91 135.00 142.37 1fns s PRO 204 Ca 0.16 1.92 -0.21 0.00 0.04 0.00 0.00 61.00 62.91 1fns s PRO 204 Cb -0.11 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 1fns s PRO 204 CO 0.07 -1.25 0.67 0.42 0.04 0.00 0.00 177.00 176.95 1fns s ILE 205 N -1.51 4.93 -0.06 0.56 1.01 -0.26 -4.88 121.20 120.99 1fns s ILE 205 Ca 0.77 1.07 0.01 0.00 0.00 0.00 0.00 60.65 62.50 1fns s ILE 205 Cb -0.33 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.11 1fns s ILE 205 CO 0.36 -0.08 -0.07 -0.69 0.00 0.00 0.00 174.94 174.46 1fns s VAL 206 N 2.64 3.70 -0.01 2.92 1.01 -1.26 -0.30 120.40 129.09 1fns s VAL 206 Ca 0.27 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1fns s VAL 206 Cb -0.15 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.71 1fns s VAL 206 CO 0.10 0.57 -0.03 -0.54 0.00 0.00 0.00 175.10 175.20 1fns s LYS 207 N -0.90 0.37 0.21 2.72 3.01 -0.59 -4.99 119.74 119.56 1fns s LYS 207 Ca 0.13 -0.08 -0.07 0.00 -1.01 0.00 0.00 55.97 54.95 1fns s LYS 207 Cb -0.11 -0.41 -0.02 0.00 -1.01 0.00 0.00 37.83 36.27 1fns s LYS 207 CO 0.02 0.01 0.27 -1.12 0.51 0.00 0.00 175.35 175.05 1fns s SER 208 N 0.32 0.06 0.03 2.83 0.01 -1.26 -0.45 113.70 115.24 1fns s SER 208 Ca -0.03 -1.12 -0.23 0.00 1.31 0.00 0.00 55.95 55.88 1fns s SER 208 Cb -0.06 0.46 0.05 0.00 0.21 0.00 0.00 66.02 66.67 1fns s SER 208 CO -0.01 -0.95 0.52 0.72 0.41 0.00 0.00 173.24 173.93 1fns s PHE 209 N -4.07 -0.43 -0.22 2.43 -0.12 -0.61 -5.00 117.98 109.97 1fns s PHE 209 Ca 0.28 0.52 -0.05 0.00 -0.05 0.00 0.00 56.93 57.63 1fns s PHE 209 Cb 0.04 0.33 -0.02 0.00 -0.63 0.00 0.00 43.02 42.73 1fns s PHE 209 CO 0.08 -0.62 0.01 -0.80 -0.05 0.00 0.00 175.22 173.84 1fns s ASN 210 N -1.84 4.83 0.59 1.98 0.01 -1.26 -1.08 114.94 118.16 1fns s ASN 210 Ca -0.06 -0.23 0.29 0.00 -0.71 0.00 0.00 52.86 52.15 1fns s ASN 210 Cb -0.01 -1.84 1.38 0.00 0.41 0.00 0.00 41.25 41.20 1fns s ASN 210 CO -0.00 0.02 1.77 -0.09 -1.51 0.00 0.00 177.10 177.30 1fns h ARG 211 N 7.79 0.00 -0.01 -0.60 2.43 -1.10 -1.18 114.38 121.71 1fns h ARG 211 Ca -0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1fns h ARG 211 Cb 1.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1fns h ARG 211 CO 0.60 0.00 -0.43 0.27 -1.51 0.00 0.00 179.97 178.90 1fns n ASN 212 N -3.66 1.83 -1.01 -3.80 6.94 -1.26 -4.13 115.26 110.17 1fns n ASN 212 Ca 0.13 -1.41 0.05 0.00 -0.02 0.00 0.00 54.58 53.32 1fns n ASN 212 Cb 0.90 0.49 0.19 0.00 -2.36 0.00 0.00 39.78 39.00 1fns n ASN 212 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 1fns n GLU 213 N -0.10 2.55 0.00 -3.83 2.13 -0.44 -5.26 120.64 115.69 1fns n GLU 213 Ca 0.08 -1.53 0.00 0.00 0.66 0.00 0.00 57.16 56.37 1fns n GLU 213 Cb 0.41 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.47 1fns n GLU 213 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72