#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fpt n VAL 2 N 0.00 -1.03 -1.88 2.53 0.31 -1.26 -4.59 118.33 112.42 1fpt n VAL 2 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 1fpt n VAL 2 Cb 0.00 -2.10 -0.03 0.00 -0.91 0.00 0.00 33.84 30.81 1fpt n VAL 2 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1fpt s VAL 3 N -0.62 3.27 0.17 2.52 1.01 -1.26 -4.81 120.40 120.69 1fpt s VAL 3 Ca 0.00 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 1fpt s VAL 3 Cb 0.00 -3.58 -0.08 0.00 0.00 0.00 0.00 36.38 32.72 1fpt s VAL 3 CO 0.00 -0.52 1.09 -0.04 0.00 0.00 0.00 175.10 175.64 1fpt s MET 4 N 7.03 4.60 -0.14 2.72 -1.94 -1.26 -2.32 119.30 127.99 1fpt s MET 4 Ca 0.80 1.70 -0.02 0.00 -1.71 0.00 0.00 55.69 56.46 1fpt s MET 4 Cb -0.17 -3.28 0.05 0.00 2.01 0.00 0.00 34.83 33.43 1fpt s MET 4 CO 0.26 0.08 0.03 0.99 -0.01 0.00 0.00 175.02 176.37 1fpt s THR 5 N -0.23 0.42 -0.06 2.05 2.01 0.04 -4.59 115.64 115.27 1fpt s THR 5 Ca 0.49 -0.25 -0.02 0.00 0.31 0.00 0.00 61.69 62.23 1fpt s THR 5 Cb -0.29 -0.79 -0.04 0.00 0.01 0.00 0.00 72.50 71.39 1fpt s THR 5 CO 0.35 -0.02 0.04 -1.10 -0.69 0.00 0.00 174.62 173.20 1fpt s GLN 6 N 1.93 3.03 -0.03 4.92 -0.21 -1.26 -1.71 119.66 126.33 1fpt s GLN 6 Ca 0.02 -0.42 -0.01 0.00 0.02 0.00 0.00 55.36 54.96 1fpt s GLN 6 Cb -0.15 -2.84 0.02 0.00 1.00 0.00 0.00 33.01 31.04 1fpt s GLN 6 CO -0.07 0.69 0.06 0.95 -2.12 0.00 0.00 175.29 174.79 1fpt s THR 7 N -1.01 -0.04 0.85 -0.19 -4.23 -0.30 -4.49 115.64 106.22 1fpt s THR 7 Ca 0.17 0.15 -0.12 0.00 -1.18 0.00 0.00 61.69 60.71 1fpt s THR 7 Cb -0.12 -0.11 0.10 0.00 1.34 0.00 0.00 72.50 73.72 1fpt s THR 7 CO 0.07 0.06 1.11 -2.16 -0.54 0.00 0.00 174.62 173.16 1fpt s PRO 8 N 0.81 1.64 0.25 3.99 0.04 -1.26 -1.42 135.00 139.04 1fpt s PRO 8 Ca -0.07 0.49 0.10 0.00 0.04 0.00 0.00 61.00 61.56 1fpt s PRO 8 Cb -0.09 -1.88 0.27 0.00 0.04 0.00 0.00 34.50 32.84 1fpt s PRO 8 CO -0.03 -1.90 1.56 -0.07 0.04 0.00 0.00 177.00 176.61 1fpt h LEU 9 N -1.29 0.00 -7.48 -3.56 4.07 -1.84 -3.39 115.31 101.82 1fpt h LEU 9 Ca -0.49 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.34 1fpt h LEU 9 Cb 1.30 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 42.82 1fpt h LEU 9 CO 0.60 0.67 -0.31 -0.94 -1.08 0.00 0.00 178.44 177.39 1fpt s SER 10 N -6.81 -0.23 -0.39 -0.43 1.04 -1.26 -2.21 113.70 103.41 1fpt s SER 10 Ca -0.01 0.28 0.01 0.00 0.48 0.00 0.00 55.95 56.71 1fpt s SER 10 Cb 0.12 0.44 0.13 0.00 0.10 0.00 0.00 66.02 66.81 1fpt s SER 10 CO 0.77 -0.32 0.20 -0.22 0.98 0.00 0.00 173.24 174.65 1fpt s LEU 11 N -0.78 2.05 -0.04 2.42 2.96 -1.10 -4.88 118.68 119.31 1fpt s LEU 11 Ca -0.09 -2.29 -0.30 0.00 -0.22 0.00 0.00 54.13 51.23 1fpt s LEU 11 Cb -0.04 -0.80 -0.06 0.00 0.50 0.00 0.00 46.19 45.79 1fpt s LEU 11 CO 0.03 -0.31 1.63 -2.16 -1.32 0.00 0.00 176.35 174.22 1fpt s PRO 12 N 0.83 4.19 0.03 0.98 0.04 -1.26 -1.30 135.00 138.51 1fpt s PRO 12 Ca 0.16 2.17 0.03 0.00 0.04 0.00 0.00 61.00 63.41 1fpt s PRO 12 Cb -0.23 -3.92 -0.02 0.00 0.04 0.00 0.00 34.50 30.37 1fpt s PRO 12 CO -0.05 -0.82 -0.10 0.08 0.04 0.00 0.00 177.00 176.16 1fpt s VAL 13 N 3.80 0.75 0.01 -0.36 1.01 0.04 -4.94 120.40 120.70 1fpt s VAL 13 Ca 0.72 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 1fpt s VAL 13 Cb -0.33 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 1fpt s VAL 13 CO 0.29 -0.12 0.13 -0.44 0.00 0.00 0.00 175.10 174.96 1fpt s SER 14 N -1.10 5.96 0.10 3.32 0.01 -1.26 -0.00 113.70 120.73 1fpt s SER 14 Ca -0.03 0.21 -0.29 0.00 1.31 0.00 0.00 55.95 57.15 1fpt s SER 14 Cb -0.07 -1.77 -0.16 0.00 0.21 0.00 0.00 66.02 64.22 1fpt s SER 14 CO 0.01 0.25 0.67 0.18 0.41 0.00 0.00 173.24 174.76 1fpt n LEU 15 N 0.91 -0.60 0.00 2.44 4.77 -1.26 -1.39 117.00 121.87 1fpt n LEU 15 Ca -0.11 1.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.87 1fpt n LEU 15 Cb 0.52 -0.82 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1fpt n LEU 15 CO 0.42 -2.18 0.00 0.61 -1.33 0.00 0.00 177.39 174.91 1fpt n GLY 16 N 1.55 2.01 3.86 -0.72 0.00 0.54 -4.86 105.19 107.57 1fpt n GLY 16 Ca 0.17 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1fpt n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fpt s ASP 17 N 0.05 5.02 0.62 1.61 1.11 -0.49 -4.07 116.67 120.52 1fpt s ASP 17 Ca 0.00 1.15 -0.14 0.00 0.18 0.00 0.00 52.55 53.74 1fpt s ASP 17 Cb 0.00 -1.90 -0.02 0.00 1.07 0.00 0.00 42.92 42.07 1fpt s ASP 17 CO 0.00 -1.62 1.06 -1.58 1.18 0.00 0.00 175.17 174.21 1fpt s GLN 18 N -5.31 3.22 -0.11 8.23 0.74 -1.24 -2.06 119.66 123.13 1fpt s GLN 18 Ca 0.59 1.13 -0.09 0.00 0.05 0.00 0.00 55.36 57.05 1fpt s GLN 18 Cb -0.12 -2.02 0.03 0.00 1.10 0.00 0.00 33.01 32.00 1fpt s GLN 18 CO 0.52 -0.88 0.28 0.00 -0.55 0.00 0.00 175.29 174.66 1fpt s ALA 19 N -2.61 -0.69 -0.31 1.58 0.00 -0.21 -4.91 121.76 114.60 1fpt s ALA 19 Ca 0.62 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 53.39 1fpt s ALA 19 Cb -0.15 -0.48 0.13 0.00 0.00 0.00 0.00 23.12 22.62 1fpt s ALA 19 CO 0.42 -0.14 0.26 0.45 0.00 0.00 0.00 175.76 176.74 1fpt s SER 20 N 0.25 2.26 0.27 0.00 0.15 -1.26 -0.67 113.70 114.70 1fpt s SER 20 Ca -0.01 -1.27 -0.28 0.00 0.70 0.00 0.00 55.95 55.08 1fpt s SER 20 Cb -0.03 0.16 -0.09 0.00 -1.71 0.00 0.00 66.02 64.35 1fpt s SER 20 CO -0.00 -0.36 0.95 -0.63 1.20 0.00 0.00 173.24 174.39 1fpt s ILE 21 N 1.92 4.11 -0.03 6.45 1.01 -0.60 -4.84 121.20 129.23 1fpt s ILE 21 Ca 0.12 1.97 0.03 0.00 0.00 0.00 0.00 60.65 62.78 1fpt s ILE 21 Cb -0.16 -4.20 -0.00 0.00 0.01 0.00 0.00 42.46 38.11 1fpt s ILE 21 CO -0.23 0.36 -0.12 -0.94 0.00 0.00 0.00 174.94 174.01 1fpt s SER 22 N -1.34 1.55 -0.04 3.58 1.04 -0.51 -0.68 113.70 117.29 1fpt s SER 22 Ca 0.45 -0.24 0.01 0.00 0.48 0.00 0.00 55.95 56.64 1fpt s SER 22 Cb -0.23 -0.38 0.02 0.00 0.10 0.00 0.00 66.02 65.53 1fpt s SER 22 CO 0.29 0.11 -0.03 0.00 0.98 0.00 0.00 173.24 174.59 1fpt s SER 24 N 1.00 1.66 0.19 0.00 1.04 -0.69 -0.96 113.70 115.94 1fpt s SER 24 Ca -0.10 -0.39 0.10 0.00 0.48 0.00 0.00 55.95 56.04 1fpt s SER 24 Cb -0.14 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.80 1fpt s SER 24 CO -0.01 0.08 -0.14 -0.94 0.98 0.00 0.00 173.24 173.21 1fpt s SER 25 N -0.86 3.97 0.12 7.02 1.04 -0.83 -0.78 113.70 123.37 1fpt s SER 25 Ca 0.03 -0.69 -0.11 0.00 0.48 0.00 0.00 55.95 55.66 1fpt s SER 25 Cb -0.07 -0.56 -0.11 0.00 0.10 0.00 0.00 66.02 65.38 1fpt s SER 25 CO 0.01 0.10 1.35 0.77 0.98 0.00 0.00 173.24 176.45 1fpt h SER 26 N 2.96 0.91 -1.48 7.02 4.64 -1.77 -3.46 113.55 122.36 1fpt h SER 26 Ca -0.46 -0.57 -0.45 0.00 -0.47 0.00 0.00 61.79 59.84 1fpt h SER 26 Cb 1.21 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1fpt h SER 26 CO 0.52 1.36 -0.31 -1.10 -0.87 0.00 0.00 176.83 176.43 1fpt s GLN 27 N -3.83 2.72 0.08 4.77 -0.21 -1.26 -4.98 119.66 116.95 1fpt s GLN 27 Ca -0.10 -1.35 -0.30 0.00 0.02 0.00 0.00 55.36 53.63 1fpt s GLN 27 Cb 0.09 -2.61 -0.06 0.00 1.00 0.00 0.00 33.01 31.43 1fpt s GLN 27 CO 0.90 -0.23 1.19 0.45 -2.12 0.00 0.00 175.29 175.47 1fpt s SER 27 N -4.26 7.10 0.00 5.90 0.15 -1.26 -4.70 113.70 116.63 1fpt s SER 27 Ca 0.52 2.03 0.29 0.00 0.70 0.00 0.00 55.95 59.49 1fpt s SER 27 Cb -0.07 -2.58 1.33 0.00 -1.71 0.00 0.00 66.02 62.99 1fpt s SER 27 CO 0.31 -0.44 1.91 0.18 1.20 0.00 0.00 173.24 176.40 1fpt n LEU 27 N 3.72 0.70 -4.56 3.45 4.77 0.60 -4.78 117.00 120.90 1fpt n LEU 27 Ca 0.08 -0.17 -0.41 0.00 -0.03 0.00 0.00 56.01 55.48 1fpt n LEU 27 Cb 0.46 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 1fpt n LEU 27 CO 0.55 0.12 1.25 -0.69 -1.33 0.00 0.00 177.39 177.29 1fpt s VAL 27 N -2.19 3.72 0.13 4.08 1.01 -1.26 -3.75 120.40 122.14 1fpt s VAL 27 Ca 0.37 0.53 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 1fpt s VAL 27 Cb 0.21 -4.60 -0.07 0.00 0.00 0.00 0.00 36.38 31.92 1fpt s VAL 27 CO 0.40 -1.43 1.17 -2.28 0.00 0.00 0.00 175.10 172.96 1fpt s HIS 27 N 6.22 3.48 0.00 5.22 5.04 -1.12 -4.84 115.29 129.29 1fpt s HIS 27 Ca 0.46 1.43 0.00 0.00 -1.54 0.00 0.00 55.06 55.41 1fpt s HIS 27 Cb -0.10 -3.38 0.00 0.00 0.04 0.00 0.00 32.58 29.15 1fpt s HIS 27 CO 0.20 -1.05 0.00 -1.13 -2.34 0.00 0.00 174.74 170.43 1fpt n SER 27 N 3.03 0.00 0.00 9.88 3.41 -1.26 -0.41 113.62 128.27 1fpt n SER 27 Ca 0.06 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.73 1fpt n SER 27 Cb 0.46 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 64.75 1fpt n SER 27 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1fpt n ASN 28 N -2.35 0.00 0.00 4.04 6.94 -1.26 -4.86 115.26 117.77 1fpt n ASN 28 Ca 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 54.58 54.54 1fpt n ASN 28 Cb 0.00 -0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.20 1fpt n ASN 28 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1fpt n GLY 29 N -0.19 0.84 3.42 4.83 0.00 0.45 -5.08 105.19 109.45 1fpt n GLY 29 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1fpt n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fpt s LYS 30 N -0.85 3.56 -0.41 1.61 1.02 -1.20 -4.89 119.74 118.59 1fpt s LYS 30 Ca 0.00 -0.55 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 1fpt s LYS 30 Cb 0.00 -3.01 0.01 0.00 -0.52 0.00 0.00 37.83 34.31 1fpt s LYS 30 CO 0.00 0.01 1.37 0.99 -0.92 0.00 0.00 175.35 176.81 1fpt s THR 31 N 0.98 3.96 -1.06 2.17 2.01 -1.26 -2.81 115.64 119.62 1fpt s THR 31 Ca 0.01 0.99 -0.04 0.00 0.31 0.00 0.00 61.69 62.95 1fpt s THR 31 Cb -0.14 -4.24 0.30 0.00 0.01 0.00 0.00 72.50 68.43 1fpt s THR 31 CO 0.01 -0.75 1.39 -1.22 -0.69 0.00 0.00 174.62 173.36 1fpt n TYR 32 N 8.60 2.72 -3.98 4.92 4.02 -1.25 -4.49 117.16 127.71 1fpt n TYR 32 Ca 0.16 -2.85 -0.35 0.00 -0.01 0.00 0.00 57.90 54.85 1fpt n TYR 32 Cb 0.48 -1.27 -0.12 0.00 -0.02 0.00 0.00 39.34 38.41 1fpt n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1fpt s LEU 33 N -2.58 3.46 0.06 7.72 1.98 -1.19 -1.46 118.68 126.68 1fpt s LEU 33 Ca 0.31 -0.12 0.08 0.00 -2.89 0.00 0.00 54.13 51.51 1fpt s LEU 33 Cb 0.03 -1.89 -0.03 0.00 0.66 0.00 0.00 46.19 44.96 1fpt s LEU 33 CO 0.07 0.07 -0.19 -1.00 -1.89 0.00 0.00 176.35 173.42 1fpt s HIS 34 N 1.01 2.54 -0.05 5.38 3.76 0.42 -3.79 115.29 124.55 1fpt s HIS 34 Ca 0.03 -0.27 0.06 0.00 -0.15 0.00 0.00 55.06 54.73 1fpt s HIS 34 Cb -0.14 -1.43 -0.02 0.00 1.11 0.00 0.00 32.58 32.10 1fpt s HIS 34 CO 0.02 0.28 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.38 1fpt s TRP 35 N -0.97 2.47 0.08 1.40 0.52 -0.76 -0.76 118.94 120.91 1fpt s TRP 35 Ca 0.15 -0.56 0.09 0.00 0.02 0.00 0.00 56.10 55.80 1fpt s TRP 35 Cb -0.10 -1.59 -0.03 0.00 -1.15 0.00 0.00 33.47 30.59 1fpt s TRP 35 CO 0.06 -0.11 -0.23 0.71 0.02 0.00 0.00 176.95 177.40 1fpt s TYR 36 N -0.33 2.41 -0.16 -1.98 2.02 0.14 0.18 117.35 119.64 1fpt s TYR 36 Ca 0.02 -0.34 -0.01 0.00 -0.37 0.00 0.00 57.07 56.37 1fpt s TYR 36 Cb -0.12 -1.37 -0.01 0.00 -0.40 0.00 0.00 41.96 40.06 1fpt s TYR 36 CO 0.02 0.25 -0.12 -1.17 -1.57 0.00 0.00 175.55 172.96 1fpt s LEU 37 N -1.63 2.68 -0.44 -1.29 2.96 0.08 -1.26 118.68 119.78 1fpt s LEU 37 Ca 0.14 -0.39 -0.03 0.00 -0.22 0.00 0.00 54.13 53.63 1fpt s LEU 37 Cb -0.10 -1.62 0.12 0.00 0.50 0.00 0.00 46.19 45.08 1fpt s LEU 37 CO 0.05 0.10 0.24 -1.58 -1.32 0.00 0.00 176.35 173.83 1fpt s GLN 38 N 0.76 2.08 0.74 1.98 0.74 -0.60 -0.68 119.66 124.68 1fpt s GLN 38 Ca -0.05 -1.90 -0.14 0.00 0.05 0.00 0.00 55.36 53.32 1fpt s GLN 38 Cb -0.15 -3.62 0.04 0.00 1.10 0.00 0.00 33.01 30.39 1fpt s GLN 38 CO 0.01 -1.09 1.19 0.15 -0.55 0.00 0.00 175.29 175.00 1fpt s LYS 39 N 1.02 2.13 -0.06 1.67 1.02 -1.26 -2.16 119.74 122.10 1fpt s LYS 39 Ca 0.09 1.68 -0.33 0.00 0.02 0.00 0.00 55.97 57.42 1fpt s LYS 39 Cb -0.23 -1.84 -0.11 0.00 -0.52 0.00 0.00 37.83 35.13 1fpt s LYS 39 CO -0.04 -1.82 1.89 -2.30 -0.92 0.00 0.00 175.35 172.15 1fpt n PRO 40 N -2.84 2.30 0.00 -1.68 -0.02 -1.26 -3.21 135.00 128.30 1fpt n PRO 40 Ca 0.13 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1fpt n PRO 40 Cb 0.51 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1fpt n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fpt n GLY 41 N 4.39 2.24 3.20 -1.23 0.00 -1.26 -5.00 105.19 107.52 1fpt n GLY 41 Ca 0.22 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 1fpt n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fpt n GLN 42 N 0.00 -3.05 -3.94 1.61 1.13 -1.20 -5.08 117.38 106.86 1fpt n GLN 42 Ca 0.00 -0.89 -0.24 0.00 -1.94 0.00 0.00 57.00 53.93 1fpt n GLN 42 Cb 0.00 -1.76 -0.02 0.00 0.11 0.00 0.00 30.24 28.56 1fpt n GLN 42 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1fpt s SER 43 N -2.36 6.33 0.47 1.08 1.04 -1.26 -4.66 113.70 114.34 1fpt s SER 43 Ca 0.55 0.13 -0.23 0.00 0.48 0.00 0.00 55.95 56.88 1fpt s SER 43 Cb -0.12 -1.89 -0.07 0.00 0.10 0.00 0.00 66.02 64.04 1fpt s SER 43 CO 0.52 -0.02 1.26 -2.16 0.98 0.00 0.00 173.24 173.82 1fpt s PRO 44 N -3.62 3.62 0.09 4.02 0.05 -1.26 -4.68 135.00 133.22 1fpt s PRO 44 Ca 0.34 2.01 0.09 0.00 0.05 0.00 0.00 61.00 63.50 1fpt s PRO 44 Cb -0.10 -2.45 -0.04 0.00 0.05 0.00 0.00 34.50 31.96 1fpt s PRO 44 CO 0.29 -0.73 -0.21 -1.59 0.05 0.00 0.00 177.00 174.81 1fpt s LYS 45 N -2.64 1.79 0.02 4.56 -2.85 0.15 -4.92 119.74 115.84 1fpt s LYS 45 Ca 0.64 -1.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.16 1fpt s LYS 45 Cb -0.35 -2.08 -0.06 0.00 -2.06 0.00 0.00 37.83 33.29 1fpt s LYS 45 CO 0.42 0.49 1.37 -1.17 0.10 0.00 0.00 175.35 176.56 1fpt s LEU 46 N -1.85 4.33 -0.22 2.77 2.96 -1.26 -0.74 118.68 124.66 1fpt s LEU 46 Ca 0.16 2.11 -0.15 0.00 -0.22 0.00 0.00 54.13 56.03 1fpt s LEU 46 Cb -0.10 -3.57 -0.09 0.00 0.50 0.00 0.00 46.19 42.93 1fpt s LEU 46 CO 0.07 -0.68 -0.34 0.18 -1.32 0.00 0.00 176.35 174.27 1fpt n LEU 47 N 5.02 1.88 -4.20 -0.68 4.77 0.13 -4.69 117.00 119.22 1fpt n LEU 47 Ca 0.12 0.32 -0.29 0.00 -0.03 0.00 0.00 56.01 56.14 1fpt n LEU 47 Cb 0.44 -0.75 -0.16 0.00 -2.33 0.00 0.00 43.42 40.61 1fpt n LEU 47 CO 0.58 0.17 -0.53 -0.63 -1.33 0.00 0.00 177.39 175.65 1fpt s ILE 48 N -2.65 1.74 -0.11 -0.08 -1.09 -0.94 -1.68 121.20 116.39 1fpt s ILE 48 Ca -0.33 -0.89 -0.12 0.00 -2.23 0.00 0.00 60.65 57.08 1fpt s ILE 48 Cb 0.10 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 39.45 1fpt s ILE 48 CO 0.44 0.49 -0.24 0.00 -1.23 0.00 0.00 174.94 174.40 1fpt n TYR 49 N 3.02 0.00 0.01 3.97 0.18 0.12 -1.83 117.16 122.63 1fpt n TYR 49 Ca -0.18 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.50 1fpt n TYR 49 Cb 0.52 -0.39 -0.14 0.00 -0.38 0.00 0.00 39.34 38.96 1fpt n TYR 49 CO 0.00 0.00 0.00 0.87 -2.08 0.00 0.00 176.86 175.65 1fpt h LYS 50 N -0.69 0.06 0.00 -3.48 1.57 -1.79 -3.36 116.57 108.87 1fpt h LYS 50 Ca -0.06 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1fpt h LYS 50 Cb 0.78 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1fpt h LYS 50 CO -0.03 0.75 0.00 0.28 -0.57 0.00 0.00 179.45 179.88 1fpt n VAL 51 N -3.21 0.00 -0.00 0.50 0.31 -1.25 -3.15 118.33 111.53 1fpt n VAL 51 Ca -0.14 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.20 1fpt n VAL 51 Cb 1.02 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.92 1fpt n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1fpt n SER 52 N -1.74 4.12 -4.67 4.52 3.41 -1.26 -3.39 113.62 114.60 1fpt n SER 52 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 1fpt n SER 52 Cb 0.00 1.07 -0.04 0.00 -0.26 0.00 0.00 64.21 64.98 1fpt n SER 52 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1fpt s ASN 53 N -2.63 6.92 0.31 4.04 2.20 -1.26 -4.25 114.94 120.26 1fpt s ASN 53 Ca -0.01 1.12 -0.28 0.00 -0.94 0.00 0.00 52.86 52.75 1fpt s ASN 53 Cb 0.02 -2.43 -0.09 0.00 -2.00 0.00 0.00 41.25 36.75 1fpt s ASN 53 CO 0.16 -0.35 1.03 -0.13 -2.94 0.00 0.00 177.10 174.87 1fpt s ARG 54 N 1.96 4.54 0.87 3.55 0.52 -1.26 0.14 118.95 129.27 1fpt s ARG 54 Ca 0.37 1.59 -0.11 0.00 -0.52 0.00 0.00 55.73 57.06 1fpt s ARG 54 Cb -0.17 -2.97 0.11 0.00 0.52 0.00 0.00 34.95 32.44 1fpt s ARG 54 CO 0.13 0.19 1.09 0.12 0.02 0.00 0.00 175.30 176.85 1fpt s PHE 55 N -1.37 2.37 0.54 -0.53 5.36 -0.67 -4.83 117.98 118.84 1fpt s PHE 55 Ca 0.48 1.33 -0.22 0.00 -0.96 0.00 0.00 56.93 57.57 1fpt s PHE 55 Cb -0.26 -3.14 -0.05 0.00 -0.34 0.00 0.00 43.02 39.23 1fpt s PHE 55 CO 0.33 -2.26 1.33 0.45 -1.46 0.00 0.00 175.22 173.61 1fpt s SER 56 N -3.40 5.36 -1.04 6.13 0.15 -1.26 -3.49 113.70 116.14 1fpt s SER 56 Ca 0.63 2.69 -0.11 0.00 0.70 0.00 0.00 55.95 59.87 1fpt s SER 56 Cb -0.18 -2.63 -0.04 0.00 -1.71 0.00 0.00 66.02 61.46 1fpt s SER 56 CO 0.57 -1.50 0.85 0.61 1.20 0.00 0.00 173.24 174.96 1fpt n GLY 57 N 0.69 -1.12 2.70 9.45 0.00 -1.26 -5.01 105.19 110.64 1fpt n GLY 57 Ca 0.10 0.53 -0.27 0.00 0.00 0.00 0.00 46.02 46.38 1fpt n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fpt s VAL 58 N -3.36 0.39 0.32 1.61 1.01 -1.23 -5.12 120.40 114.02 1fpt s VAL 58 Ca 0.41 -0.52 -0.26 0.00 0.00 0.00 0.00 61.98 61.61 1fpt s VAL 58 Cb -0.09 -0.96 -0.14 0.00 0.00 0.00 0.00 36.38 35.19 1fpt s VAL 58 CO 0.79 -0.26 0.77 -2.65 0.00 0.00 0.00 175.10 173.75 1fpt n PRO 59 N 5.10 0.86 0.03 2.72 -0.01 -1.26 -4.81 135.00 137.63 1fpt n PRO 59 Ca -0.08 0.30 0.04 0.00 -0.01 0.00 0.00 63.50 63.75 1fpt n PRO 59 Cb 0.47 -1.60 0.17 0.00 -0.01 0.00 0.00 33.50 32.53 1fpt n PRO 59 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 175.50 175.09 1fpt n ASP 60 N 1.33 0.12 0.08 2.55 5.75 -1.26 -1.74 116.55 123.38 1fpt n ASP 60 Ca 0.12 0.55 0.10 0.00 -0.01 0.00 0.00 54.79 55.55 1fpt n ASP 60 Cb 0.34 -0.57 0.57 0.00 -1.03 0.00 0.00 41.12 40.43 1fpt n ASP 60 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1fpt h ARG 61 N 0.00 0.21 -6.25 0.11 3.08 -1.92 -3.42 114.38 106.18 1fpt h ARG 61 Ca 0.00 -0.01 -0.56 0.00 0.07 0.00 0.00 59.98 59.48 1fpt h ARG 61 Cb 0.06 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 1fpt h ARG 61 CO 0.00 0.14 0.60 -0.06 -1.07 0.00 0.00 179.97 179.57 1fpt s PHE 62 N -5.22 3.47 -0.04 3.04 0.08 -0.71 -2.06 117.98 116.54 1fpt s PHE 62 Ca -0.06 1.55 -0.03 0.00 0.12 0.00 0.00 56.93 58.50 1fpt s PHE 62 Cb 0.18 -3.22 0.01 0.00 -0.57 0.00 0.00 43.02 39.42 1fpt s PHE 62 CO 0.71 -0.35 0.10 -1.54 -0.10 0.00 0.00 175.22 174.04 1fpt s SER 63 N 1.14 -0.10 0.29 1.36 1.04 -0.02 -4.96 113.70 112.45 1fpt s SER 63 Ca 0.49 0.19 0.03 0.00 0.48 0.00 0.00 55.95 57.14 1fpt s SER 63 Cb -0.19 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 1fpt s SER 63 CO 0.18 -0.04 0.45 -0.83 0.98 0.00 0.00 173.24 173.97 1fpt s GLY 64 N 0.03 1.28 -0.19 7.32 0.00 -1.26 -0.49 107.32 114.01 1fpt s GLY 64 Ca -0.00 -1.10 -0.31 0.00 0.00 0.00 0.00 44.72 43.31 1fpt s GLY 64 CO 0.00 -1.08 1.13 -1.35 0.00 0.00 0.00 173.10 171.80 1fpt s SER 65 N -4.01 -0.23 0.00 1.64 1.04 -0.89 -4.38 113.70 106.86 1fpt s SER 65 Ca 0.37 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.99 1fpt s SER 65 Cb -0.09 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1fpt s SER 65 CO 0.32 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.89 1fpt n GLY 66 N 0.42 -0.55 3.13 7.32 0.00 -1.26 -0.07 105.19 114.18 1fpt n GLY 66 Ca -0.05 -1.46 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 1fpt n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fpt s SER 67 N 0.00 -0.26 0.00 1.61 0.15 0.16 -4.95 113.70 110.42 1fpt s SER 67 Ca 0.00 0.50 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1fpt s SER 67 Cb 0.00 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 1fpt s SER 67 CO 0.00 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1fpt n GLY 68 N 3.02 -0.07 0.00 9.45 0.00 -1.26 -0.56 105.19 115.77 1fpt n GLY 68 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1fpt n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fpt n THR 69 N 0.00 0.10 -3.81 2.61 -2.24 -1.26 -0.29 114.28 109.39 1fpt n THR 69 Ca 0.00 -0.20 -0.26 0.00 -2.27 0.00 0.00 64.05 61.31 1fpt n THR 69 Cb 0.00 1.41 -0.17 0.00 -2.10 0.00 0.00 70.33 69.47 1fpt n THR 69 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1fpt s TYR 70 N -0.10 1.17 -0.02 4.78 5.04 0.28 -1.97 117.35 126.52 1fpt s TYR 70 Ca 0.00 -0.71 0.01 0.00 -2.44 0.00 0.00 57.07 53.93 1fpt s TYR 70 Cb 0.00 -1.06 0.01 0.00 0.35 0.00 0.00 41.96 41.26 1fpt s TYR 70 CO 0.00 -0.52 -0.03 -0.06 -1.34 0.00 0.00 175.55 173.60 1fpt s PHE 71 N 1.81 0.49 0.13 4.97 0.40 -0.14 0.39 117.98 126.04 1fpt s PHE 71 Ca 0.02 -0.09 0.10 0.00 -0.60 0.00 0.00 56.93 56.36 1fpt s PHE 71 Cb -0.15 -0.43 -0.04 0.00 0.51 0.00 0.00 43.02 42.92 1fpt s PHE 71 CO -0.07 -0.09 -0.25 -0.08 0.70 0.00 0.00 175.22 175.43 1fpt s THR 72 N 0.50 2.11 -0.05 0.64 -1.32 0.91 -0.70 115.64 117.73 1fpt s THR 72 Ca -0.06 -1.74 0.04 0.00 -1.21 0.00 0.00 61.69 58.72 1fpt s THR 72 Cb -0.09 -1.89 -0.02 0.00 -1.51 0.00 0.00 72.50 68.98 1fpt s THR 72 CO -0.00 0.01 -0.16 -0.22 -2.21 0.00 0.00 174.62 172.04 1fpt s LEU 73 N -2.11 2.65 -0.03 9.08 2.96 0.15 -2.10 118.68 129.29 1fpt s LEU 73 Ca 0.13 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1fpt s LEU 73 Cb -0.10 -1.53 0.00 0.00 0.50 0.00 0.00 46.19 45.07 1fpt s LEU 73 CO 0.06 0.33 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.79 1fpt s LYS 74 N -0.64 0.98 -0.23 1.98 1.02 0.35 -1.55 119.74 121.65 1fpt s LYS 74 Ca 0.10 -0.30 -0.06 0.00 0.02 0.00 0.00 55.97 55.73 1fpt s LYS 74 Cb -0.11 -0.91 -0.02 0.00 -0.52 0.00 0.00 37.83 36.27 1fpt s LYS 74 CO 0.01 0.11 0.02 0.42 -0.92 0.00 0.00 175.35 174.98 1fpt s ILE 75 N 0.22 3.96 -0.05 2.17 1.01 0.16 -0.84 121.20 127.83 1fpt s ILE 75 Ca -0.04 -0.29 -0.23 0.00 0.00 0.00 0.00 60.65 60.08 1fpt s ILE 75 Cb -0.09 -2.83 -0.26 0.00 0.01 0.00 0.00 42.46 39.30 1fpt s ILE 75 CO 0.01 0.39 0.98 0.77 0.00 0.00 0.00 174.94 177.08 1fpt h SER 76 N 8.00 0.31 -2.32 3.58 4.64 -1.70 -0.55 113.55 125.52 1fpt h SER 76 Ca -0.39 -0.84 -0.33 0.00 -0.47 0.00 0.00 61.79 59.76 1fpt h SER 76 Cb 1.17 -0.10 -0.35 0.00 -0.31 0.00 0.00 62.40 62.82 1fpt h SER 76 CO 0.59 1.12 -0.63 -0.13 -0.87 0.00 0.00 176.83 176.91 1fpt s ARG 77 N -2.86 0.26 0.27 4.77 3.00 -1.26 -3.68 118.95 119.45 1fpt s ARG 77 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 55.73 55.29 1fpt s ARG 77 Cb 0.01 -0.90 -0.14 0.00 0.00 0.00 0.00 34.95 33.92 1fpt s ARG 77 CO 0.77 -0.86 1.15 0.28 0.00 0.00 0.00 175.30 176.64 1fpt n VAL 78 N 5.31 1.61 -4.37 3.52 0.31 -0.88 -4.59 118.33 119.25 1fpt n VAL 78 Ca -0.04 -0.40 -0.20 0.00 -0.01 0.00 0.00 64.34 63.69 1fpt n VAL 78 Cb 0.47 -1.14 -0.10 0.00 -0.91 0.00 0.00 33.84 32.16 1fpt n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1fpt s GLU 79 N -1.19 1.40 0.27 5.55 2.02 -1.26 -0.34 118.70 125.15 1fpt s GLU 79 Ca 0.62 -1.62 -0.02 0.00 0.02 0.00 0.00 54.97 53.98 1fpt s GLU 79 Cb -0.70 -1.28 0.59 0.00 0.10 0.00 0.00 34.13 32.84 1fpt s GLU 79 CO 0.57 0.22 1.64 0.00 0.02 0.00 0.00 175.26 177.72 1fpt h ALA 80 N 2.53 1.07 0.00 5.21 0.00 -1.94 -1.45 119.26 124.68 1fpt h ALA 80 Ca -0.39 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1fpt h ALA 80 Cb 1.23 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1fpt h ALA 80 CO 0.61 -0.44 0.00 -0.85 0.00 0.00 0.00 179.25 178.57 1fpt n GLU 81 N -5.28 0.11 -0.53 0.00 0.28 -1.26 -2.12 120.64 111.84 1fpt n GLU 81 Ca 0.18 0.10 0.09 0.00 -0.16 0.00 0.00 57.16 57.36 1fpt n GLU 81 Cb 0.59 -1.50 0.32 0.00 1.43 0.00 0.00 31.44 32.29 1fpt n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1fpt n ASP 82 N -1.11 4.27 -4.71 -1.84 8.00 -0.55 -4.90 116.55 115.71 1fpt n ASP 82 Ca 0.03 -2.34 -0.42 0.00 0.71 0.00 0.00 54.79 52.77 1fpt n ASP 82 Cb 0.02 -0.54 -0.03 0.00 -0.02 0.00 0.00 41.12 40.55 1fpt n ASP 82 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1fpt n LEU 83 N 1.10 3.96 0.00 0.64 4.77 -0.90 -4.81 117.00 121.76 1fpt n LEU 83 Ca 0.23 1.04 0.00 0.00 -0.03 0.00 0.00 56.01 57.25 1fpt n LEU 83 Cb 0.78 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 1fpt n LEU 83 CO 0.21 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1fpt n GLY 84 N 4.03 -1.34 3.62 -0.72 0.00 -1.24 -4.51 105.19 105.02 1fpt n GLY 84 Ca 0.17 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.68 1fpt n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fpt s VAL 85 N -3.00 4.32 -0.22 1.61 1.01 -0.92 -0.58 120.40 122.63 1fpt s VAL 85 Ca 0.00 -0.22 -0.10 0.00 0.00 0.00 0.00 61.98 61.66 1fpt s VAL 85 Cb 0.00 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 1fpt s VAL 85 CO 0.00 0.54 0.13 -0.31 0.00 0.00 0.00 175.10 175.46 1fpt s TYR 86 N -0.20 3.33 -0.12 5.22 1.51 -0.28 -1.56 117.35 125.25 1fpt s TYR 86 Ca 0.05 0.21 -0.04 0.00 -1.01 0.00 0.00 57.07 56.28 1fpt s TYR 86 Cb -0.12 -2.21 -0.04 0.00 -0.11 0.00 0.00 41.96 39.48 1fpt s TYR 86 CO 0.02 0.13 0.04 -0.06 -1.11 0.00 0.00 175.55 174.58 1fpt s PHE 87 N 0.76 3.27 -0.09 2.71 0.08 -0.39 -2.64 117.98 121.69 1fpt s PHE 87 Ca 0.07 0.21 -0.05 0.00 0.12 0.00 0.00 56.93 57.28 1fpt s PHE 87 Cb -0.13 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 1fpt s PHE 87 CO 0.02 0.42 0.12 0.00 -0.10 0.00 0.00 175.22 175.68 1fpt s SER 89 N -1.22 0.22 -0.09 0.00 1.04 0.06 0.58 113.70 114.28 1fpt s SER 89 Ca 0.17 -0.62 -0.02 0.00 0.48 0.00 0.00 55.95 55.97 1fpt s SER 89 Cb -0.12 0.24 -0.03 0.00 0.10 0.00 0.00 66.02 66.21 1fpt s SER 89 CO 0.07 -0.55 -0.02 0.00 0.98 0.00 0.00 173.24 173.72 1fpt s GLN 90 N -2.98 3.06 -0.13 4.02 1.03 -0.81 -0.44 119.66 123.41 1fpt s GLN 90 Ca -0.02 -0.45 0.15 0.00 0.04 0.00 0.00 55.36 55.08 1fpt s GLN 90 Cb 0.01 -2.78 0.32 0.00 0.03 0.00 0.00 33.01 30.59 1fpt s GLN 90 CO -0.06 0.62 1.16 -1.13 -2.54 0.00 0.00 175.29 173.34 1fpt n SER 91 N 2.39 1.73 0.13 12.60 3.41 -0.53 -3.66 113.62 129.68 1fpt n SER 91 Ca -0.18 -3.17 -0.21 0.00 -0.26 0.00 0.00 58.87 55.05 1fpt n SER 91 Cb 0.53 -0.43 -0.15 0.00 -0.26 0.00 0.00 64.21 63.90 1fpt n SER 91 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1fpt h THR 92 N 1.78 1.36 -3.26 6.66 2.02 -1.87 -3.45 112.91 116.16 1fpt h THR 92 Ca -0.02 -2.86 -0.67 0.00 0.77 0.00 0.00 66.41 63.63 1fpt h THR 92 Cb 1.13 2.99 -0.31 0.00 -1.74 0.00 0.00 68.15 70.22 1fpt h THR 92 CO 0.01 0.85 -0.82 -1.00 0.37 0.00 0.00 175.52 174.93 1fpt s HIS 93 N -2.62 2.76 0.12 3.16 3.76 -1.26 -4.92 115.29 116.28 1fpt s HIS 93 Ca -0.07 -1.12 -0.30 0.00 -0.15 0.00 0.00 55.06 53.42 1fpt s HIS 93 Cb 0.05 -1.87 -0.06 0.00 1.11 0.00 0.00 32.58 31.81 1fpt s HIS 93 CO 0.92 -0.51 1.09 0.08 -0.85 0.00 0.00 174.74 175.47 1fpt s VAL 94 N 0.82 4.10 0.33 -0.90 1.01 -1.26 -3.01 120.40 121.50 1fpt s VAL 94 Ca -0.05 1.69 -0.27 0.00 0.00 0.00 0.00 61.98 63.34 1fpt s VAL 94 Cb -0.15 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.06 1fpt s VAL 94 CO -0.01 0.23 1.03 -2.84 0.00 0.00 0.00 175.10 173.51 1fpt s PRO 95 N 0.19 4.46 -0.01 2.72 0.02 -1.26 -5.04 135.00 136.07 1fpt s PRO 95 Ca 0.52 1.56 -0.30 0.00 0.02 0.00 0.00 61.00 62.80 1fpt s PRO 95 Cb -0.28 -2.86 -0.06 0.00 0.02 0.00 0.00 34.50 31.33 1fpt s PRO 95 CO 0.32 0.11 1.57 0.71 -0.33 0.00 0.00 177.00 179.38 1fpt s TYR 96 N -1.46 2.37 0.16 6.54 2.02 -1.16 -4.87 117.35 120.96 1fpt s TYR 96 Ca 0.51 0.43 0.10 0.00 -0.37 0.00 0.00 57.07 57.74 1fpt s TYR 96 Cb -0.25 -3.84 -0.04 0.00 -0.40 0.00 0.00 41.96 37.43 1fpt s TYR 96 CO 0.31 -3.39 -0.19 0.99 -1.57 0.00 0.00 175.55 171.70 1fpt s THR 97 N 3.18 2.72 0.28 -0.71 2.01 -1.24 -5.00 115.64 116.88 1fpt s THR 97 Ca 0.70 -1.75 0.10 0.00 0.31 0.00 0.00 61.69 61.05 1fpt s THR 97 Cb -0.34 -2.29 -0.05 0.00 0.01 0.00 0.00 72.50 69.83 1fpt s THR 97 CO 0.29 -0.03 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.79 1fpt s PHE 98 N -1.47 2.60 0.20 4.92 0.40 -1.26 -1.93 117.98 121.43 1fpt s PHE 98 Ca 0.20 -0.28 -0.03 0.00 -0.60 0.00 0.00 56.93 56.22 1fpt s PHE 98 Cb -0.09 -1.22 0.05 0.00 0.51 0.00 0.00 43.02 42.27 1fpt s PHE 98 CO 0.11 0.61 0.19 0.41 0.70 0.00 0.00 175.22 177.24 1fpt n GLY 99 N -0.86 -2.21 0.10 4.36 0.00 0.20 -4.66 105.19 102.11 1fpt n GLY 99 Ca -0.06 -1.50 -0.18 0.00 0.00 0.00 0.00 46.02 44.28 1fpt n GLY 99 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1fpt h GLY 100 N -0.74 0.23 0.00 -0.02 0.00 -1.88 -3.46 103.07 97.19 1fpt h GLY 100 Ca -0.07 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.67 1fpt h GLY 100 CO 0.05 0.51 0.00 0.61 0.00 0.00 0.00 176.54 177.71 1fpt n GLY 101 N 1.65 2.94 3.42 4.60 0.00 -1.26 -4.99 105.19 111.56 1fpt n GLY 101 Ca -0.14 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 1fpt n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fpt s THR 102 N -0.56 3.26 -0.82 2.61 2.01 -1.08 -4.70 115.64 116.36 1fpt s THR 102 Ca 0.00 -0.59 -0.19 0.00 0.31 0.00 0.00 61.69 61.21 1fpt s THR 102 Cb 0.00 -2.38 0.12 0.00 0.01 0.00 0.00 72.50 70.25 1fpt s THR 102 CO 0.00 0.53 1.02 -0.75 -0.69 0.00 0.00 174.62 174.73 1fpt s LYS 103 N 0.21 3.42 -0.37 4.92 2.20 -0.94 -1.12 119.74 128.06 1fpt s LYS 103 Ca -0.07 -1.52 -0.29 0.00 -0.36 0.00 0.00 55.97 53.74 1fpt s LYS 103 Cb -0.15 -4.65 -0.00 0.00 -1.51 0.00 0.00 37.83 31.52 1fpt s LYS 103 CO 0.05 -1.73 1.52 -1.17 -0.36 0.00 0.00 175.35 173.65 1fpt s LEU 104 N 2.90 3.60 -0.28 5.43 1.98 0.25 -2.70 118.68 129.86 1fpt s LEU 104 Ca 0.27 1.03 -0.16 0.00 -2.89 0.00 0.00 54.13 52.38 1fpt s LEU 104 Cb -0.10 -3.54 -0.03 0.00 0.66 0.00 0.00 46.19 43.19 1fpt s LEU 104 CO -0.03 -1.48 0.44 -1.61 -1.89 0.00 0.00 176.35 171.78 1fpt s GLU 105 N 5.07 3.94 0.35 1.98 2.02 -0.42 -3.63 118.70 128.02 1fpt s GLU 105 Ca 0.67 0.07 -0.26 0.00 0.02 0.00 0.00 54.97 55.47 1fpt s GLU 105 Cb -0.17 -3.69 -0.09 0.00 0.10 0.00 0.00 34.13 30.28 1fpt s GLU 105 CO 0.32 -0.37 1.03 0.42 0.02 0.00 0.00 175.26 176.68 1fpt s ILE 106 N 2.19 3.80 -0.71 -1.63 -1.09 -1.26 -0.78 121.20 121.72 1fpt s ILE 106 Ca 0.17 1.51 0.03 0.00 -2.23 0.00 0.00 60.65 60.13 1fpt s ILE 106 Cb -0.16 -3.84 0.34 0.00 -1.58 0.00 0.00 42.46 37.22 1fpt s ILE 106 CO 0.10 0.13 1.24 1.17 -1.23 0.00 0.00 174.94 176.36 1fpt n LYS 107 N 0.41 3.87 -0.55 2.79 4.81 1.00 -4.80 118.16 125.69 1fpt n LYS 107 Ca 0.03 -4.75 -0.28 0.00 -0.87 0.00 0.00 58.31 52.43 1fpt n LYS 107 Cb 0.49 -2.31 0.25 0.00 0.02 0.00 0.00 35.03 33.48 1fpt n LYS 107 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1fpt s ARG 108 N -3.74 -0.82 0.57 1.64 1.70 -1.26 -4.80 118.95 112.24 1fpt s ARG 108 Ca 0.46 0.90 -0.18 0.00 -0.47 0.00 0.00 55.73 56.44 1fpt s ARG 108 Cb 0.27 -1.56 -0.05 0.00 -0.57 0.00 0.00 34.95 33.04 1fpt s ARG 108 CO -0.15 -3.67 1.10 0.00 -1.08 0.00 0.00 175.30 171.50 1fpt s ALA 109 N -2.47 2.68 0.98 7.88 0.00 -1.26 -4.97 121.76 124.59 1fpt s ALA 109 Ca 0.68 0.68 -0.13 0.00 0.00 0.00 0.00 51.96 53.20 1fpt s ALA 109 Cb -0.25 -3.32 0.09 0.00 0.00 0.00 0.00 23.12 19.64 1fpt s ALA 109 CO 0.64 -0.82 0.56 -0.25 0.00 0.00 0.00 175.76 175.90 1fpt n ASP 110 N -1.58 -1.55 -3.80 0.00 8.00 -1.26 -4.97 116.55 111.39 1fpt n ASP 110 Ca 0.11 0.27 -0.12 0.00 0.71 0.00 0.00 54.79 55.75 1fpt n ASP 110 Cb 0.52 -1.24 -0.09 0.00 -0.02 0.00 0.00 41.12 40.29 1fpt n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fpt s ALA 111 N -2.43 -0.57 0.02 2.24 0.00 0.17 -4.95 121.76 116.24 1fpt s ALA 111 Ca 0.60 0.04 0.08 0.00 0.00 0.00 0.00 51.96 52.68 1fpt s ALA 111 Cb -0.21 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1fpt s ALA 111 CO 0.65 -0.29 -0.25 0.00 0.00 0.00 0.00 175.76 175.87 1fpt s ALA 112 N -1.80 2.08 0.54 0.00 0.00 -1.26 -2.64 121.76 118.67 1fpt s ALA 112 Ca -0.11 -1.15 -0.22 0.00 0.00 0.00 0.00 51.96 50.48 1fpt s ALA 112 Cb -0.04 -0.46 -0.05 0.00 0.00 0.00 0.00 23.12 22.57 1fpt s ALA 112 CO 0.01 0.49 1.31 -1.25 0.00 0.00 0.00 175.76 176.33 1fpt s PRO 113 N -1.00 3.21 -0.79 0.00 0.04 -1.26 -4.80 135.00 130.39 1fpt s PRO 113 Ca 0.10 2.13 -0.04 0.00 0.04 0.00 0.00 61.00 63.23 1fpt s PRO 113 Cb -0.10 -2.25 0.20 0.00 0.04 0.00 0.00 34.50 32.40 1fpt s PRO 113 CO 0.01 -1.10 0.67 0.99 0.04 0.00 0.00 177.00 177.60 1fpt s THR 114 N -1.36 4.39 0.19 1.26 2.01 -0.32 -4.78 115.64 117.02 1fpt s THR 114 Ca 0.71 -3.30 -0.31 0.00 0.31 0.00 0.00 61.69 59.10 1fpt s THR 114 Cb -0.38 -3.76 -0.10 0.00 0.01 0.00 0.00 72.50 68.27 1fpt s THR 114 CO 0.44 -1.00 1.55 -0.69 -0.69 0.00 0.00 174.62 174.23 1fpt s VAL 115 N -0.64 2.58 -0.11 3.82 1.01 -1.26 -2.87 120.40 122.93 1fpt s VAL 115 Ca 0.22 0.43 -0.04 0.00 0.00 0.00 0.00 61.98 62.59 1fpt s VAL 115 Cb -0.13 -3.27 0.05 0.00 0.00 0.00 0.00 36.38 33.03 1fpt s VAL 115 CO -0.08 0.04 0.10 -0.44 0.00 0.00 0.00 175.10 174.72 1fpt s SER 116 N 0.98 1.56 0.33 3.32 0.01 -1.21 -4.98 113.70 113.72 1fpt s SER 116 Ca 0.68 -0.17 -0.20 0.00 1.31 0.00 0.00 55.95 57.56 1fpt s SER 116 Cb -0.44 -0.07 -0.10 0.00 0.21 0.00 0.00 66.02 65.62 1fpt s SER 116 CO 0.34 -0.29 0.84 -0.63 0.41 0.00 0.00 173.24 173.90 1fpt s ILE 117 N 2.19 4.47 -0.21 1.44 -1.09 -1.26 -2.03 121.20 124.71 1fpt s ILE 117 Ca 0.04 1.37 -0.01 0.00 -2.23 0.00 0.00 60.65 59.82 1fpt s ILE 117 Cb -0.14 -3.76 0.06 0.00 -1.58 0.00 0.00 42.46 37.04 1fpt s ILE 117 CO -0.06 -0.05 -0.00 -0.36 -1.23 0.00 0.00 174.94 173.23 1fpt s PHE 118 N -1.84 1.63 0.68 3.97 0.40 -0.03 -5.00 117.98 117.78 1fpt s PHE 118 Ca 0.53 -1.25 -0.17 0.00 -0.60 0.00 0.00 56.93 55.44 1fpt s PHE 118 Cb -0.13 -1.27 -0.01 0.00 0.51 0.00 0.00 43.02 42.12 1fpt s PHE 118 CO 0.19 -0.68 1.01 -2.30 0.70 0.00 0.00 175.22 174.14 1fpt n PRO 119 N 4.88 0.71 -1.67 0.24 -0.02 -1.26 -1.72 135.00 136.16 1fpt n PRO 119 Ca -0.10 0.29 -0.43 0.00 -2.02 0.00 0.00 63.50 61.24 1fpt n PRO 119 Cb 0.46 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 1fpt n PRO 119 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1fpt n PRO 120 N -1.62 2.76 -0.76 0.52 -0.02 -1.25 -4.77 135.00 129.86 1fpt n PRO 120 Ca 0.14 1.01 -0.33 0.00 -2.02 0.00 0.00 63.50 62.30 1fpt n PRO 120 Cb 0.49 -2.94 0.13 0.00 -0.02 0.00 0.00 33.50 31.16 1fpt n PRO 120 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1fpt n SER 121 N 7.00 -1.95 0.05 2.55 3.41 -1.26 -4.81 113.62 118.61 1fpt n SER 121 Ca 0.20 0.26 0.13 0.00 -0.26 0.00 0.00 58.87 59.20 1fpt n SER 121 Cb 0.38 -1.19 0.51 0.00 -0.26 0.00 0.00 64.21 63.65 1fpt n SER 121 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1fpt n SER 122 N -1.65 0.33 0.03 4.04 7.64 -1.26 -2.22 113.62 120.53 1fpt n SER 122 Ca 0.06 0.54 -0.16 0.00 1.01 0.00 0.00 58.87 60.32 1fpt n SER 122 Cb 0.55 -0.62 -0.05 0.00 -1.01 0.00 0.00 64.21 63.07 1fpt n SER 122 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1fpt h GLU 123 N 0.00 0.60 -0.11 1.43 3.07 -2.01 -3.13 114.58 114.43 1fpt h GLU 123 Ca 0.00 -0.56 -0.19 0.00 -0.50 0.00 0.00 59.36 58.11 1fpt h GLU 123 Cb 0.55 0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.61 1fpt h GLU 123 CO 0.00 1.18 -0.68 0.37 -1.40 0.00 0.00 179.01 178.48 1fpt h GLN 124 N 0.38 0.65 0.00 2.33 4.15 -1.78 -2.97 115.11 117.87 1fpt h GLN 124 Ca -0.07 -0.56 -0.01 0.00 0.77 0.00 0.00 58.65 58.78 1fpt h GLN 124 Cb 1.50 0.12 -0.00 0.00 0.21 0.00 0.00 27.48 29.31 1fpt h GLN 124 CO 0.17 1.17 -0.04 -0.07 -1.93 0.00 0.00 178.83 178.13 1fpt h LEU 125 N 0.31 0.00 0.38 -2.39 3.38 -1.49 0.18 115.31 115.68 1fpt h LEU 125 Ca -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1fpt h LEU 125 Cb 1.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 1fpt h LEU 125 CO 0.14 0.04 -0.34 0.74 0.09 0.00 0.00 178.44 179.11 1fpt h THR 126 N 0.00 0.30 -0.53 0.22 2.02 -1.46 -3.36 112.91 110.09 1fpt h THR 126 Ca -0.00 0.00 -0.73 0.00 0.77 0.00 0.00 66.41 66.45 1fpt h THR 126 Cb 0.07 0.30 -0.08 0.00 -1.74 0.00 0.00 68.15 66.70 1fpt h THR 126 CO 0.01 0.00 2.75 -1.54 0.37 0.00 0.00 175.52 177.11 1fpt n SER 127 N -5.46 4.68 0.00 4.18 3.41 0.05 -4.76 113.62 115.72 1fpt n SER 127 Ca -0.10 -2.93 0.00 0.00 -0.26 0.00 0.00 58.87 55.57 1fpt n SER 127 Cb 0.36 -1.58 0.00 0.00 -0.26 0.00 0.00 64.21 62.73 1fpt n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fpt n GLY 128 N 3.53 0.00 3.25 5.00 0.00 -1.26 -4.82 105.19 110.89 1fpt n GLY 128 Ca 0.49 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.39 1fpt n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fpt s GLY 129 N -1.19 -0.15 0.12 -0.02 0.00 -1.25 -2.56 107.32 102.28 1fpt s GLY 129 Ca 0.00 0.20 0.06 0.00 0.00 0.00 0.00 44.72 44.98 1fpt s GLY 129 CO 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 173.10 172.94 1fpt s ALA 130 N -1.91 1.51 -0.14 3.20 0.00 -1.14 -3.54 121.76 119.74 1fpt s ALA 130 Ca -0.09 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 50.55 1fpt s ALA 130 Cb -0.03 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.05 1fpt s ALA 130 CO 0.01 0.10 -0.03 -1.12 0.00 0.00 0.00 175.76 174.72 1fpt s SER 131 N -2.48 2.42 -0.39 0.00 0.01 -1.26 -0.24 113.70 111.76 1fpt s SER 131 Ca 0.09 -0.48 -0.29 0.00 1.31 0.00 0.00 55.95 56.59 1fpt s SER 131 Cb -0.05 -0.74 0.02 0.00 0.21 0.00 0.00 66.02 65.46 1fpt s SER 131 CO 0.03 -0.19 1.17 -0.69 0.41 0.00 0.00 173.24 173.97 1fpt s VAL 132 N 1.76 4.26 -0.01 3.43 1.01 0.16 -3.94 120.40 127.07 1fpt s VAL 132 Ca 0.02 1.38 -0.18 0.00 0.00 0.00 0.00 61.98 63.20 1fpt s VAL 132 Cb -0.14 -4.42 -0.05 0.00 0.00 0.00 0.00 36.38 31.76 1fpt s VAL 132 CO -0.07 -0.71 0.52 -0.69 0.00 0.00 0.00 175.10 174.14 1fpt s VAL 133 N 4.27 4.97 -0.06 2.92 1.01 -0.70 -1.50 120.40 131.32 1fpt s VAL 133 Ca 0.50 1.07 0.04 0.00 0.00 0.00 0.00 61.98 63.59 1fpt s VAL 133 Cb -0.11 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 1fpt s VAL 133 CO 0.25 0.46 -0.19 0.00 0.00 0.00 0.00 175.10 175.62 1fpt s PHE 135 N 0.17 3.50 -0.74 0.00 0.08 -0.86 -0.94 117.98 119.19 1fpt s PHE 135 Ca -0.09 -2.49 -0.26 0.00 0.12 0.00 0.00 56.93 54.22 1fpt s PHE 135 Cb -0.14 -3.26 -0.00 0.00 -0.57 0.00 0.00 43.02 39.05 1fpt s PHE 135 CO 0.04 -0.92 1.65 -0.51 -0.10 0.00 0.00 175.22 175.38 1fpt s LEU 136 N 0.61 3.25 0.41 -0.37 1.43 0.74 -3.29 118.68 121.47 1fpt s LEU 136 Ca 0.12 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 1fpt s LEU 136 Cb -0.22 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.46 1fpt s LEU 136 CO -0.04 -2.17 0.58 0.20 0.23 0.00 0.00 176.35 175.15 1fpt s ASN 137 N 6.37 5.72 -1.14 2.29 0.01 -1.14 -1.40 114.94 125.66 1fpt s ASN 137 Ca 0.55 -0.22 -0.10 0.00 -0.71 0.00 0.00 52.86 52.38 1fpt s ASN 137 Cb -0.09 -0.96 0.10 0.00 0.41 0.00 0.00 41.25 40.71 1fpt s ASN 137 CO 0.12 -0.70 0.25 0.59 -1.51 0.00 0.00 177.10 175.85 1fpt n ASN 138 N -1.87 -0.56 -4.52 -1.22 4.13 -1.18 -1.18 115.26 108.86 1fpt n ASN 138 Ca 0.05 -0.81 -0.25 0.00 1.68 0.00 0.00 54.58 55.25 1fpt n ASN 138 Cb 0.59 -1.03 0.13 0.00 -1.54 0.00 0.00 39.78 37.93 1fpt n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1fpt s PHE 139 N -2.94 1.41 -0.30 3.10 -0.71 0.36 -4.61 117.98 114.28 1fpt s PHE 139 Ca 0.35 -0.21 -0.17 0.00 -1.04 0.00 0.00 56.93 55.87 1fpt s PHE 139 Cb -0.21 -3.25 0.19 0.00 -1.21 0.00 0.00 43.02 38.54 1fpt s PHE 139 CO 0.66 -2.00 1.19 -0.47 -1.34 0.00 0.00 175.22 173.25 1fpt s TYR 140 N -3.33 -0.23 0.45 3.49 5.04 -1.08 0.08 117.35 121.76 1fpt s TYR 140 Ca 0.69 0.44 -0.14 0.00 -2.44 0.00 0.00 57.07 55.62 1fpt s TYR 140 Cb -0.04 0.14 -0.07 0.00 0.35 0.00 0.00 41.96 42.34 1fpt s TYR 140 CO 0.47 -0.12 0.87 -1.25 -1.34 0.00 0.00 175.55 174.18 1fpt s PRO 141 N 1.55 3.87 0.66 4.97 0.04 -1.26 -0.65 135.00 144.18 1fpt s PRO 141 Ca -0.05 0.70 0.21 0.00 0.04 0.00 0.00 61.00 61.90 1fpt s PRO 141 Cb -0.03 -2.28 1.15 0.00 0.04 0.00 0.00 34.50 33.39 1fpt s PRO 141 CO -0.13 -0.13 1.65 1.57 0.04 0.00 0.00 177.00 179.99 1fpt h LYS 142 N 1.16 0.00 -6.18 4.56 2.10 -1.99 -3.38 116.57 112.85 1fpt h LYS 142 Ca -0.47 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 57.66 1fpt h LYS 142 Cb 1.19 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.45 1fpt h LYS 142 CO 0.63 0.00 1.18 -0.51 -2.00 0.00 0.00 179.45 178.75 1fpt s ASP 143 N -4.01 5.91 0.11 7.07 1.01 -1.26 -4.93 116.67 120.57 1fpt s ASP 143 Ca -0.02 -0.42 0.11 0.00 0.71 0.00 0.00 52.55 52.92 1fpt s ASP 143 Cb 0.06 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 1fpt s ASP 143 CO 0.20 -1.99 -0.27 -0.51 0.21 0.00 0.00 175.17 172.81 1fpt s ILE 144 N 6.80 2.22 -0.15 0.77 2.07 -1.26 -4.80 121.20 126.84 1fpt s ILE 144 Ca 0.47 -1.68 0.01 0.00 -1.41 0.00 0.00 60.65 58.04 1fpt s ILE 144 Cb -0.08 -1.95 0.02 0.00 0.13 0.00 0.00 42.46 40.58 1fpt s ILE 144 CO 0.11 0.14 -0.16 0.21 -1.91 0.00 0.00 174.94 173.34 1fpt s ASN 145 N -1.89 2.80 -0.13 4.50 3.84 0.06 -4.93 114.94 119.19 1fpt s ASN 145 Ca 0.13 -0.53 0.01 0.00 0.21 0.00 0.00 52.86 52.68 1fpt s ASN 145 Cb -0.10 -1.26 -0.01 0.00 -0.55 0.00 0.00 41.25 39.33 1fpt s ASN 145 CO 0.05 -0.03 -0.15 -0.69 -2.79 0.00 0.00 177.10 173.48 1fpt s VAL 146 N 1.39 2.78 -0.25 -5.21 1.01 -1.26 -0.39 120.40 118.47 1fpt s VAL 146 Ca 0.04 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 1fpt s VAL 146 Cb -0.13 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1fpt s VAL 146 CO -0.11 0.53 -0.04 -0.75 0.00 0.00 0.00 175.10 174.72 1fpt s LYS 147 N 0.51 2.95 0.11 2.72 2.47 -0.61 -4.98 119.74 122.90 1fpt s LYS 147 Ca -0.10 -0.91 -0.14 0.00 -1.56 0.00 0.00 55.97 53.26 1fpt s LYS 147 Cb -0.16 -3.02 -0.06 0.00 -1.46 0.00 0.00 37.83 33.12 1fpt s LYS 147 CO 0.04 -0.37 0.50 -1.58 0.16 0.00 0.00 175.35 174.10 1fpt s TRP 148 N 1.37 3.64 -0.11 4.03 0.52 -1.26 -0.94 118.94 126.18 1fpt s TRP 148 Ca 0.01 1.01 0.01 0.00 0.02 0.00 0.00 56.10 57.15 1fpt s TRP 148 Cb -0.16 -2.32 0.02 0.00 -1.15 0.00 0.00 33.47 29.85 1fpt s TRP 148 CO -0.04 0.49 -0.11 0.15 0.02 0.00 0.00 176.95 177.47 1fpt s LYS 149 N -1.75 1.82 -0.27 4.98 1.02 0.60 -0.51 119.74 125.62 1fpt s LYS 149 Ca 0.34 -0.39 -0.18 0.00 0.02 0.00 0.00 55.97 55.76 1fpt s LYS 149 Cb -0.15 -1.71 -0.02 0.00 -0.52 0.00 0.00 37.83 35.43 1fpt s LYS 149 CO 0.18 -0.18 0.54 0.42 -0.92 0.00 0.00 175.35 175.39 1fpt s ILE 150 N 1.38 5.04 -1.26 2.17 1.01 0.15 -0.63 121.20 129.06 1fpt s ILE 150 Ca -0.00 0.85 -0.12 0.00 0.00 0.00 0.00 60.65 61.38 1fpt s ILE 150 Cb -0.13 -3.87 -0.00 0.00 0.01 0.00 0.00 42.46 38.46 1fpt s ILE 150 CO -0.06 0.02 0.63 0.47 0.00 0.00 0.00 174.94 176.01 1fpt n ASP 151 N 5.62 -2.95 0.00 3.58 8.00 0.90 -1.86 116.55 129.84 1fpt n ASP 151 Ca -0.03 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.45 1fpt n ASP 151 Cb 0.49 -3.21 0.00 0.00 -0.02 0.00 0.00 41.12 38.38 1fpt n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fpt n GLY 152 N -1.82 1.90 3.41 0.44 0.00 -1.26 -4.99 105.19 102.86 1fpt n GLY 152 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 1fpt n GLY 152 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fpt s SER 153 N -3.35 3.44 0.09 1.61 0.15 -0.78 -5.05 113.70 109.81 1fpt s SER 153 Ca 0.00 -0.65 -0.31 0.00 0.70 0.00 0.00 55.95 55.69 1fpt s SER 153 Cb 0.00 -0.33 -0.10 0.00 -1.71 0.00 0.00 66.02 63.88 1fpt s SER 153 CO 0.00 0.20 1.87 -1.61 1.20 0.00 0.00 173.24 174.90 1fpt s GLU 154 N -1.86 4.14 -0.20 5.44 8.01 -1.26 -0.68 118.70 132.29 1fpt s GLU 154 Ca 0.14 2.58 -0.07 0.00 0.01 0.00 0.00 54.97 57.64 1fpt s GLU 154 Cb -0.10 -3.81 -0.03 0.00 -4.31 0.00 0.00 34.13 25.87 1fpt s GLU 154 CO 0.06 -0.88 0.05 0.08 0.01 0.00 0.00 175.26 174.57 1fpt s VAL 155 N 3.41 4.43 -0.38 2.63 1.01 0.33 -4.87 120.40 126.95 1fpt s VAL 155 Ca 0.83 -0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.73 1fpt s VAL 155 Cb -0.44 -3.02 0.69 0.00 0.00 0.00 0.00 36.38 33.61 1fpt s VAL 155 CO 0.38 0.42 1.84 0.00 0.00 0.00 0.00 175.10 177.74 1fpt n GLN 156 N 4.06 2.84 -4.14 2.72 1.13 -1.26 -4.53 117.38 118.19 1fpt n GLN 156 Ca -0.17 -3.06 -0.10 0.00 -1.94 0.00 0.00 57.00 51.73 1fpt n GLN 156 Cb 0.52 -2.17 -0.10 0.00 0.11 0.00 0.00 30.24 28.60 1fpt n GLN 156 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1fpt s ASN 157 N -1.30 1.00 -0.37 1.08 3.84 -1.26 -4.72 114.94 113.22 1fpt s ASN 157 Ca 0.55 -0.95 0.00 0.00 0.21 0.00 0.00 52.86 52.67 1fpt s ASN 157 Cb 0.46 0.10 0.00 0.00 -0.55 0.00 0.00 41.25 41.26 1fpt s ASN 157 CO 0.11 -0.46 0.00 0.61 -2.79 0.00 0.00 177.10 174.57 1fpt n GLY 158 N 0.15 -0.04 3.78 1.21 0.00 -1.26 -4.73 105.19 104.30 1fpt n GLY 158 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 1fpt n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fpt s VAL 159 N -1.73 4.26 -0.36 1.61 1.01 -1.26 -2.81 120.40 121.13 1fpt s VAL 159 Ca 0.00 1.76 0.04 0.00 0.00 0.00 0.00 61.98 63.78 1fpt s VAL 159 Cb 0.00 -4.01 0.16 0.00 0.00 0.00 0.00 36.38 32.53 1fpt s VAL 159 CO 0.00 0.18 0.45 -0.22 0.00 0.00 0.00 175.10 175.51 1fpt s LEU 160 N -1.97 -0.62 -0.00 3.92 2.96 -0.36 -4.97 118.68 117.64 1fpt s LEU 160 Ca 0.48 -1.09 -0.30 0.00 -0.22 0.00 0.00 54.13 53.00 1fpt s LEU 160 Cb -0.19 1.06 -0.03 0.00 0.50 0.00 0.00 46.19 47.53 1fpt s LEU 160 CO 0.24 -0.26 1.04 0.20 -1.32 0.00 0.00 176.35 176.25 1fpt s ASN 161 N 1.80 7.27 -0.10 3.68 0.01 -1.26 -1.94 114.94 124.41 1fpt s ASN 161 Ca 0.15 1.73 0.03 0.00 -0.71 0.00 0.00 52.86 54.06 1fpt s ASN 161 Cb -0.12 -2.57 -0.01 0.00 0.41 0.00 0.00 41.25 38.97 1fpt s ASN 161 CO -0.11 -0.35 -0.21 -0.55 -1.51 0.00 0.00 177.10 174.38 1fpt s SER 162 N 1.06 3.37 -0.10 -1.22 0.15 -0.10 -4.99 113.70 111.88 1fpt s SER 162 Ca 0.53 -0.47 -0.00 0.00 0.70 0.00 0.00 55.95 56.71 1fpt s SER 162 Cb -0.23 -1.32 -0.03 0.00 -1.71 0.00 0.00 66.02 62.74 1fpt s SER 162 CO 0.27 0.19 -0.07 0.26 1.20 0.00 0.00 173.24 175.09 1fpt s TRP 163 N 0.19 2.94 0.73 3.44 0.51 -1.26 -1.54 118.94 123.94 1fpt s TRP 163 Ca -0.12 -0.13 -0.06 0.00 -2.12 0.00 0.00 56.10 53.67 1fpt s TRP 163 Cb -0.16 -1.79 0.09 0.00 -0.81 0.00 0.00 33.47 30.80 1fpt s TRP 163 CO 0.07 0.18 1.03 0.99 -0.51 0.00 0.00 176.95 178.71 1fpt s THR 164 N -0.40 2.25 0.05 2.01 2.01 -0.57 -5.01 115.64 115.98 1fpt s THR 164 Ca 0.06 -0.32 -0.08 0.00 0.31 0.00 0.00 61.69 61.65 1fpt s THR 164 Cb -0.12 -2.93 -0.05 0.00 0.01 0.00 0.00 72.50 69.41 1fpt s THR 164 CO 0.02 0.00 0.34 -0.62 -0.69 0.00 0.00 174.62 173.67 1fpt s ASP 165 N -4.59 6.57 -0.02 3.53 -1.08 -1.26 -4.66 116.67 115.16 1fpt s ASP 165 Ca 0.63 0.68 -0.40 0.00 -0.52 0.00 0.00 52.55 52.94 1fpt s ASP 165 Cb -0.09 -2.14 -0.19 0.00 -1.46 0.00 0.00 42.92 39.04 1fpt s ASP 165 CO 0.45 0.21 1.18 1.67 0.52 0.00 0.00 175.17 179.20 1fpt n GLN 166 N 0.98 0.28 -2.05 4.34 7.27 -1.26 -4.77 117.38 122.17 1fpt n GLN 166 Ca -0.09 0.10 -0.41 0.00 0.07 0.00 0.00 57.00 56.67 1fpt n GLN 166 Cb 0.52 -1.64 -0.02 0.00 2.41 0.00 0.00 30.24 31.51 1fpt n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1fpt s ASP 167 N 0.41 6.69 0.01 1.69 2.15 -0.52 -4.88 116.67 122.22 1fpt s ASP 167 Ca 0.91 2.65 -0.17 0.00 0.43 0.00 0.00 52.55 56.36 1fpt s ASP 167 Cb -1.21 -2.63 -0.10 0.00 -0.30 0.00 0.00 42.92 38.69 1fpt s ASP 167 CO 0.57 -0.66 1.00 -1.28 -0.17 0.00 0.00 175.17 174.63 1fpt h SER 168 N 4.82 -0.53 0.70 -0.34 0.87 -1.88 0.37 113.55 117.57 1fpt h SER 168 Ca -0.46 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.09 1fpt h SER 168 Cb 1.22 0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1fpt h SER 168 CO 0.76 -0.30 -0.12 0.50 -0.53 0.00 0.00 176.83 177.14 1fpt h LYS 169 N -0.78 0.00 0.00 2.24 3.64 -1.94 -3.31 116.57 116.41 1fpt h LYS 169 Ca -0.06 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1fpt h LYS 169 Cb 0.48 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1fpt h LYS 169 CO 0.10 0.12 -0.48 -0.40 -2.27 0.00 0.00 179.45 176.52 1fpt n ASP 170 N -3.37 0.12 -0.15 4.20 5.75 -1.23 -4.99 116.55 116.87 1fpt n ASP 170 Ca -0.01 -2.05 -0.02 0.00 -0.01 0.00 0.00 54.79 52.71 1fpt n ASP 170 Cb 0.31 -0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 40.18 1fpt n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1fpt n SER 171 N -0.06 -4.94 -4.86 -1.12 7.64 0.13 -4.87 113.62 105.56 1fpt n SER 171 Ca 0.01 0.04 -0.33 0.00 1.01 0.00 0.00 58.87 59.60 1fpt n SER 171 Cb 0.70 -3.10 -0.06 0.00 -1.01 0.00 0.00 64.21 60.74 1fpt n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1fpt s THR 172 N -1.00 5.14 0.73 0.44 -4.23 -1.26 -4.39 115.64 111.07 1fpt s THR 172 Ca 0.00 -0.29 -0.05 0.00 -1.18 0.00 0.00 61.69 60.17 1fpt s THR 172 Cb 0.00 -3.39 0.10 0.00 1.34 0.00 0.00 72.50 70.55 1fpt s THR 172 CO 0.00 0.31 1.03 -0.31 -0.54 0.00 0.00 174.62 175.12 1fpt s TYR 173 N -1.29 2.29 0.13 3.99 2.02 0.11 -1.45 117.35 123.15 1fpt s TYR 173 Ca 0.26 0.15 -0.25 0.00 -0.37 0.00 0.00 57.07 56.87 1fpt s TYR 173 Cb -0.12 -3.24 0.07 0.00 -0.40 0.00 0.00 41.96 38.27 1fpt s TYR 173 CO 0.18 -1.64 0.72 -1.12 -1.57 0.00 0.00 175.55 172.12 1fpt s SER 174 N -4.63 -0.45 -0.22 2.29 0.01 -1.26 -0.49 113.70 108.95 1fpt s SER 174 Ca 0.64 -0.10 -0.18 0.00 1.31 0.00 0.00 55.95 57.61 1fpt s SER 174 Cb -0.08 0.55 0.06 0.00 0.21 0.00 0.00 66.02 66.76 1fpt s SER 174 CO 0.45 -0.91 0.58 -0.32 0.41 0.00 0.00 173.24 173.44 1fpt s MET 175 N -3.56 0.65 -0.02 12.44 1.75 -0.49 -1.52 119.30 128.55 1fpt s MET 175 Ca 0.04 0.86 0.00 0.00 -1.25 0.00 0.00 55.69 55.35 1fpt s MET 175 Cb -0.02 0.26 -0.04 0.00 2.84 0.00 0.00 34.83 37.88 1fpt s MET 175 CO -0.08 -0.10 0.02 0.45 -0.65 0.00 0.00 175.02 174.65 1fpt s SER 176 N 0.62 5.25 -0.11 1.11 0.15 -0.59 -0.18 113.70 119.95 1fpt s SER 176 Ca -0.03 0.05 -0.01 0.00 0.70 0.00 0.00 55.95 56.66 1fpt s SER 176 Cb -0.05 -1.42 0.03 0.00 -1.71 0.00 0.00 66.02 62.88 1fpt s SER 176 CO -0.04 0.30 -0.02 -0.55 1.20 0.00 0.00 173.24 174.13 1fpt s SER 177 N -1.46 2.09 -0.11 5.45 0.15 -0.11 -0.92 113.70 118.79 1fpt s SER 177 Ca 0.19 -0.32 0.03 0.00 0.70 0.00 0.00 55.95 56.54 1fpt s SER 177 Cb -0.12 -0.62 -0.01 0.00 -1.71 0.00 0.00 66.02 63.56 1fpt s SER 177 CO 0.09 -0.19 -0.20 -0.89 1.20 0.00 0.00 173.24 173.26 1fpt s THR 178 N 1.85 2.46 -0.18 6.45 2.01 -0.82 -0.49 115.64 126.92 1fpt s THR 178 Ca 0.04 -0.88 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 1fpt s THR 178 Cb -0.13 -1.98 -0.03 0.00 0.01 0.00 0.00 72.50 70.37 1fpt s THR 178 CO -0.07 0.55 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.18 1fpt s LEU 179 N 0.27 3.28 -0.20 4.42 0.20 -0.56 -1.23 118.68 124.87 1fpt s LEU 179 Ca -0.14 -0.15 0.01 0.00 0.69 0.00 0.00 54.13 54.54 1fpt s LEU 179 Cb -0.17 -1.81 0.03 0.00 -0.43 0.00 0.00 46.19 43.81 1fpt s LEU 179 CO 0.07 0.12 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.20 1fpt s THR 180 N 0.64 2.20 0.55 3.68 2.01 -1.12 0.38 115.64 123.97 1fpt s THR 180 Ca -0.01 -1.03 0.08 0.00 0.31 0.00 0.00 61.69 61.03 1fpt s THR 180 Cb -0.14 -2.00 0.06 0.00 0.01 0.00 0.00 72.50 70.43 1fpt s THR 180 CO 0.02 0.42 0.63 -0.76 -0.69 0.00 0.00 174.62 174.24 1fpt s LEU 181 N 1.27 3.00 0.90 4.42 1.43 0.67 -4.81 118.68 125.56 1fpt s LEU 181 Ca 0.02 -0.96 -0.14 0.00 -1.03 0.00 0.00 54.13 52.02 1fpt s LEU 181 Cb -0.14 -1.54 0.15 0.00 0.03 0.00 0.00 46.19 44.69 1fpt s LEU 181 CO -0.11 -1.21 1.26 0.42 0.23 0.00 0.00 176.35 176.95 1fpt s THR 182 N -2.68 2.01 0.06 5.49 -4.23 -1.26 -2.90 115.64 112.13 1fpt s THR 182 Ca 0.51 -0.02 -0.28 0.00 -1.18 0.00 0.00 61.69 60.73 1fpt s THR 182 Cb -0.05 -2.99 -0.14 0.00 1.34 0.00 0.00 72.50 70.66 1fpt s THR 182 CO 0.32 0.00 1.43 0.50 -0.54 0.00 0.00 174.62 176.33 1fpt h LYS 183 N -1.39 -0.85 -0.08 3.99 3.64 -1.75 -1.09 116.57 119.03 1fpt h LYS 183 Ca -0.45 0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.02 1fpt h LYS 183 Cb 1.27 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 33.22 1fpt h LYS 183 CO 0.49 -0.57 -0.47 -0.44 -2.27 0.00 0.00 179.45 176.18 1fpt h ASP 184 N -0.89 -1.48 0.45 4.20 3.32 -1.94 0.78 116.42 120.86 1fpt h ASP 184 Ca -0.07 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1fpt h ASP 184 Cb 0.73 0.58 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1fpt h ASP 184 CO 0.04 -0.47 0.00 1.21 -1.72 0.00 0.00 179.24 178.30 1fpt n GLU 185 N -5.45 0.18 0.24 3.56 2.13 -1.23 0.11 120.64 120.19 1fpt n GLU 185 Ca -0.05 0.52 -0.10 0.00 0.66 0.00 0.00 57.16 58.18 1fpt n GLU 185 Cb 0.38 -1.92 -0.05 0.00 0.27 0.00 0.00 31.44 30.12 1fpt n GLU 185 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1fpt h TYR 186 N 0.00 -0.58 0.00 4.31 3.20 0.33 -3.40 116.97 120.83 1fpt h TYR 186 Ca 0.00 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1fpt h TYR 186 Cb 0.23 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.69 1fpt h TYR 186 CO 0.00 -0.36 -0.04 0.93 -1.64 0.00 0.00 178.16 177.05 1fpt h GLU 187 N -0.85 0.00 -2.04 1.82 5.08 0.19 -3.16 114.58 115.62 1fpt h GLU 187 Ca -0.06 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.60 1fpt h GLU 187 Cb 0.48 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.49 1fpt h GLU 187 CO 0.11 0.04 0.92 2.89 -1.00 0.00 0.00 179.01 181.97 1fpt n ARG 188 N -3.60 2.93 -3.55 2.33 1.85 -0.37 -4.85 116.66 111.40 1fpt n ARG 188 Ca -0.02 -3.28 -0.16 0.00 -1.00 0.00 0.00 57.85 53.38 1fpt n ARG 188 Cb 0.14 -2.26 -0.06 0.00 -1.05 0.00 0.00 32.46 29.22 1fpt n ARG 188 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1fpt s HIS 189 N -3.34 -0.62 -0.01 2.89 3.76 -1.19 -5.02 115.29 111.76 1fpt s HIS 189 Ca 0.53 1.16 0.02 0.00 -0.15 0.00 0.00 55.06 56.61 1fpt s HIS 189 Cb 0.40 0.40 -0.02 0.00 1.11 0.00 0.00 32.58 34.46 1fpt s HIS 189 CO -0.33 -0.52 0.02 0.27 -0.85 0.00 0.00 174.74 173.33 1fpt n ASN 190 N 1.18 4.60 -4.63 1.40 0.23 -1.26 -4.69 115.26 112.09 1fpt n ASN 190 Ca -0.17 0.00 -0.32 0.00 -0.53 0.00 0.00 54.58 53.56 1fpt n ASN 190 Cb 0.57 0.81 -0.10 0.00 -2.08 0.00 0.00 39.78 38.98 1fpt n ASN 190 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 1fpt s SER 191 N -2.70 4.84 -0.02 0.53 0.01 -1.26 0.89 113.70 115.99 1fpt s SER 191 Ca -0.01 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1fpt s SER 191 Cb 0.01 -1.19 0.02 0.00 0.21 0.00 0.00 66.02 65.07 1fpt s SER 191 CO 0.07 0.28 -0.00 -0.31 0.41 0.00 0.00 173.24 173.69 1fpt s TYR 192 N -1.04 0.20 -0.06 2.43 2.02 -0.47 -0.07 117.35 120.35 1fpt s TYR 192 Ca 0.18 0.01 -0.01 0.00 -0.37 0.00 0.00 57.07 56.88 1fpt s TYR 192 Cb -0.11 -0.25 0.03 0.00 -0.40 0.00 0.00 41.96 41.22 1fpt s TYR 192 CO 0.09 -0.07 0.01 0.99 -1.57 0.00 0.00 175.55 175.00 1fpt s THR 193 N 0.60 0.30 -0.36 -0.71 2.01 0.20 0.18 115.64 117.86 1fpt s THR 193 Ca -0.06 0.17 -0.12 0.00 0.31 0.00 0.00 61.69 61.99 1fpt s THR 193 Cb -0.08 -0.47 0.01 0.00 0.01 0.00 0.00 72.50 71.97 1fpt s THR 193 CO -0.01 0.24 0.22 0.00 -0.69 0.00 0.00 174.62 174.38 1fpt s GLU 195 N 1.63 2.30 -0.13 0.00 -1.05 -0.12 -2.63 118.70 118.70 1fpt s GLU 195 Ca 0.04 -0.57 -0.08 0.00 -0.15 0.00 0.00 54.97 54.21 1fpt s GLU 195 Cb -0.18 -2.04 -0.04 0.00 -0.44 0.00 0.00 34.13 31.43 1fpt s GLU 195 CO 0.08 -0.16 0.15 0.00 0.95 0.00 0.00 175.26 176.28 1fpt s ALA 196 N 1.27 3.84 -0.03 -0.84 0.00 -1.25 -1.57 121.76 123.18 1fpt s ALA 196 Ca 0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 51.96 51.33 1fpt s ALA 196 Cb -0.14 -2.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 1fpt s ALA 196 CO -0.07 0.54 0.03 0.99 0.00 0.00 0.00 175.76 177.25 1fpt s THR 197 N -0.80 4.39 0.00 0.00 2.01 0.47 -1.32 115.64 120.38 1fpt s THR 197 Ca 0.14 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.70 1fpt s THR 197 Cb -0.12 -2.94 0.00 0.00 0.01 0.00 0.00 72.50 69.45 1fpt s THR 197 CO 0.03 0.43 0.00 1.57 -0.69 0.00 0.00 174.62 175.97 1fpt n HIS 198 N 1.54 0.00 -0.10 4.92 -0.00 -1.26 -0.76 115.22 119.55 1fpt n HIS 198 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.57 1fpt n HIS 198 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 1fpt n HIS 198 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1fpt n LYS 199 N 0.00 2.83 0.11 1.57 4.81 -1.26 -4.88 118.16 121.33 1fpt n LYS 199 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1fpt n LYS 199 Cb 0.00 -0.24 -0.02 0.00 0.02 0.00 0.00 35.03 34.79 1fpt n LYS 199 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1fpt h THR 200 N 0.00 0.98 -3.45 3.15 2.02 -1.94 -3.43 112.91 110.24 1fpt h THR 200 Ca 0.00 -2.43 -0.25 0.00 0.77 0.00 0.00 66.41 64.50 1fpt h THR 200 Cb 0.00 2.45 -0.31 0.00 -1.74 0.00 0.00 68.15 68.56 1fpt h THR 200 CO 0.00 0.56 -0.65 -0.55 0.37 0.00 0.00 175.52 175.25 1fpt s SER 201 N -6.41 -0.05 0.37 4.18 0.15 -1.26 -5.02 113.70 105.66 1fpt s SER 201 Ca 0.02 0.17 0.26 0.00 0.70 0.00 0.00 55.95 57.10 1fpt s SER 201 Cb 0.08 0.10 0.80 0.00 -1.71 0.00 0.00 66.02 65.29 1fpt s SER 201 CO 0.77 -0.09 1.75 0.00 1.20 0.00 0.00 173.24 176.87 1fpt h THR 202 N 5.72 0.00 -2.98 6.45 1.03 -1.95 -3.40 112.91 117.79 1fpt h THR 202 Ca -0.37 -0.62 -0.59 0.00 -0.01 0.00 0.00 66.41 64.82 1fpt h THR 202 Cb 1.16 1.58 -0.03 0.00 -1.07 0.00 0.00 68.15 69.79 1fpt h THR 202 CO 0.46 0.00 -0.41 -0.94 -0.01 0.00 0.00 175.52 174.62 1fpt s SER 203 N -5.31 6.41 0.30 0.00 1.04 -1.26 -5.01 113.70 109.88 1fpt s SER 203 Ca 0.06 0.40 -0.30 0.00 0.48 0.00 0.00 55.95 56.60 1fpt s SER 203 Cb 0.09 -2.01 -0.12 0.00 0.10 0.00 0.00 66.02 64.08 1fpt s SER 203 CO 0.58 0.09 1.57 -2.65 0.98 0.00 0.00 173.24 173.81 1fpt n PRO 204 N 0.04 2.67 -1.46 4.02 -0.02 -1.26 -4.84 135.00 134.15 1fpt n PRO 204 Ca -0.04 0.95 -0.33 0.00 -2.02 0.00 0.00 63.50 62.06 1fpt n PRO 204 Cb 0.52 -2.72 -0.05 0.00 -0.02 0.00 0.00 33.50 31.23 1fpt n PRO 204 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1fpt n ILE 205 N 1.92 4.23 -1.68 4.25 5.41 -0.44 -4.85 119.36 128.21 1fpt n ILE 205 Ca 0.08 -2.90 -0.49 0.00 1.00 0.00 0.00 62.75 60.44 1fpt n ILE 205 Cb 0.37 -2.25 -0.05 0.00 -0.71 0.00 0.00 39.64 37.00 1fpt n ILE 205 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1fpt n VAL 206 N 2.60 0.45 -4.26 1.39 0.31 -1.26 -4.39 118.33 113.18 1fpt n VAL 206 Ca 0.65 -0.08 -0.23 0.00 -0.01 0.00 0.00 64.34 64.67 1fpt n VAL 206 Cb 0.39 -1.75 -0.07 0.00 -0.91 0.00 0.00 33.84 31.50 1fpt n VAL 206 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1fpt s LYS 207 N 3.44 2.32 -0.28 5.55 2.47 -1.08 -5.03 119.74 127.13 1fpt s LYS 207 Ca 0.91 -1.45 -0.25 0.00 -1.56 0.00 0.00 55.97 53.63 1fpt s LYS 207 Cb -0.72 -2.16 0.10 0.00 -1.46 0.00 0.00 37.83 33.58 1fpt s LYS 207 CO 0.50 0.31 0.90 -1.54 0.16 0.00 0.00 175.35 175.69 1fpt s SER 208 N -3.71 -0.58 0.24 1.43 1.04 -1.26 -2.31 113.70 108.55 1fpt s SER 208 Ca 0.33 1.11 0.02 0.00 0.48 0.00 0.00 55.95 57.88 1fpt s SER 208 Cb -0.05 1.13 -0.05 0.00 0.10 0.00 0.00 66.02 67.14 1fpt s SER 208 CO 0.21 -0.19 0.07 0.72 0.98 0.00 0.00 173.24 175.03 1fpt s PHE 209 N 0.35 1.49 -0.25 5.02 -0.71 0.13 -4.98 117.98 119.03 1fpt s PHE 209 Ca 0.01 -1.13 0.02 0.00 -1.04 0.00 0.00 56.93 54.79 1fpt s PHE 209 Cb -0.05 -0.87 0.05 0.00 -1.21 0.00 0.00 43.02 40.94 1fpt s PHE 209 CO -0.04 -0.28 -0.11 -0.80 -1.34 0.00 0.00 175.22 172.64 1fpt s ASN 210 N -3.29 4.22 0.20 1.98 0.02 -1.26 -1.37 114.94 115.43 1fpt s ASN 210 Ca 0.34 -1.19 0.17 0.00 -1.02 0.00 0.00 52.86 51.16 1fpt s ASN 210 Cb 0.07 -1.56 0.64 0.00 0.02 0.00 0.00 41.25 40.42 1fpt s ASN 210 CO 0.11 -0.15 0.61 -1.14 0.02 0.00 0.00 177.10 176.55 1fpt n ARG 211 N 4.51 -0.01 -1.39 -0.60 0.63 0.26 -2.12 116.66 117.94 1fpt n ARG 211 Ca -0.16 0.45 -0.40 0.00 -0.92 0.00 0.00 57.85 56.83 1fpt n ARG 211 Cb 0.44 -0.97 -0.02 0.00 0.45 0.00 0.00 32.46 32.36 1fpt n ARG 211 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1fpt n ASN 212 N -3.06 7.85 0.28 6.15 4.13 -1.26 -4.64 115.26 124.71 1fpt n ASN 212 Ca 0.17 -2.62 -0.16 0.00 1.68 0.00 0.00 54.58 53.64 1fpt n ASN 212 Cb 0.71 -1.58 -0.09 0.00 -1.54 0.00 0.00 39.78 37.28 1fpt n ASN 212 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 1fpt h GLU 213 N 5.19 -0.89 0.00 3.52 5.08 -1.83 -3.55 114.58 122.11 1fpt h GLU 213 Ca 0.82 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 59.24 1fpt h GLU 213 Cb 0.35 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1fpt h GLU 213 CO 1.81 -0.59 0.00 0.00 -1.00 0.00 0.00 179.01 179.23