#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fg2 s HIS 3 N 0.00 1.14 0.28 6.00 3.76 -0.02 -4.92 115.29 121.53 1fg2 s HIS 3 Ca 0.00 -1.37 -0.20 0.00 -0.15 0.00 0.00 55.06 53.34 1fg2 s HIS 3 Cb 0.00 -0.55 0.02 0.00 1.11 0.00 0.00 32.58 33.16 1fg2 s HIS 3 CO 0.00 -0.64 0.70 -1.54 -0.85 0.00 0.00 174.74 172.41 1fg2 s SER 4 N -3.16 -0.24 -0.10 1.40 1.04 -1.26 0.11 113.70 111.49 1fg2 s SER 4 Ca 0.38 -0.64 -0.12 0.00 0.48 0.00 0.00 55.95 56.06 1fg2 s SER 4 Cb 0.07 0.72 0.03 0.00 0.10 0.00 0.00 66.02 66.94 1fg2 s SER 4 CO 0.12 -1.33 0.32 -0.32 0.98 0.00 0.00 173.24 173.00 1fg2 s MET 5 N -3.92 0.44 -0.00 4.02 1.75 -0.77 -0.69 119.30 120.13 1fg2 s MET 5 Ca 0.12 0.30 -0.09 0.00 -1.25 0.00 0.00 55.69 54.77 1fg2 s MET 5 Cb -0.06 0.21 0.01 0.00 2.84 0.00 0.00 34.83 37.83 1fg2 s MET 5 CO 0.07 -0.07 0.18 1.03 -0.65 0.00 0.00 175.02 175.58 1fg2 s ARG 6 N -0.17 0.52 -0.17 4.11 1.81 0.24 -2.06 118.95 123.23 1fg2 s ARG 6 Ca -0.03 -0.32 -0.01 0.00 -1.72 0.00 0.00 55.73 53.65 1fg2 s ARG 6 Cb -0.03 0.22 0.05 0.00 -0.45 0.00 0.00 34.95 34.74 1fg2 s ARG 6 CO 0.01 -0.13 -0.03 0.71 -0.68 0.00 0.00 175.30 175.18 1fg2 s TYR 7 N -1.31 1.60 -0.40 -0.53 2.02 -0.05 0.58 117.35 119.27 1fg2 s TYR 7 Ca -0.14 -1.06 -0.14 0.00 -0.37 0.00 0.00 57.07 55.36 1fg2 s TYR 7 Cb -0.07 -1.26 0.02 0.00 -0.40 0.00 0.00 41.96 40.25 1fg2 s TYR 7 CO 0.02 -0.61 0.28 -0.06 -1.57 0.00 0.00 175.55 173.60 1fg2 s PHE 8 N 1.67 3.24 0.02 2.71 0.40 0.12 -2.34 117.98 123.79 1fg2 s PHE 8 Ca 0.00 -0.67 0.02 0.00 -0.60 0.00 0.00 56.93 55.68 1fg2 s PHE 8 Cb -0.16 -2.55 -0.04 0.00 0.51 0.00 0.00 43.02 40.78 1fg2 s PHE 8 CO -0.07 -0.60 0.02 -1.21 0.70 0.00 0.00 175.22 174.06 1fg2 s GLU 9 N 1.65 2.79 -0.01 0.44 2.02 -0.02 -0.97 118.70 124.60 1fg2 s GLU 9 Ca 0.04 -0.65 -0.02 0.00 0.02 0.00 0.00 54.97 54.36 1fg2 s GLU 9 Cb -0.19 -2.68 -0.00 0.00 0.10 0.00 0.00 34.13 31.36 1fg2 s GLU 9 CO 0.09 0.60 0.05 0.99 0.02 0.00 0.00 175.26 177.02 1fg2 s THR 10 N -1.18 0.05 -0.11 3.63 2.01 0.13 -0.87 115.64 119.30 1fg2 s THR 10 Ca 0.22 -0.39 -0.03 0.00 0.31 0.00 0.00 61.69 61.81 1fg2 s THR 10 Cb -0.12 -0.20 0.04 0.00 0.01 0.00 0.00 72.50 72.23 1fg2 s THR 10 CO 0.14 -0.21 0.05 0.00 -0.69 0.00 0.00 174.62 173.90 1fg2 s ALA 11 N -0.65 0.51 -0.10 7.40 0.00 -0.22 -0.49 121.76 128.21 1fg2 s ALA 11 Ca -0.07 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 51.76 1fg2 s ALA 11 Cb -0.04 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.21 1fg2 s ALA 11 CO 0.00 -0.78 -0.17 0.14 0.00 0.00 0.00 175.76 174.95 1fg2 s VAL 12 N 2.07 2.71 -0.01 0.00 -7.23 -0.28 -1.47 120.40 116.19 1fg2 s VAL 12 Ca 0.03 -0.81 0.04 0.00 -1.81 0.00 0.00 61.98 59.44 1fg2 s VAL 12 Cb -0.14 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.69 1fg2 s VAL 12 CO -0.06 0.55 -0.13 -0.94 -0.31 0.00 0.00 175.10 174.21 1fg2 s SER 13 N 0.03 4.12 0.06 4.85 1.04 -0.26 -0.76 113.70 122.78 1fg2 s SER 13 Ca -0.06 -0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.14 1fg2 s SER 13 Cb -0.15 -0.84 -0.03 0.00 0.10 0.00 0.00 66.02 65.10 1fg2 s SER 13 CO 0.05 0.31 -0.08 -0.13 0.98 0.00 0.00 173.24 174.37 1fg2 s ARG 14 N -1.09 0.64 0.27 4.02 0.52 -1.26 -1.82 118.95 120.23 1fg2 s ARG 14 Ca 0.14 -0.96 -0.30 0.00 -0.52 0.00 0.00 55.73 54.08 1fg2 s ARG 14 Cb -0.11 -0.28 -0.13 0.00 0.52 0.00 0.00 34.95 34.95 1fg2 s ARG 14 CO 0.04 0.03 1.33 -2.30 0.02 0.00 0.00 175.30 174.42 1fg2 n PRO 15 N 0.94 1.97 -1.49 3.54 -0.02 -1.24 -1.35 135.00 137.35 1fg2 n PRO 15 Ca -0.19 0.70 -0.17 0.00 -2.02 0.00 0.00 63.50 61.82 1fg2 n PRO 15 Cb 0.57 -2.30 -0.07 0.00 -0.02 0.00 0.00 33.50 31.67 1fg2 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fg2 n GLY 16 N 1.68 1.63 0.01 -1.23 0.00 -1.26 -4.79 105.19 101.23 1fg2 n GLY 16 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 1fg2 n GLY 16 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fg2 n LEU 17 N -2.00 0.32 0.00 0.99 7.94 -0.46 -5.01 117.00 118.79 1fg2 n LEU 17 Ca -0.17 -0.12 0.00 0.00 -1.11 0.00 0.00 56.01 54.60 1fg2 n LEU 17 Cb 0.62 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.57 1fg2 n LEU 17 CO 0.26 0.06 0.00 -0.62 -1.11 0.00 0.00 177.39 175.98 1fg2 n GLU 18 N -2.05 0.00 -4.10 1.96 -0.58 -1.26 -4.80 120.64 109.80 1fg2 n GLU 18 Ca -0.01 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.38 1fg2 n GLU 18 Cb 0.50 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.30 1fg2 n GLU 18 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1fg2 s GLU 19 N 0.00 3.19 0.63 3.49 0.41 -1.26 -4.99 118.70 120.17 1fg2 s GLU 19 Ca 0.00 -0.33 -0.15 0.00 -0.41 0.00 0.00 54.97 54.08 1fg2 s GLU 19 Cb 0.00 -2.97 -0.02 0.00 -1.78 0.00 0.00 34.13 29.37 1fg2 s GLU 19 CO 0.00 0.71 1.09 -1.25 -0.49 0.00 0.00 175.26 175.32 1fg2 s PRO 20 N -1.22 3.05 -0.15 0.39 0.04 -1.26 -4.84 135.00 131.01 1fg2 s PRO 20 Ca 0.17 1.30 -0.13 0.00 0.04 0.00 0.00 61.00 62.38 1fg2 s PRO 20 Cb -0.12 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 1fg2 s PRO 20 CO 0.07 -1.04 0.28 0.50 0.04 0.00 0.00 177.00 176.85 1fg2 s ARG 21 N -4.09 4.15 -0.18 4.56 3.52 0.06 -4.87 118.95 122.09 1fg2 s ARG 21 Ca 0.65 0.08 -0.03 0.00 -0.13 0.00 0.00 55.73 56.30 1fg2 s ARG 21 Cb -0.18 -3.39 -0.02 0.00 -1.56 0.00 0.00 34.95 29.80 1fg2 s ARG 21 CO 0.39 0.33 -0.05 -0.47 -0.81 0.00 0.00 175.30 174.69 1fg2 s TYR 22 N 0.19 2.96 -0.07 5.12 5.04 -1.26 -1.12 117.35 128.21 1fg2 s TYR 22 Ca 0.16 -0.63 0.02 0.00 -2.44 0.00 0.00 57.07 54.19 1fg2 s TYR 22 Cb -0.13 -2.01 0.01 0.00 0.35 0.00 0.00 41.96 40.18 1fg2 s TYR 22 CO 0.04 -0.30 -0.13 0.42 -1.34 0.00 0.00 175.55 174.25 1fg2 s ILE 23 N 0.88 1.16 -0.07 3.14 1.09 0.35 -0.90 121.20 126.85 1fg2 s ILE 23 Ca -0.01 -0.50 0.03 0.00 -1.10 0.00 0.00 60.65 59.07 1fg2 s ILE 23 Cb -0.15 -1.06 0.01 0.00 -1.06 0.00 0.00 42.46 40.20 1fg2 s ILE 23 CO 0.01 0.36 -0.15 -0.55 -0.10 0.00 0.00 174.94 174.52 1fg2 s SER 24 N 0.63 2.01 -0.06 3.58 0.15 0.15 0.18 113.70 120.34 1fg2 s SER 24 Ca -0.14 -0.34 0.03 0.00 0.70 0.00 0.00 55.95 56.19 1fg2 s SER 24 Cb -0.16 -0.88 0.01 0.00 -1.71 0.00 0.00 66.02 63.28 1fg2 s SER 24 CO 0.04 0.07 -0.15 -0.69 1.20 0.00 0.00 173.24 173.71 1fg2 s VAL 25 N 0.52 1.31 0.03 4.45 1.01 -0.14 -0.56 120.40 127.02 1fg2 s VAL 25 Ca -0.14 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.26 1fg2 s VAL 25 Cb -0.15 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1fg2 s VAL 25 CO 0.04 0.39 -0.02 -0.83 0.00 0.00 0.00 175.10 174.68 1fg2 s GLY 26 N 0.38 1.85 0.01 4.51 0.00 -0.87 0.12 107.32 113.31 1fg2 s GLY 26 Ca -0.11 -1.03 0.02 0.00 0.00 0.00 0.00 44.72 43.60 1fg2 s GLY 26 CO 0.04 -0.93 -0.06 -0.19 0.00 0.00 0.00 173.10 171.96 1fg2 s TYR 27 N -1.12 0.53 -0.15 1.90 1.51 0.20 -0.59 117.35 119.62 1fg2 s TYR 27 Ca 0.20 -0.19 0.01 0.00 -1.01 0.00 0.00 57.07 56.09 1fg2 s TYR 27 Cb -0.11 -0.33 0.02 0.00 -0.11 0.00 0.00 41.96 41.42 1fg2 s TYR 27 CO 0.12 -0.03 -0.19 0.08 -1.11 0.00 0.00 175.55 174.42 1fg2 s VAL 28 N -0.44 1.88 -1.50 0.71 1.01 -0.73 -0.59 120.40 120.75 1fg2 s VAL 28 Ca -0.01 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 1fg2 s VAL 28 Cb -0.04 -1.70 0.07 0.00 0.00 0.00 0.00 36.38 34.71 1fg2 s VAL 28 CO -0.00 0.51 0.87 0.47 0.00 0.00 0.00 175.10 176.95 1fg2 n ASP 29 N 4.41 -3.64 -1.32 3.32 8.00 0.13 -1.98 116.55 125.47 1fg2 n ASP 29 Ca -0.20 -0.83 -0.17 0.00 0.71 0.00 0.00 54.79 54.31 1fg2 n ASP 29 Cb 0.51 -3.75 -0.07 0.00 -0.02 0.00 0.00 41.12 37.79 1fg2 n ASP 29 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1fg2 n ASN 30 N -2.87 -5.04 -4.25 -2.24 3.02 -1.26 -5.00 115.26 97.62 1fg2 n ASN 30 Ca -0.05 0.40 -0.32 0.00 -0.03 0.00 0.00 54.58 54.59 1fg2 n ASN 30 Cb 0.56 -4.04 -0.16 0.00 -0.61 0.00 0.00 39.78 35.53 1fg2 n ASN 30 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1fg2 s LYS 31 N -3.49 3.12 0.22 3.52 1.02 -0.84 -5.05 119.74 118.24 1fg2 s LYS 31 Ca 0.00 -0.84 -0.32 0.00 0.02 0.00 0.00 55.97 54.83 1fg2 s LYS 31 Cb 0.00 -2.38 -0.14 0.00 -0.52 0.00 0.00 37.83 34.79 1fg2 s LYS 31 CO 0.00 0.17 1.44 -1.91 -0.92 0.00 0.00 175.35 174.13 1fg2 n GLU 32 N 3.57 2.02 0.00 1.68 2.13 -1.26 -1.77 120.64 127.02 1fg2 n GLU 32 Ca -0.19 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.35 1fg2 n GLU 32 Cb 0.53 -2.40 0.00 0.00 0.27 0.00 0.00 31.44 29.84 1fg2 n GLU 32 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1fg2 n PHE 33 N 2.25 0.00 -3.83 4.31 -1.74 0.24 -4.44 117.46 114.26 1fg2 n PHE 33 Ca 0.13 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.93 1fg2 n PHE 33 Cb 0.30 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.24 1fg2 n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1fg2 s VAL 34 N -0.79 0.10 -0.21 1.97 -7.23 -1.23 -0.64 120.40 112.36 1fg2 s VAL 34 Ca 0.00 -1.08 -0.27 0.00 -1.81 0.00 0.00 61.98 58.83 1fg2 s VAL 34 Cb 0.00 -1.46 0.08 0.00 0.56 0.00 0.00 36.38 35.57 1fg2 s VAL 34 CO 0.00 -0.44 0.79 -0.60 -0.31 0.00 0.00 175.10 174.54 1fg2 s ARG 35 N -3.88 0.80 -0.00 4.82 3.52 -0.78 -2.05 118.95 121.38 1fg2 s ARG 35 Ca 0.08 0.68 0.01 0.00 -0.13 0.00 0.00 55.73 56.37 1fg2 s ARG 35 Cb 0.03 0.39 -0.00 0.00 -1.56 0.00 0.00 34.95 33.81 1fg2 s ARG 35 CO -0.08 -0.15 -0.04 0.12 -0.81 0.00 0.00 175.30 174.34 1fg2 s PHE 36 N -0.13 0.36 -0.17 5.12 2.19 0.28 0.32 117.98 125.93 1fg2 s PHE 36 Ca -0.02 -0.07 -0.04 0.00 0.33 0.00 0.00 56.93 57.13 1fg2 s PHE 36 Cb -0.03 -0.23 0.07 0.00 -1.31 0.00 0.00 43.02 41.51 1fg2 s PHE 36 CO 0.02 -0.01 0.16 0.34 1.83 0.00 0.00 175.22 177.56 1fg2 s ASP 37 N -0.07 1.67 0.65 6.13 -1.08 -1.26 -0.67 116.67 122.03 1fg2 s ASP 37 Ca 0.01 -0.30 0.34 0.00 -0.52 0.00 0.00 52.55 52.09 1fg2 s ASP 37 Cb -0.02 0.12 1.86 0.00 -1.46 0.00 0.00 42.92 43.42 1fg2 s ASP 37 CO -0.00 -0.32 2.05 0.77 0.52 0.00 0.00 175.17 178.18 1fg2 h SER 38 N 8.36 0.00 1.53 -0.34 4.64 -1.41 -0.65 113.55 125.68 1fg2 h SER 38 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1fg2 h SER 38 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1fg2 h SER 38 CO 0.27 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 176.67 1fg2 h ASP 39 N 0.00 0.00 -3.38 4.97 5.19 -1.95 -3.46 116.42 117.79 1fg2 h ASP 39 Ca 0.00 0.00 -0.48 0.00 -0.62 0.00 0.00 57.03 55.93 1fg2 h ASP 39 Cb 0.42 0.00 0.22 0.00 0.18 0.00 0.00 39.33 40.14 1fg2 h ASP 39 CO 0.00 0.00 -0.23 0.00 -3.12 0.00 0.00 179.24 175.89 1fg2 n ALA 40 N -2.01 -2.52 0.01 3.45 0.00 -0.25 -4.92 120.51 114.27 1fg2 n ALA 40 Ca 0.03 -0.94 -0.19 0.00 0.00 0.00 0.00 53.44 52.34 1fg2 n ALA 40 Cb 0.42 -1.94 -0.09 0.00 0.00 0.00 0.00 19.45 17.85 1fg2 n ALA 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1fg2 h GLU 41 N -2.19 0.75 -3.08 0.00 4.81 -1.89 -3.36 114.58 109.61 1fg2 h GLU 41 Ca -0.52 -0.72 -0.62 0.00 -0.13 0.00 0.00 59.36 57.37 1fg2 h GLU 41 Cb 1.31 0.18 -0.41 0.00 0.63 0.00 0.00 28.75 30.46 1fg2 h GLU 41 CO 0.43 1.30 -0.65 1.21 -0.73 0.00 0.00 179.01 180.57 1fg2 s ASN 42 N -7.22 4.21 -0.21 1.04 2.47 -1.26 -5.08 114.94 108.89 1fg2 s ASN 42 Ca -0.10 -3.39 -0.36 0.00 0.42 0.00 0.00 52.86 49.43 1fg2 s ASN 42 Cb 0.08 -1.44 -0.13 0.00 -1.45 0.00 0.00 41.25 38.31 1fg2 s ASN 42 CO 0.92 -0.16 1.92 -2.65 -3.72 0.00 0.00 177.10 173.40 1fg2 n PRO 43 N 2.57 1.63 -3.55 0.43 -0.02 -1.26 -4.94 135.00 129.87 1fg2 n PRO 43 Ca 0.15 0.57 -0.08 0.00 -2.02 0.00 0.00 63.50 62.12 1fg2 n PRO 43 Cb 0.35 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.35 1fg2 n PRO 43 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1fg2 s ARG 44 N 4.44 0.63 0.08 -0.52 0.52 -1.26 -5.04 118.95 117.79 1fg2 s ARG 44 Ca 0.98 -0.11 -0.31 0.00 -0.52 0.00 0.00 55.73 55.77 1fg2 s ARG 44 Cb -0.84 0.29 -0.06 0.00 0.52 0.00 0.00 34.95 34.86 1fg2 s ARG 44 CO 0.55 -0.25 1.23 0.71 0.02 0.00 0.00 175.30 177.56 1fg2 s TYR 45 N -2.28 3.41 0.05 -0.53 2.02 -1.26 -4.42 117.35 114.34 1fg2 s TYR 45 Ca 0.04 1.25 0.06 0.00 -0.37 0.00 0.00 57.07 58.05 1fg2 s TYR 45 Cb -0.01 -3.46 -0.04 0.00 -0.40 0.00 0.00 41.96 38.05 1fg2 s TYR 45 CO -0.05 -1.45 -0.13 -1.21 -1.57 0.00 0.00 175.55 171.14 1fg2 s GLU 46 N 0.99 2.19 0.29 -0.62 0.41 0.15 -4.88 118.70 117.23 1fg2 s GLU 46 Ca 0.59 -0.94 -0.29 0.00 -0.41 0.00 0.00 54.97 53.92 1fg2 s GLU 46 Cb -0.31 -2.30 -0.10 0.00 -1.78 0.00 0.00 34.13 29.65 1fg2 s GLU 46 CO 0.30 0.54 1.36 -2.14 -0.49 0.00 0.00 175.26 174.83 1fg2 s PRO 47 N -1.69 4.33 0.00 0.39 0.02 -1.26 -1.87 135.00 134.91 1fg2 s PRO 47 Ca 0.17 2.23 0.04 0.00 0.02 0.00 0.00 61.00 63.47 1fg2 s PRO 47 Cb -0.11 -3.10 -0.01 0.00 0.02 0.00 0.00 34.50 31.30 1fg2 s PRO 47 CO 0.08 -0.28 0.38 0.54 -0.33 0.00 0.00 177.00 177.39 1fg2 n ARG 48 N 1.55 3.06 -4.18 5.54 5.12 0.18 -4.89 116.66 123.04 1fg2 n ARG 48 Ca 0.03 -0.33 -0.18 0.00 -1.93 0.00 0.00 57.85 55.44 1fg2 n ARG 48 Cb 0.41 -0.86 -0.12 0.00 -1.16 0.00 0.00 32.46 30.74 1fg2 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1fg2 s ALA 49 N -0.95 1.22 0.09 7.54 0.00 -1.24 -4.77 121.76 123.66 1fg2 s ALA 49 Ca 0.03 -1.07 -0.23 0.00 0.00 0.00 0.00 51.96 50.70 1fg2 s ALA 49 Cb 0.03 -0.08 -0.14 0.00 0.00 0.00 0.00 23.12 22.94 1fg2 s ALA 49 CO 0.12 0.14 1.74 -1.00 0.00 0.00 0.00 175.76 176.75 1fg2 h PRO 50 N 4.10 0.01 0.00 0.00 0.13 -1.95 -2.71 132.00 131.57 1fg2 h PRO 50 Ca -0.40 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1fg2 h PRO 50 Cb 1.19 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1fg2 h PRO 50 CO 0.43 0.01 0.20 -2.67 -0.23 0.00 0.00 178.00 175.74 1fg2 n TRP 51 N -5.09 0.35 0.58 1.56 4.27 -1.26 -0.92 117.44 116.92 1fg2 n TRP 51 Ca -0.06 0.18 0.12 0.00 -3.89 0.00 0.00 57.50 53.85 1fg2 n TRP 51 Cb 0.04 -0.64 0.25 0.00 -1.36 0.00 0.00 31.31 29.60 1fg2 n TRP 51 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 1fg2 n MET 52 N -1.86 0.29 0.00 -2.67 2.81 -1.02 -3.65 117.12 111.02 1fg2 n MET 52 Ca -0.01 0.13 0.05 0.00 -1.81 0.00 0.00 57.70 56.06 1fg2 n MET 52 Cb 0.22 -1.73 0.25 0.00 -0.71 0.00 0.00 33.22 31.25 1fg2 n MET 52 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1fg2 n GLU 53 N -2.18 0.18 0.10 0.03 1.02 -0.10 -2.35 120.64 117.35 1fg2 n GLU 53 Ca 0.04 0.15 -0.13 0.00 -0.02 0.00 0.00 57.16 57.20 1fg2 n GLU 53 Cb 0.44 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.28 1fg2 n GLU 53 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1fg2 h GLN 54 N 0.00 -0.25 -6.17 3.49 4.20 -1.78 -3.43 115.11 111.17 1fg2 h GLN 54 Ca 0.00 0.02 -0.70 0.00 0.06 0.00 0.00 58.65 58.03 1fg2 h GLN 54 Cb 0.07 0.06 0.07 0.00 0.30 0.00 0.00 27.48 27.98 1fg2 h GLN 54 CO 0.00 0.04 0.11 0.39 -0.67 0.00 0.00 178.83 178.70 1fg2 n GLU 55 N -5.08 0.62 -1.99 1.46 -0.58 -0.99 -4.95 120.64 109.14 1fg2 n GLU 55 Ca -0.09 0.22 -0.22 0.00 -0.42 0.00 0.00 57.16 56.65 1fg2 n GLU 55 Cb 0.22 -1.66 0.14 0.00 -0.57 0.00 0.00 31.44 29.56 1fg2 n GLU 55 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fg2 n GLY 56 N 1.92 -0.30 0.33 0.62 0.00 -1.26 -4.90 105.19 101.60 1fg2 n GLY 56 Ca 0.17 -1.88 -0.00 0.00 0.00 0.00 0.00 46.02 44.32 1fg2 n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1fg2 h PRO 57 N 0.00 -0.04 0.00 1.61 0.11 -1.98 -1.93 132.00 129.77 1fg2 h PRO 57 Ca -0.32 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1fg2 h PRO 57 Cb 1.03 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1fg2 h PRO 57 CO 0.28 -0.03 -0.06 1.49 -0.21 0.00 0.00 178.00 179.47 1fg2 h GLU 58 N -0.05 0.00 0.40 1.05 4.81 -1.98 0.30 114.58 119.12 1fg2 h GLU 58 Ca 0.34 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 1fg2 h GLU 58 Cb 0.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1fg2 h GLU 58 CO -0.83 0.06 -0.19 -0.92 -0.73 0.00 0.00 179.01 176.40 1fg2 h TYR 59 N 0.00 -0.50 -0.48 0.92 5.03 -1.71 -1.32 116.97 118.91 1fg2 h TYR 59 Ca -0.00 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.28 1fg2 h TYR 59 Cb 0.12 0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.54 1fg2 h TYR 59 CO 0.00 -0.21 0.21 -1.49 -1.32 0.00 0.00 178.16 175.34 1fg2 h TRP 60 N -0.73 0.68 -0.21 -3.82 4.06 -1.45 -1.70 115.95 112.78 1fg2 h TRP 60 Ca -0.06 -0.02 -0.00 0.00 2.06 0.00 0.00 58.89 60.87 1fg2 h TRP 60 Cb 0.51 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.45 1fg2 h TRP 60 CO -0.01 0.52 0.13 1.49 -3.56 0.00 0.00 178.44 177.01 1fg2 h GLU 61 N 0.68 0.28 0.62 0.49 4.57 -0.80 -1.58 114.58 118.85 1fg2 h GLU 61 Ca 0.17 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.29 1fg2 h GLU 61 Cb 0.11 -0.06 0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1fg2 h GLU 61 CO -0.02 0.23 -0.30 0.00 -1.18 0.00 0.00 179.01 177.74 1fg2 h ARG 62 N 0.26 -0.81 -0.95 1.92 2.47 -0.87 -2.27 114.38 114.13 1fg2 h ARG 62 Ca 0.08 0.06 0.23 0.00 -1.26 0.00 0.00 59.98 59.08 1fg2 h ARG 62 Cb 0.01 0.18 -0.12 0.00 -1.65 0.00 0.00 29.97 28.39 1fg2 h ARG 62 CO -0.01 -0.51 0.51 0.93 0.56 0.00 0.00 179.97 181.45 1fg2 h GLU 63 N -1.16 0.50 -0.59 0.04 4.39 -1.38 0.47 114.58 116.86 1fg2 h GLU 63 Ca -0.09 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 1fg2 h GLU 63 Cb 0.67 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.18 1fg2 h GLU 63 CO 0.14 0.33 0.32 1.15 -1.16 0.00 0.00 179.01 179.80 1fg2 h THR 64 N 0.52 1.19 -0.19 1.13 2.02 -1.25 0.41 112.91 116.74 1fg2 h THR 64 Ca 0.60 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 1fg2 h THR 64 Cb 1.12 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 1fg2 h THR 64 CO -0.49 0.21 -0.19 1.56 0.37 0.00 0.00 175.52 176.98 1fg2 h GLN 65 N 0.79 0.33 -0.04 6.66 1.08 0.42 -0.52 115.11 123.82 1fg2 h GLN 65 Ca 0.21 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 57.30 1fg2 h GLN 65 Cb 0.04 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1fg2 h GLN 65 CO -0.03 0.51 0.00 -0.22 -0.95 0.00 0.00 178.83 178.14 1fg2 h LYS 66 N 0.30 0.08 -0.54 1.46 3.64 -0.32 -2.33 116.57 118.86 1fg2 h LYS 66 Ca 0.05 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.51 1fg2 h LYS 66 Cb 0.51 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.24 1fg2 h LYS 66 CO 0.03 0.36 0.08 0.00 -2.27 0.00 0.00 179.45 177.66 1fg2 h ALA 67 N 0.72 0.59 0.00 5.00 0.00 -0.38 0.39 119.26 125.58 1fg2 h ALA 67 Ca 0.01 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1fg2 h ALA 67 Cb 0.32 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1fg2 h ALA 67 CO 0.00 -0.33 -0.08 0.87 0.00 0.00 0.00 179.25 179.71 1fg2 h LYS 68 N 0.21 0.00 -0.11 0.00 1.57 -1.00 0.19 116.57 117.43 1fg2 h LYS 68 Ca 0.28 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.92 1fg2 h LYS 68 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.71 1fg2 h LYS 68 CO -0.38 0.08 -0.46 0.78 -0.57 0.00 0.00 179.45 178.90 1fg2 h GLY 69 N 0.31 0.57 0.93 3.86 0.00 0.20 -2.93 103.07 106.01 1fg2 h GLY 69 Ca -0.00 -0.77 0.02 0.00 0.00 0.00 0.00 47.33 46.57 1fg2 h GLY 69 CO 0.01 0.69 0.43 1.46 0.00 0.00 0.00 176.54 179.13 1fg2 h GLN 70 N 0.11 0.84 -0.19 4.80 1.08 0.46 -0.19 115.11 122.03 1fg2 h GLN 70 Ca -0.03 -0.05 0.05 0.00 -1.45 0.00 0.00 58.65 57.18 1fg2 h GLN 70 Cb 1.10 -0.19 -0.06 0.00 -0.05 0.00 0.00 27.48 28.28 1fg2 h GLN 70 CO 0.10 0.56 -0.18 1.49 -0.95 0.00 0.00 178.83 179.84 1fg2 h GLU 71 N 0.87 -0.20 -1.01 1.46 4.81 -0.68 0.26 114.58 120.08 1fg2 h GLU 71 Ca 0.26 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.53 1fg2 h GLU 71 Cb -0.03 0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 1fg2 h GLU 71 CO -0.08 -0.13 0.66 1.96 -0.73 0.00 0.00 179.01 180.69 1fg2 h GLN 72 N -0.21 1.27 -0.08 1.92 1.08 -1.23 -0.91 115.11 116.95 1fg2 h GLN 72 Ca 0.12 -0.08 0.02 0.00 -1.45 0.00 0.00 58.65 57.26 1fg2 h GLN 72 Cb 0.38 -0.29 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 1fg2 h GLN 72 CO -0.31 0.84 -0.04 2.35 -0.95 0.00 0.00 178.83 180.72 1fg2 h TRP 73 N 1.31 -0.09 -0.55 2.96 7.01 0.68 -0.70 115.95 126.57 1fg2 h TRP 73 Ca 0.39 0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.33 1fg2 h TRP 73 Cb -0.05 0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.04 1fg2 h TRP 73 CO -0.00 -0.07 0.08 0.74 -2.79 0.00 0.00 178.44 176.40 1fg2 h PHE 74 N -0.03 0.93 -0.24 2.65 -1.00 -0.65 -0.58 116.94 118.01 1fg2 h PHE 74 Ca 0.05 -0.11 0.02 0.00 2.81 0.00 0.00 57.97 60.73 1fg2 h PHE 74 Cb 0.11 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 39.39 1fg2 h PHE 74 CO -0.15 0.80 0.12 -0.09 -1.61 0.00 0.00 178.31 177.38 1fg2 h ARG 75 N 0.83 0.24 -0.06 1.51 2.43 -0.81 0.32 114.38 118.86 1fg2 h ARG 75 Ca 0.17 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.20 1fg2 h ARG 75 Cb 0.39 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1fg2 h ARG 75 CO 0.01 0.16 -0.53 0.28 -1.51 0.00 0.00 179.97 178.38 1fg2 h VAL 76 N 0.25 1.37 -0.19 0.20 2.07 -0.76 -2.87 116.25 116.32 1fg2 h VAL 76 Ca 0.10 -1.81 -0.07 0.00 0.82 0.00 0.00 66.70 65.74 1fg2 h VAL 76 Cb 0.03 1.91 -0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1fg2 h VAL 76 CO -0.07 0.53 -0.15 0.28 0.02 0.00 0.00 177.57 178.19 1fg2 h SER 77 N 0.12 0.45 -0.80 0.57 0.02 -0.49 -2.33 113.55 111.09 1fg2 h SER 77 Ca 0.00 -0.45 0.13 0.00 -0.84 0.00 0.00 61.79 60.63 1fg2 h SER 77 Cb 0.98 -0.13 -0.06 0.00 0.14 0.00 0.00 62.40 63.33 1fg2 h SER 77 CO 0.08 0.81 0.53 -0.07 -1.14 0.00 0.00 176.83 177.03 1fg2 h LEU 78 N 0.10 0.55 -0.30 5.07 4.07 -0.35 0.17 115.31 124.62 1fg2 h LEU 78 Ca 0.04 0.03 -0.08 0.00 0.08 0.00 0.00 57.88 57.94 1fg2 h LEU 78 Cb 0.67 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1fg2 h LEU 78 CO 0.04 0.30 -0.12 -0.09 -1.08 0.00 0.00 178.44 177.49 1fg2 h ARG 79 N 0.59 0.61 -0.28 1.13 2.43 -1.30 -2.39 114.38 115.17 1fg2 h ARG 79 Ca 0.39 -0.25 -0.15 0.00 -0.81 0.00 0.00 59.98 59.16 1fg2 h ARG 79 Cb 0.69 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1fg2 h ARG 79 CO -0.15 0.82 -0.40 -0.91 -1.51 0.00 0.00 179.97 177.82 1fg2 h ASN 80 N 0.37 0.84 -0.92 -3.80 2.35 -0.51 -2.98 115.58 110.92 1fg2 h ASN 80 Ca 0.07 -0.51 0.09 0.00 -0.55 0.00 0.00 56.30 55.40 1fg2 h ASN 80 Cb 0.62 -0.24 -0.07 0.00 0.05 0.00 0.00 38.32 38.69 1fg2 h ASN 80 CO 0.04 1.18 0.59 -0.07 -1.65 0.00 0.00 177.43 177.53 1fg2 h LEU 81 N 0.52 0.86 -0.85 1.61 3.38 -0.76 0.16 115.31 120.22 1fg2 h LEU 81 Ca 0.03 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.13 1fg2 h LEU 81 Cb 1.00 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.51 1fg2 h LEU 81 CO 0.09 0.51 0.49 0.25 0.09 0.00 0.00 178.44 179.87 1fg2 h LEU 82 N 0.95 0.69 0.21 1.67 5.85 -1.27 -1.35 115.31 122.06 1fg2 h LEU 82 Ca 0.43 0.05 -0.32 0.00 0.84 0.00 0.00 57.88 58.88 1fg2 h LEU 82 Cb 0.37 -0.08 0.03 0.00 0.37 0.00 0.00 40.66 41.35 1fg2 h LEU 82 CO -0.19 0.38 -1.40 1.23 -0.34 0.00 0.00 178.44 178.13 1fg2 h GLY 83 N 0.80 0.51 1.36 3.75 0.00 -0.88 -1.15 103.07 107.47 1fg2 h GLY 83 Ca 0.42 -1.31 0.00 0.00 0.00 0.00 0.00 47.33 46.45 1fg2 h GLY 83 CO -0.27 1.14 0.41 -0.97 0.00 0.00 0.00 176.54 176.86 1fg2 h TYR 84 N 0.12 0.82 -0.04 5.60 0.05 -0.32 -2.21 116.97 120.99 1fg2 h TYR 84 Ca -0.21 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.58 1fg2 h TYR 84 Cb 2.10 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 39.57 1fg2 h TYR 84 CO 0.11 0.53 0.00 0.66 -1.05 0.00 0.00 178.16 178.40 1fg2 n TYR 85 N -4.43 0.02 -3.66 4.88 4.01 -0.55 -4.84 117.16 112.60 1fg2 n TYR 85 Ca 0.06 -0.01 -0.24 0.00 -0.16 0.00 0.00 57.90 57.55 1fg2 n TYR 85 Cb 0.05 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.15 1fg2 n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1fg2 n ASN 86 N 0.70 -4.81 -4.73 7.72 5.15 -0.83 -4.96 115.26 113.50 1fg2 n ASN 86 Ca 0.17 -0.64 -0.38 0.00 -0.60 0.00 0.00 54.58 53.14 1fg2 n ASN 86 Cb 0.46 -4.69 -0.06 0.00 -0.53 0.00 0.00 39.78 34.96 1fg2 n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1fg2 s GLN 87 N -6.20 4.29 0.85 1.20 -0.21 -0.47 -5.04 119.66 114.07 1fg2 s GLN 87 Ca 0.45 0.41 -0.14 0.00 0.02 0.00 0.00 55.36 56.10 1fg2 s GLN 87 Cb -0.21 -3.41 0.20 0.00 1.00 0.00 0.00 33.01 30.59 1fg2 s GLN 87 CO 0.76 0.22 0.94 0.43 -2.12 0.00 0.00 175.29 175.52 1fg2 n SER 88 N 3.46 -0.85 -4.91 5.90 7.64 -1.26 -4.75 113.62 118.84 1fg2 n SER 88 Ca -0.08 -1.20 -0.27 0.00 1.01 0.00 0.00 58.87 58.33 1fg2 n SER 88 Cb 0.52 -0.78 0.04 0.00 -1.01 0.00 0.00 64.21 62.98 1fg2 n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fg2 s ALA 89 N -3.51 3.21 0.00 -0.43 0.00 -1.26 -4.59 121.76 115.18 1fg2 s ALA 89 Ca 0.56 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1fg2 s ALA 89 Cb -0.03 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 20.42 1fg2 s ALA 89 CO 0.41 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.63 1fg2 n GLY 90 N -2.72 1.26 3.28 0.00 0.00 -1.26 -5.10 105.19 100.65 1fg2 n GLY 90 Ca 0.06 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 1fg2 n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fg2 s GLY 91 N -2.38 1.93 -0.17 -0.02 0.00 -1.26 -4.83 107.32 100.59 1fg2 s GLY 91 Ca 0.00 -1.82 -0.10 0.00 0.00 0.00 0.00 44.72 42.81 1fg2 s GLY 91 CO 0.00 -1.50 0.15 -0.56 0.00 0.00 0.00 173.10 171.19 1fg2 s SER 92 N -3.31 6.29 0.04 1.64 0.01 -1.26 -3.70 113.70 113.40 1fg2 s SER 92 Ca 0.38 0.33 0.02 0.00 1.31 0.00 0.00 55.95 57.99 1fg2 s SER 92 Cb 0.05 -2.09 -0.02 0.00 0.21 0.00 0.00 66.02 64.16 1fg2 s SER 92 CO 0.18 0.24 -0.08 -1.00 0.41 0.00 0.00 173.24 173.00 1fg2 s HIS 93 N -0.05 0.65 -0.01 2.43 0.09 -0.75 -4.99 115.29 112.65 1fg2 s HIS 93 Ca 0.11 -0.46 0.03 0.00 -0.00 0.00 0.00 55.06 54.74 1fg2 s HIS 93 Cb -0.12 -0.39 -0.00 0.00 -0.00 0.00 0.00 32.58 32.07 1fg2 s HIS 93 CO 0.00 -0.08 -0.10 0.99 -0.00 0.00 0.00 174.74 175.55 1fg2 s THR 94 N -1.26 0.85 -0.10 1.30 2.01 -1.26 -1.10 115.64 116.08 1fg2 s THR 94 Ca -0.09 -0.44 -0.00 0.00 0.31 0.00 0.00 61.69 61.47 1fg2 s THR 94 Cb -0.09 -0.72 0.02 0.00 0.01 0.00 0.00 72.50 71.72 1fg2 s THR 94 CO 0.00 0.25 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.89 1fg2 s LEU 95 N -0.11 1.20 0.17 4.42 2.96 -0.54 -0.58 118.68 126.19 1fg2 s LEU 95 Ca 0.02 -0.27 0.09 0.00 -0.22 0.00 0.00 54.13 53.76 1fg2 s LEU 95 Cb -0.06 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 1fg2 s LEU 95 CO -0.00 -0.10 -0.21 -1.10 -1.32 0.00 0.00 176.35 173.62 1fg2 s GLN 96 N 1.53 1.34 -0.00 1.98 -0.21 0.34 -1.05 119.66 123.58 1fg2 s GLN 96 Ca 0.01 -1.42 -0.02 0.00 0.02 0.00 0.00 55.36 53.96 1fg2 s GLN 96 Cb -0.13 -1.52 -0.00 0.00 1.00 0.00 0.00 33.01 32.36 1fg2 s GLN 96 CO -0.06 0.32 0.03 -1.14 -2.12 0.00 0.00 175.29 172.33 1fg2 s GLN 97 N -2.64 0.15 -0.03 2.91 0.74 -0.05 -1.16 119.66 119.57 1fg2 s GLN 97 Ca 0.16 -0.16 0.02 0.00 0.05 0.00 0.00 55.36 55.43 1fg2 s GLN 97 Cb -0.07 0.06 0.01 0.00 1.10 0.00 0.00 33.01 34.11 1fg2 s GLN 97 CO 0.07 -0.03 -0.08 -1.64 -0.55 0.00 0.00 175.29 173.07 1fg2 s MET 98 N -0.49 0.97 0.01 1.67 -1.94 -0.37 -0.84 119.30 118.31 1fg2 s MET 98 Ca -0.05 -0.24 -0.19 0.00 -1.71 0.00 0.00 55.69 53.50 1fg2 s MET 98 Cb -0.03 -0.90 0.04 0.00 2.01 0.00 0.00 34.83 35.94 1fg2 s MET 98 CO -0.00 0.04 0.41 -1.54 -0.01 0.00 0.00 175.02 173.92 1fg2 s SER 99 N 0.47 -0.30 0.00 3.03 1.04 -0.99 -1.11 113.70 115.84 1fg2 s SER 99 Ca -0.07 0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.47 1fg2 s SER 99 Cb -0.11 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1fg2 s SER 99 CO 0.01 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1fg2 n GLY 100 N 0.79 -0.79 3.13 7.32 0.00 -0.73 -0.87 105.19 114.04 1fg2 n GLY 100 Ca -0.19 -1.28 -0.12 0.00 0.00 0.00 0.00 46.02 44.42 1fg2 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fg2 s ASP 102 N -0.85 5.16 -0.02 0.00 1.01 0.43 -1.84 116.67 120.55 1fg2 s ASP 102 Ca -0.09 0.09 0.07 0.00 0.71 0.00 0.00 52.55 53.32 1fg2 s ASP 102 Cb -0.05 -1.41 -0.02 0.00 1.01 0.00 0.00 42.92 42.46 1fg2 s ASP 102 CO 0.02 0.35 -0.22 -0.76 0.21 0.00 0.00 175.17 174.76 1fg2 s LEU 103 N -1.10 2.04 1.03 1.23 1.43 0.30 0.64 118.68 124.25 1fg2 s LEU 103 Ca 0.15 -0.40 -0.16 0.00 -1.03 0.00 0.00 54.13 52.69 1fg2 s LEU 103 Cb -0.11 -1.15 0.21 0.00 0.03 0.00 0.00 46.19 45.17 1fg2 s LEU 103 CO 0.05 0.26 1.18 -0.83 0.23 0.00 0.00 176.35 177.24 1fg2 s GLY 104 N -0.45 1.63 0.13 -3.19 0.00 -0.75 -0.84 107.32 103.85 1fg2 s GLY 104 Ca 0.07 -0.84 0.12 0.00 0.00 0.00 0.00 44.72 44.07 1fg2 s GLY 104 CO -0.00 -0.12 1.38 -1.14 0.00 0.00 0.00 173.10 173.22 1fg2 n SER 105 N -4.12 0.27 -0.74 1.64 3.41 -1.26 -0.61 113.62 112.20 1fg2 n SER 105 Ca 0.11 0.60 0.06 0.00 -0.26 0.00 0.00 58.87 59.38 1fg2 n SER 105 Cb 0.59 -0.65 0.17 0.00 -0.26 0.00 0.00 64.21 64.07 1fg2 n SER 105 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1fg2 n ASP 106 N -1.84 2.15 -0.38 4.04 5.75 -1.26 -4.52 116.55 120.49 1fg2 n ASP 106 Ca 0.00 -2.05 -0.05 0.00 -0.01 0.00 0.00 54.79 52.69 1fg2 n ASP 106 Cb 0.07 -0.29 -0.02 0.00 -1.03 0.00 0.00 41.12 39.85 1fg2 n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1fg2 n TRP 107 N 0.57 0.00 -3.17 2.11 7.02 0.22 -4.98 117.44 119.21 1fg2 n TRP 107 Ca 0.13 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.27 1fg2 n TRP 107 Cb 0.36 -2.00 -0.06 0.00 -2.42 0.00 0.00 31.31 27.19 1fg2 n TRP 107 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1fg2 s ARG 108 N -2.15 4.05 0.02 -0.99 6.06 -1.26 -4.84 118.95 119.85 1fg2 s ARG 108 Ca 0.00 0.68 -0.30 0.00 -2.50 0.00 0.00 55.73 53.61 1fg2 s ARG 108 Cb 0.00 -2.61 -0.08 0.00 0.06 0.00 0.00 34.95 32.32 1fg2 s ARG 108 CO 0.00 0.26 1.82 -1.17 -2.50 0.00 0.00 175.30 173.71 1fg2 s LEU 109 N -2.61 4.39 -0.24 -0.88 2.96 -1.26 -1.81 118.68 119.23 1fg2 s LEU 109 Ca 0.49 2.52 -0.15 0.00 -0.22 0.00 0.00 54.13 56.77 1fg2 s LEU 109 Cb -0.12 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 42.87 1fg2 s LEU 109 CO 0.19 -0.99 -0.10 -0.11 -1.32 0.00 0.00 176.35 174.02 1fg2 n LEU 110 N 7.04 2.05 -3.54 -0.68 7.94 0.21 -4.86 117.00 125.16 1fg2 n LEU 110 Ca 0.18 0.32 -0.15 0.00 -1.11 0.00 0.00 56.01 55.25 1fg2 n LEU 110 Cb 0.41 -0.90 -0.06 0.00 0.53 0.00 0.00 43.42 43.41 1fg2 n LEU 110 CO 0.65 0.52 0.56 -0.60 -1.11 0.00 0.00 177.39 177.41 1fg2 s ARG 111 N -2.46 0.89 0.21 1.96 3.52 -1.14 -4.98 118.95 116.94 1fg2 s ARG 111 Ca -0.34 0.24 0.07 0.00 -0.13 0.00 0.00 55.73 55.57 1fg2 s ARG 111 Cb 0.11 0.42 -0.04 0.00 -1.56 0.00 0.00 34.95 33.88 1fg2 s ARG 111 CO 0.55 -0.27 0.10 0.20 -0.81 0.00 0.00 175.30 175.07 1fg2 s GLY 112 N -1.12 1.62 0.03 8.12 0.00 -1.26 -0.43 107.32 114.28 1fg2 s GLY 112 Ca -0.07 -1.38 0.03 0.00 0.00 0.00 0.00 44.72 43.30 1fg2 s GLY 112 CO 0.07 -1.41 -0.10 -0.19 0.00 0.00 0.00 173.10 171.47 1fg2 s TYR 113 N -1.94 0.87 -0.30 1.90 1.51 0.62 -4.83 117.35 115.17 1fg2 s TYR 113 Ca 0.31 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.04 1fg2 s TYR 113 Cb -0.09 -0.52 0.19 0.00 -0.11 0.00 0.00 41.96 41.44 1fg2 s TYR 113 CO 0.22 -0.01 0.73 -1.17 -1.11 0.00 0.00 175.55 174.20 1fg2 s LEU 114 N -1.04 -1.27 0.01 -1.29 0.20 -1.25 -1.78 118.68 112.27 1fg2 s LEU 114 Ca -0.02 0.08 0.01 0.00 0.69 0.00 0.00 54.13 54.89 1fg2 s LEU 114 Cb -0.07 1.79 -0.01 0.00 -0.43 0.00 0.00 46.19 47.47 1fg2 s LEU 114 CO 0.01 -0.22 -0.03 0.00 -0.29 0.00 0.00 176.35 175.81 1fg2 s GLN 115 N 2.78 0.24 0.12 1.98 -2.07 -0.27 -0.03 119.66 122.41 1fg2 s GLN 115 Ca 0.15 -0.24 0.10 0.00 -1.82 0.00 0.00 55.36 53.55 1fg2 s GLN 115 Cb -0.07 -0.15 -0.04 0.00 -1.09 0.00 0.00 33.01 31.66 1fg2 s GLN 115 CO -0.24 0.03 -0.22 -0.06 -1.32 0.00 0.00 175.29 173.48 1fg2 s PHE 116 N -0.42 2.43 -0.01 9.60 0.40 0.61 -1.24 117.98 129.35 1fg2 s PHE 116 Ca -0.03 -0.32 0.02 0.00 -0.60 0.00 0.00 56.93 56.00 1fg2 s PHE 116 Cb -0.03 -1.31 -0.00 0.00 0.51 0.00 0.00 43.02 42.19 1fg2 s PHE 116 CO -0.00 0.36 -0.06 0.00 0.70 0.00 0.00 175.22 176.22 1fg2 s ALA 117 N -1.09 0.50 -0.12 5.36 0.00 -0.31 -0.97 121.76 125.13 1fg2 s ALA 117 Ca 0.16 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 51.92 1fg2 s ALA 117 Cb -0.10 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.87 1fg2 s ALA 117 CO 0.08 0.11 -0.22 -0.47 0.00 0.00 0.00 175.76 175.25 1fg2 s TYR 118 N -0.02 2.58 -1.74 0.00 5.04 0.97 -0.50 117.35 123.66 1fg2 s TYR 118 Ca 0.01 -1.20 0.00 0.00 -2.44 0.00 0.00 57.07 53.44 1fg2 s TYR 118 Cb -0.04 -1.75 0.00 0.00 0.35 0.00 0.00 41.96 40.53 1fg2 s TYR 118 CO -0.00 -0.53 0.00 0.39 -1.34 0.00 0.00 175.55 174.07 1fg2 n GLU 119 N 3.86 -1.58 -0.96 4.97 -0.58 0.25 -1.45 120.64 125.15 1fg2 n GLU 119 Ca -0.20 0.99 0.00 0.00 -0.42 0.00 0.00 57.16 57.53 1fg2 n GLU 119 Cb 0.52 -5.58 0.00 0.00 -0.57 0.00 0.00 31.44 25.81 1fg2 n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fg2 n GLY 120 N -0.98 0.88 3.64 0.62 0.00 -1.26 -4.99 105.19 103.11 1fg2 n GLY 120 Ca -0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 1fg2 n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fg2 s ARG 121 N -0.04 2.47 0.08 1.61 3.00 -0.53 -5.04 118.95 120.50 1fg2 s ARG 121 Ca 0.00 -0.84 -0.34 0.00 0.00 0.00 0.00 55.73 54.55 1fg2 s ARG 121 Cb 0.00 -2.49 -0.13 0.00 0.00 0.00 0.00 34.95 32.33 1fg2 s ARG 121 CO 0.00 0.55 1.69 -0.25 0.00 0.00 0.00 175.30 177.29 1fg2 n ASP 122 N 0.86 3.27 -0.03 0.23 8.00 -1.26 -0.02 116.55 127.60 1fg2 n ASP 122 Ca -0.13 1.04 -0.07 0.00 0.71 0.00 0.00 54.79 56.35 1fg2 n ASP 122 Cb 0.52 -1.42 -0.02 0.00 -0.02 0.00 0.00 41.12 40.18 1fg2 n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fg2 n TYR 123 N 4.55 0.00 -3.63 1.24 9.36 -0.14 -4.77 117.16 123.77 1fg2 n TYR 123 Ca 0.19 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.26 1fg2 n TYR 123 Cb 0.30 -0.32 -0.07 0.00 -0.63 0.00 0.00 39.34 38.62 1fg2 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1fg2 s ILE 124 N -2.43 0.01 0.03 2.97 2.07 -1.12 -4.13 121.20 118.60 1fg2 s ILE 124 Ca -0.16 -0.06 -0.03 0.00 -1.41 0.00 0.00 60.65 58.99 1fg2 s ILE 124 Cb 0.03 -0.87 -0.02 0.00 0.13 0.00 0.00 42.46 41.74 1fg2 s ILE 124 CO 0.23 -0.03 0.05 0.00 -1.91 0.00 0.00 174.94 173.27 1fg2 s ALA 125 N -0.35 0.03 -0.08 1.50 0.00 0.28 -0.28 121.76 122.86 1fg2 s ALA 125 Ca -0.05 -0.59 -0.23 0.00 0.00 0.00 0.00 51.96 51.09 1fg2 s ALA 125 Cb -0.03 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.25 1fg2 s ALA 125 CO 0.04 -0.26 0.67 -1.17 0.00 0.00 0.00 175.76 175.04 1fg2 s LEU 126 N -1.91 4.30 0.97 0.00 2.96 0.95 -0.66 118.68 125.29 1fg2 s LEU 126 Ca -0.08 1.11 -0.12 0.00 -0.22 0.00 0.00 54.13 54.82 1fg2 s LEU 126 Cb -0.04 -3.02 0.17 0.00 0.50 0.00 0.00 46.19 43.81 1fg2 s LEU 126 CO -0.03 -0.11 1.09 0.20 -1.32 0.00 0.00 176.35 176.17 1fg2 s ASN 127 N 0.80 2.80 0.05 3.68 0.01 0.13 -4.62 114.94 117.79 1fg2 s ASN 127 Ca 0.35 1.43 0.17 0.00 -0.71 0.00 0.00 52.86 54.09 1fg2 s ASN 127 Cb -0.17 -2.10 0.70 0.00 0.41 0.00 0.00 41.25 40.09 1fg2 s ASN 127 CO 0.16 -3.05 1.52 -1.84 -1.51 0.00 0.00 177.10 172.38 1fg2 n GLU 128 N -4.15 0.04 0.00 -0.60 0.28 -1.26 -0.97 120.64 113.98 1fg2 n GLU 128 Ca 0.06 0.28 0.09 0.00 -0.16 0.00 0.00 57.16 57.44 1fg2 n GLU 128 Cb 0.56 -1.58 0.47 0.00 1.43 0.00 0.00 31.44 32.32 1fg2 n GLU 128 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1fg2 n ASP 129 N -1.66 0.00 -2.16 -1.84 5.75 -1.26 -4.80 116.55 110.58 1fg2 n ASP 129 Ca 0.03 0.11 -0.13 0.00 -0.01 0.00 0.00 54.79 54.80 1fg2 n ASP 129 Cb 0.18 -0.33 -0.02 0.00 -1.03 0.00 0.00 41.12 39.92 1fg2 n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1fg2 n LEU 130 N -1.33 -1.10 0.00 -2.12 4.77 -0.14 -4.70 117.00 112.37 1fg2 n LEU 130 Ca 0.08 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1fg2 n LEU 130 Cb 0.17 -2.10 0.00 0.00 -2.33 0.00 0.00 43.42 39.16 1fg2 n LEU 130 CO 0.15 -0.27 -0.26 0.29 -1.33 0.00 0.00 177.39 175.98 1fg2 n LYS 131 N -2.56 1.00 -4.24 3.23 5.02 -1.26 -4.65 118.16 114.70 1fg2 n LYS 131 Ca -0.14 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.87 1fg2 n LYS 131 Cb 0.56 -0.76 -0.09 0.00 -0.02 0.00 0.00 35.03 34.72 1fg2 n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1fg2 s THR 132 N -1.52 3.44 0.20 -0.18 -4.23 -1.26 -4.86 115.64 107.23 1fg2 s THR 132 Ca 0.00 -1.49 0.07 0.00 -1.18 0.00 0.00 61.69 59.09 1fg2 s THR 132 Cb 0.00 -2.70 -0.04 0.00 1.34 0.00 0.00 72.50 71.11 1fg2 s THR 132 CO 0.00 -0.07 0.10 0.26 -0.54 0.00 0.00 174.62 174.38 1fg2 s TRP 133 N -1.62 3.01 -0.10 3.99 0.52 -1.26 0.18 118.94 123.65 1fg2 s TRP 133 Ca 0.25 -0.10 0.02 0.00 0.02 0.00 0.00 56.10 56.29 1fg2 s TRP 133 Cb -0.09 -1.41 0.02 0.00 -1.15 0.00 0.00 33.47 30.83 1fg2 s TRP 133 CO 0.16 0.53 -0.14 0.99 0.02 0.00 0.00 176.95 178.51 1fg2 s THR 134 N -1.93 1.43 -0.15 2.01 2.01 0.16 -4.87 115.64 114.30 1fg2 s THR 134 Ca 0.31 -0.60 -0.05 0.00 0.31 0.00 0.00 61.69 61.66 1fg2 s THR 134 Cb -0.09 -1.32 0.08 0.00 0.01 0.00 0.00 72.50 71.18 1fg2 s THR 134 CO 0.22 0.43 0.28 0.00 -0.69 0.00 0.00 174.62 174.86 1fg2 s ALA 135 N 1.00 -0.62 -0.12 7.40 0.00 -1.26 -0.55 121.76 127.60 1fg2 s ALA 135 Ca -0.07 0.91 -0.11 0.00 0.00 0.00 0.00 51.96 52.70 1fg2 s ALA 135 Cb -0.15 -1.14 -0.09 0.00 0.00 0.00 0.00 23.12 21.74 1fg2 s ALA 135 CO -0.02 -0.77 0.22 0.00 0.00 0.00 0.00 175.76 175.19 1fg2 h ALA 136 N 8.27 0.02 -2.80 0.00 0.00 -1.87 -3.46 119.26 119.41 1fg2 h ALA 136 Ca -0.15 -0.27 -0.56 0.00 0.00 0.00 0.00 54.91 53.93 1fg2 h ALA 136 Cb 1.12 0.09 0.14 0.00 0.00 0.00 0.00 17.79 19.15 1fg2 h ALA 136 CO 0.16 0.09 0.37 -0.25 0.00 0.00 0.00 179.25 179.63 1fg2 n ASP 137 N -4.69 1.90 -0.13 0.00 10.43 -1.26 -4.90 116.55 117.89 1fg2 n ASP 137 Ca -0.05 0.97 -0.07 0.00 2.57 0.00 0.00 54.79 58.20 1fg2 n ASP 137 Cb 0.21 -1.47 0.01 0.00 1.84 0.00 0.00 41.12 41.71 1fg2 n ASP 137 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 1fg2 h MET 138 N 1.33 0.47 -0.82 -1.24 2.86 -2.00 -1.41 114.93 114.12 1fg2 h MET 138 Ca -0.48 -0.03 0.12 0.00 -2.06 0.00 0.00 59.70 57.24 1fg2 h MET 138 Cb 1.32 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 32.82 1fg2 h MET 138 CO 0.56 0.31 0.54 0.00 1.06 0.00 0.00 176.91 179.38 1fg2 h ALA 139 N 1.18 1.82 0.00 6.32 0.00 -1.90 -1.84 119.26 124.84 1fg2 h ALA 139 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1fg2 h ALA 139 Cb 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1fg2 h ALA 139 CO -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.16 1fg2 n ALA 140 N -2.45 1.61 0.22 0.00 0.00 -0.53 -3.02 120.51 116.34 1fg2 n ALA 140 Ca 0.15 0.06 0.05 0.00 0.00 0.00 0.00 53.44 53.70 1fg2 n ALA 140 Cb 0.40 -1.34 0.49 0.00 0.00 0.00 0.00 19.45 19.00 1fg2 n ALA 140 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1fg2 h GLN 141 N 0.00 0.00 -0.68 0.00 1.08 -1.32 -1.74 115.11 112.45 1fg2 h GLN 141 Ca 0.00 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1fg2 h GLN 141 Cb 0.31 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.70 1fg2 h GLN 141 CO 0.00 0.21 0.45 0.82 -0.95 0.00 0.00 178.83 179.36 1fg2 h ILE 142 N 0.00 1.16 -0.28 2.54 2.04 -1.73 -0.56 117.51 120.68 1fg2 h ILE 142 Ca -0.00 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.49 1fg2 h ILE 142 Cb 0.39 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1fg2 h ILE 142 CO 0.03 0.17 -0.05 0.74 0.00 0.00 0.00 178.15 179.03 1fg2 h THR 143 N 0.90 1.28 -0.33 -0.27 2.02 -1.60 -0.71 112.91 114.20 1fg2 h THR 143 Ca 0.26 -1.05 0.07 0.00 0.77 0.00 0.00 66.41 66.45 1fg2 h THR 143 Cb -0.08 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 1fg2 h THR 143 CO -0.07 0.33 -0.06 -0.09 0.37 0.00 0.00 175.52 176.01 1fg2 h ARG 144 N 0.29 0.02 0.10 6.66 2.43 -0.71 0.36 114.38 123.53 1fg2 h ARG 144 Ca 0.07 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1fg2 h ARG 144 Cb 0.51 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1fg2 h ARG 144 CO 0.02 0.02 -0.05 0.00 -1.51 0.00 0.00 179.97 178.45 1fg2 h ARG 145 N 0.03 -0.13 -0.68 0.20 3.08 -1.07 0.30 114.38 116.10 1fg2 h ARG 145 Ca 0.16 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.32 1fg2 h ARG 145 Cb 0.24 0.03 -0.11 0.00 0.08 0.00 0.00 29.97 30.20 1fg2 h ARG 145 CO -0.32 0.11 -0.45 -0.22 -1.07 0.00 0.00 179.97 178.01 1fg2 h LYS 146 N -0.36 -0.17 -0.47 0.04 3.64 -0.43 0.15 116.57 118.98 1fg2 h LYS 146 Ca -0.01 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1fg2 h LYS 146 Cb 0.30 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1fg2 h LYS 146 CO 0.02 -0.11 -0.03 -1.49 -2.27 0.00 0.00 179.45 175.57 1fg2 h TRP 147 N -0.18 0.85 -0.07 1.91 4.06 -0.21 -3.02 115.95 119.29 1fg2 h TRP 147 Ca 0.19 -0.13 -0.02 0.00 2.06 0.00 0.00 58.89 61.00 1fg2 h TRP 147 Cb 0.55 -0.23 -0.00 0.00 -1.00 0.00 0.00 29.16 28.48 1fg2 h TRP 147 CO -0.77 0.80 -0.03 0.93 -3.56 0.00 0.00 178.44 175.80 1fg2 h GLU 148 N 0.73 0.16 0.00 0.49 5.08 0.57 -1.56 114.58 120.05 1fg2 h GLU 148 Ca 0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1fg2 h GLU 148 Cb 0.48 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1fg2 h GLU 148 CO 0.02 0.52 0.00 1.04 -1.00 0.00 0.00 179.01 179.60 1fg2 n GLN 149 N -4.77 0.09 0.00 2.33 6.02 0.39 -2.33 117.38 119.11 1fg2 n GLN 149 Ca -0.07 0.24 0.04 0.00 -0.01 0.00 0.00 57.00 57.20 1fg2 n GLN 149 Cb 0.25 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.04 1fg2 n GLN 149 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1fg2 n SER 150 N -1.37 1.44 -1.37 1.08 3.41 -1.14 -5.00 113.62 110.66 1fg2 n SER 150 Ca 0.04 -1.22 -0.09 0.00 -0.26 0.00 0.00 58.87 57.34 1fg2 n SER 150 Cb 0.10 0.13 0.02 0.00 -0.26 0.00 0.00 64.21 64.19 1fg2 n SER 150 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fg2 n GLY 151 N 0.50 0.21 0.08 5.00 0.00 -0.98 -4.95 105.19 105.04 1fg2 n GLY 151 Ca 0.04 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 1fg2 n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fg2 h ALA 152 N 0.40 0.13 -1.01 4.61 0.00 -1.55 -3.06 119.26 118.78 1fg2 h ALA 152 Ca -0.21 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 54.91 1fg2 h ALA 152 Cb 1.15 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.78 1fg2 h ALA 152 CO 0.23 -0.36 0.61 0.00 0.00 0.00 0.00 179.25 179.72 1fg2 h ALA 153 N 1.01 1.83 -0.75 0.00 0.00 -1.89 0.50 119.26 119.96 1fg2 h ALA 153 Ca 0.04 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1fg2 h ALA 153 Cb 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1fg2 h ALA 153 CO -0.01 -0.27 0.38 0.93 0.00 0.00 0.00 179.25 180.29 1fg2 h GLU 154 N 0.60 1.06 0.11 0.00 3.07 -1.80 0.32 114.58 117.95 1fg2 h GLU 154 Ca 0.62 -0.14 -0.00 0.00 -0.50 0.00 0.00 59.36 59.34 1fg2 h GLU 154 Cb 1.19 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1fg2 h GLU 154 CO -0.42 0.81 -0.07 1.25 -1.40 0.00 0.00 179.01 179.18 1fg2 h HIS 155 N 1.04 -0.18 -0.29 4.33 -0.00 -0.94 -1.28 115.15 117.83 1fg2 h HIS 155 Ca 0.26 -0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.56 1fg2 h HIS 155 Cb 0.08 0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.54 1fg2 h HIS 155 CO 0.00 -0.11 -0.13 1.88 -0.00 0.00 0.00 177.93 179.57 1fg2 h TYR 156 N -0.18 0.53 -0.18 5.26 0.05 -1.27 -2.77 116.97 118.41 1fg2 h TYR 156 Ca -0.01 -0.08 0.02 0.00 0.05 0.00 0.00 58.73 58.71 1fg2 h TYR 156 Cb 0.15 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1fg2 h TYR 156 CO -0.08 0.61 0.05 -0.22 -1.05 0.00 0.00 178.16 177.46 1fg2 h LYS 157 N 0.45 0.12 -0.21 4.88 3.64 -0.53 -0.01 116.57 124.92 1fg2 h LYS 157 Ca 0.08 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1fg2 h LYS 157 Cb 0.50 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.26 1fg2 h LYS 157 CO 0.03 0.08 -0.02 0.00 -2.27 0.00 0.00 179.45 177.27 1fg2 h ALA 158 N 1.12 0.16 0.25 5.00 0.00 -0.98 -0.22 119.26 124.59 1fg2 h ALA 158 Ca 0.08 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1fg2 h ALA 158 Cb 0.06 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1fg2 h ALA 158 CO -0.09 -0.45 -0.20 -0.92 0.00 0.00 0.00 179.25 177.58 1fg2 h TYR 159 N 0.03 -0.52 -0.88 0.00 3.20 -1.22 0.10 116.97 117.68 1fg2 h TYR 159 Ca 0.10 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.08 1fg2 h TYR 159 Cb 0.14 0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.54 1fg2 h TYR 159 CO -0.20 -0.30 0.57 -0.07 -1.64 0.00 0.00 178.16 176.52 1fg2 h LEU 160 N -0.46 0.75 0.00 2.82 3.38 -0.67 -1.29 115.31 119.84 1fg2 h LEU 160 Ca -0.01 0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 1fg2 h LEU 160 Cb 0.41 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1fg2 h LEU 160 CO -0.02 0.43 -1.11 -0.33 0.09 0.00 0.00 178.44 177.50 1fg2 h GLU 161 N 0.82 0.00 0.00 1.13 5.08 -0.85 -3.36 114.58 117.40 1fg2 h GLU 161 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1fg2 h GLU 161 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1fg2 h GLU 161 CO -0.18 0.34 0.00 0.41 -1.00 0.00 0.00 179.01 178.58 1fg2 n GLY 162 N 1.33 0.11 0.33 -3.84 0.00 0.33 -4.56 105.19 98.90 1fg2 n GLY 162 Ca -0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 1fg2 n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fg2 n GLU 163 N 0.00 -0.27 -0.08 1.61 1.02 -1.06 0.31 120.64 122.17 1fg2 n GLU 163 Ca 0.00 1.27 -0.09 0.00 -0.02 0.00 0.00 57.16 58.32 1fg2 n GLU 163 Cb 0.00 -1.88 -0.03 0.00 -0.02 0.00 0.00 31.44 29.50 1fg2 n GLU 163 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fg2 h VAL 165 N -0.34 0.92 -0.34 0.00 2.07 -1.17 -0.70 116.25 116.70 1fg2 h VAL 165 Ca 0.13 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1fg2 h VAL 165 Cb 0.56 1.19 -0.08 0.00 -1.52 0.00 0.00 31.29 31.44 1fg2 h VAL 165 CO -0.48 0.10 -0.21 -0.33 0.02 0.00 0.00 177.57 176.67 1fg2 h GLU 166 N -0.45 -0.16 -0.03 1.57 4.39 0.39 -1.83 114.58 118.46 1fg2 h GLU 166 Ca -0.02 0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 1fg2 h GLU 166 Cb 0.35 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1fg2 h GLU 166 CO 0.04 -0.11 -0.56 -1.49 -1.16 0.00 0.00 179.01 175.74 1fg2 h TRP 167 N -0.17 0.13 -0.45 4.33 4.06 -0.50 -2.76 115.95 120.59 1fg2 h TRP 167 Ca 0.17 -0.04 -0.04 0.00 2.06 0.00 0.00 58.89 61.03 1fg2 h TRP 167 Cb 0.43 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 28.55 1fg2 h TRP 167 CO -0.42 0.63 0.10 1.25 -3.56 0.00 0.00 178.44 176.44 1fg2 h LEU 168 N 0.08 0.63 -0.12 -4.49 5.85 -0.50 0.14 115.31 116.90 1fg2 h LEU 168 Ca -0.00 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 1fg2 h LEU 168 Cb 1.01 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1fg2 h LEU 168 CO 0.08 0.63 0.05 0.45 -0.34 0.00 0.00 178.44 179.32 1fg2 h HIS 169 N 0.66 0.17 -0.52 1.25 3.86 -1.17 0.23 115.15 119.62 1fg2 h HIS 169 Ca 0.15 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.35 1fg2 h HIS 169 Cb 0.27 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 1fg2 h HIS 169 CO 0.01 0.23 0.32 -0.09 0.86 0.00 0.00 177.93 179.27 1fg2 h ARG 170 N 0.06 0.70 -0.54 2.45 2.43 -1.11 -1.59 114.38 116.77 1fg2 h ARG 170 Ca 0.04 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1fg2 h ARG 170 Cb 0.13 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1fg2 h ARG 170 CO -0.00 0.49 -0.01 1.88 -1.51 0.00 0.00 179.97 180.82 1fg2 h TYR 171 N 0.70 1.05 -0.61 2.20 0.05 -0.57 -2.61 116.97 117.18 1fg2 h TYR 171 Ca 0.19 -0.19 0.06 0.00 0.05 0.00 0.00 58.73 58.84 1fg2 h TYR 171 Cb -0.03 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.40 1fg2 h TYR 171 CO -0.03 0.96 0.40 -0.07 -1.05 0.00 0.00 178.16 178.38 1fg2 h LEU 172 N 0.84 0.53 0.17 3.88 3.38 -0.08 -2.33 115.31 121.70 1fg2 h LEU 172 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1fg2 h LEU 172 Cb 0.55 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1fg2 h LEU 172 CO 0.03 0.35 -0.08 0.11 0.09 0.00 0.00 178.44 178.93 1fg2 h LYS 173 N 0.60 -0.23 0.00 1.13 1.57 -1.03 -3.08 116.57 115.54 1fg2 h LYS 173 Ca 0.26 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1fg2 h LYS 173 Cb 0.26 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1fg2 h LYS 173 CO -0.08 0.19 0.00 0.09 -0.57 0.00 0.00 179.45 179.08 1fg2 n ASN 174 N -4.97 0.00 -1.37 0.86 3.02 -1.01 -2.86 115.26 108.94 1fg2 n ASN 174 Ca -0.08 0.08 0.04 0.00 -0.03 0.00 0.00 54.58 54.58 1fg2 n ASN 174 Cb 0.26 -0.16 0.07 0.00 -0.61 0.00 0.00 39.78 39.35 1fg2 n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fg2 n GLY 175 N -0.91 2.22 0.25 7.41 0.00 -0.91 -4.80 105.19 108.45 1fg2 n GLY 175 Ca 0.02 -1.02 0.11 0.00 0.00 0.00 0.00 46.02 45.13 1fg2 n GLY 175 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1fg2 h ASN 176 N 1.13 0.00 -0.02 1.61 2.35 -1.45 0.29 115.58 119.48 1fg2 h ASN 176 Ca -0.15 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.55 1fg2 h ASN 176 Cb 1.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.00 1fg2 h ASN 176 CO 0.10 0.17 -0.16 0.00 -1.65 0.00 0.00 177.43 175.88 1fg2 h ALA 177 N 1.83 0.04 0.12 -0.83 0.00 -1.87 -3.39 119.26 115.18 1fg2 h ALA 177 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1fg2 h ALA 177 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1fg2 h ALA 177 CO 0.02 0.01 -0.06 1.15 0.00 0.00 0.00 179.25 180.37 1fg2 h THR 178 N -0.50 0.87 -3.53 0.00 2.02 -1.85 -3.44 112.91 106.49 1fg2 h THR 178 Ca -0.01 -1.28 -0.72 0.00 0.77 0.00 0.00 66.41 65.17 1fg2 h THR 178 Cb 0.86 1.52 -0.22 0.00 -1.74 0.00 0.00 68.15 68.57 1fg2 h THR 178 CO 0.03 0.25 -0.45 -0.76 0.37 0.00 0.00 175.52 174.95 1fg2 s LEU 179 N -8.83 5.00 0.00 2.58 1.43 0.99 -4.42 118.68 115.44 1fg2 s LEU 179 Ca -0.12 -0.93 0.00 0.00 -1.03 0.00 0.00 54.13 52.05 1fg2 s LEU 179 Cb -0.00 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 44.10 1fg2 s LEU 179 CO 0.45 -0.43 0.00 -0.11 0.23 0.00 0.00 176.35 176.48 1fg2 n LEU 180 N 5.11 0.00 -4.91 1.79 7.94 -1.26 -4.35 117.00 121.32 1fg2 n LEU 180 Ca -0.11 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.52 1fg2 n LEU 180 Cb 0.47 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.41 1fg2 n LEU 180 CO 0.40 0.00 0.39 0.00 -1.11 0.00 0.00 177.39 177.07 1fg2 s ARG 181 N 0.00 3.55 -0.36 1.96 1.70 -1.26 -5.08 118.95 119.47 1fg2 s ARG 181 Ca 0.00 0.12 0.06 0.00 -0.47 0.00 0.00 55.73 55.44 1fg2 s ARG 181 Cb 0.00 -2.44 0.18 0.00 -0.57 0.00 0.00 34.95 32.12 1fg2 s ARG 181 CO 0.00 -0.12 0.56 0.95 -1.08 0.00 0.00 175.30 175.61 1fg2 s THR 182 N -2.62 -0.86 -0.25 4.99 -4.23 -1.26 -4.81 115.64 106.61 1fg2 s THR 182 Ca 0.46 -0.18 -0.29 0.00 -1.18 0.00 0.00 61.69 60.50 1fg2 s THR 182 Cb -0.10 -0.47 -0.01 0.00 1.34 0.00 0.00 72.50 73.26 1fg2 s THR 182 CO 0.42 -0.12 1.41 -1.81 -0.54 0.00 0.00 174.62 173.97 1fg2 s ASP 183 N 2.12 6.62 0.61 3.99 1.11 -0.70 -4.86 116.67 125.57 1fg2 s ASP 183 Ca 0.14 1.45 -0.18 0.00 0.18 0.00 0.00 52.55 54.14 1fg2 s ASP 183 Cb -0.08 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.35 1fg2 s ASP 183 CO -0.14 -1.08 1.17 -0.44 1.18 0.00 0.00 175.17 175.86 1fg2 s SER 184 N 3.14 5.14 0.17 0.27 0.01 -1.26 -0.22 113.70 120.95 1fg2 s SER 184 Ca 0.61 2.26 -0.30 0.00 1.31 0.00 0.00 55.95 59.84 1fg2 s SER 184 Cb -0.21 -2.58 -0.07 0.00 0.21 0.00 0.00 66.02 63.37 1fg2 s SER 184 CO 0.24 -1.62 1.06 -2.16 0.41 0.00 0.00 173.24 171.17 1fg2 s PRO 185 N -3.55 4.63 -0.32 12.44 0.04 -1.26 -4.28 135.00 142.70 1fg2 s PRO 185 Ca 0.74 1.64 -0.11 0.00 0.04 0.00 0.00 61.00 63.31 1fg2 s PRO 185 Cb -0.27 -3.30 -0.01 0.00 0.04 0.00 0.00 34.50 30.96 1fg2 s PRO 185 CO 0.35 0.14 0.19 0.15 0.04 0.00 0.00 177.00 177.87 1fg2 s LYS 186 N -0.35 3.42 0.06 4.56 1.02 -0.63 -4.87 119.74 122.94 1fg2 s LYS 186 Ca 0.48 -0.68 0.06 0.00 0.02 0.00 0.00 55.97 55.86 1fg2 s LYS 186 Cb -0.28 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.32 1fg2 s LYS 186 CO 0.34 -0.43 -0.13 0.00 -0.92 0.00 0.00 175.35 174.21 1fg2 s ALA 187 N 1.67 2.80 0.25 5.17 0.00 -1.26 -1.40 121.76 128.99 1fg2 s ALA 187 Ca 0.05 -1.19 -0.04 0.00 0.00 0.00 0.00 51.96 50.79 1fg2 s ALA 187 Cb -0.17 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.07 1fg2 s ALA 187 CO 0.08 0.60 0.30 -3.38 0.00 0.00 0.00 175.76 173.37 1fg2 s HIS 188 N -1.05 0.98 0.04 0.00 -3.43 -0.90 -4.99 115.29 105.95 1fg2 s HIS 188 Ca 0.17 -1.21 0.06 0.00 -0.80 0.00 0.00 55.06 53.28 1fg2 s HIS 188 Cb -0.11 -0.28 -0.02 0.00 -1.43 0.00 0.00 32.58 30.74 1fg2 s HIS 188 CO 0.09 -0.85 -0.17 0.08 -2.00 0.00 0.00 174.74 171.88 1fg2 s VAL 189 N -3.85 1.39 0.05 -5.38 1.01 -1.26 -0.69 120.40 111.67 1fg2 s VAL 189 Ca 0.33 -1.07 0.09 0.00 0.00 0.00 0.00 61.98 61.33 1fg2 s VAL 189 Cb 0.03 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1fg2 s VAL 189 CO 0.14 0.13 -0.26 0.42 0.00 0.00 0.00 175.10 175.53 1fg2 s THR 190 N -0.79 2.14 -0.26 3.92 -4.23 -0.22 -4.97 115.64 111.23 1fg2 s THR 190 Ca 0.05 -1.42 -0.08 0.00 -1.18 0.00 0.00 61.69 59.06 1fg2 s THR 190 Cb -0.08 -1.83 -0.03 0.00 1.34 0.00 0.00 72.50 71.90 1fg2 s THR 190 CO 0.01 0.34 0.10 -2.28 -0.54 0.00 0.00 174.62 172.25 1fg2 s HIS 191 N -0.82 3.12 -0.27 3.99 2.46 -1.26 -1.66 115.29 120.84 1fg2 s HIS 191 Ca 0.12 -0.41 0.01 0.00 0.47 0.00 0.00 55.06 55.25 1fg2 s HIS 191 Cb -0.10 -2.27 0.05 0.00 -0.13 0.00 0.00 32.58 30.13 1fg2 s HIS 191 CO 0.02 -0.36 -0.08 -1.01 -2.47 0.00 0.00 174.74 170.84 1fg2 s HIS 192 N 1.63 3.24 0.09 3.88 3.76 -0.21 -4.99 115.29 122.68 1fg2 s HIS 192 Ca 0.06 -2.15 -0.08 0.00 -0.15 0.00 0.00 55.06 52.74 1fg2 s HIS 192 Cb -0.16 -1.98 -0.05 0.00 1.11 0.00 0.00 32.58 31.50 1fg2 s HIS 192 CO 0.05 -0.85 0.11 -2.30 -0.85 0.00 0.00 174.74 170.89 1fg2 n PRO 193 N 4.50 0.00 0.00 8.40 -0.02 -1.26 -0.68 135.00 145.94 1fg2 n PRO 193 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.34 1fg2 n PRO 193 Cb 0.43 -0.32 0.00 0.00 -0.02 0.00 0.00 33.50 33.59 1fg2 n PRO 193 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1fg2 n ARG 194 N 0.37 1.96 0.00 -0.52 -4.01 -1.22 -4.54 116.66 108.70 1fg2 n ARG 194 Ca 0.05 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.86 1fg2 n ARG 194 Cb 0.10 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.52 1fg2 n ARG 194 CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 1fg2 n SER 195 N 0.00 0.17 0.00 2.89 3.41 -1.02 -4.79 113.62 114.28 1fg2 n SER 195 Ca 0.00 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 1fg2 n SER 195 Cb 0.00 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1fg2 n SER 195 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1fg2 n LYS 196 N -0.15 0.00 -2.26 4.33 4.81 -1.26 -4.89 118.16 118.73 1fg2 n LYS 196 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.41 1fg2 n LYS 196 Cb 0.09 0.00 0.08 0.00 0.02 0.00 0.00 35.03 35.22 1fg2 n LYS 196 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fg2 n GLY 197 N 0.00 1.57 2.65 3.14 0.00 -1.26 -5.07 105.19 106.22 1fg2 n GLY 197 Ca 0.00 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 1fg2 n GLY 197 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fg2 s GLU 198 N 0.10 0.16 0.39 1.61 2.12 -1.26 -2.73 118.70 119.09 1fg2 s GLU 198 Ca 0.07 -0.12 0.08 0.00 0.36 0.00 0.00 54.97 55.36 1fg2 s GLU 198 Cb 0.34 -1.34 -0.00 0.00 0.26 0.00 0.00 34.13 33.38 1fg2 s GLU 198 CO -0.10 -0.80 0.50 0.14 -0.54 0.00 0.00 175.26 174.46 1fg2 s VAL 199 N 2.21 3.22 -0.13 3.70 -7.23 0.68 -2.43 120.40 120.42 1fg2 s VAL 199 Ca 0.06 -1.08 -0.00 0.00 -1.81 0.00 0.00 61.98 59.15 1fg2 s VAL 199 Cb -0.16 -3.10 -0.01 0.00 0.56 0.00 0.00 36.38 33.67 1fg2 s VAL 199 CO -0.20 -0.05 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.52 1fg2 s THR 200 N -2.33 3.02 -0.24 5.32 2.01 0.15 -0.37 115.64 123.19 1fg2 s THR 200 Ca 0.51 -0.67 -0.07 0.00 0.31 0.00 0.00 61.69 61.77 1fg2 s THR 200 Cb -0.08 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.13 1fg2 s THR 200 CO 0.31 0.52 0.05 -0.76 -0.69 0.00 0.00 174.62 174.06 1fg2 s LEU 201 N 0.38 3.35 -0.24 4.42 1.43 -0.47 -1.05 118.68 126.50 1fg2 s LEU 201 Ca -0.11 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 52.70 1fg2 s LEU 201 Cb -0.16 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 1fg2 s LEU 201 CO 0.06 -0.03 0.01 -0.60 0.23 0.00 0.00 176.35 176.01 1fg2 s ARG 202 N 1.59 3.40 -0.34 1.70 6.06 -0.67 -1.28 118.95 129.41 1fg2 s ARG 202 Ca 0.06 -0.63 -0.15 0.00 -2.50 0.00 0.00 55.73 52.51 1fg2 s ARG 202 Cb -0.15 -3.16 -0.01 0.00 0.06 0.00 0.00 34.95 31.69 1fg2 s ARG 202 CO 0.03 -0.24 0.37 0.00 -2.50 0.00 0.00 175.30 172.96 1fg2 s TRP 204 N 2.05 3.48 -0.13 0.00 0.52 0.13 -1.31 118.94 123.67 1fg2 s TRP 204 Ca 0.12 0.36 0.00 0.00 0.02 0.00 0.00 56.10 56.61 1fg2 s TRP 204 Cb -0.16 -1.84 0.02 0.00 -1.15 0.00 0.00 33.47 30.34 1fg2 s TRP 204 CO 0.12 0.64 -0.12 0.00 0.02 0.00 0.00 176.95 177.61 1fg2 s ALA 205 N -1.18 1.65 0.21 0.98 0.00 -0.06 -2.11 121.76 121.25 1fg2 s ALA 205 Ca 0.22 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.47 1fg2 s ALA 205 Cb -0.12 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.99 1fg2 s ALA 205 CO 0.12 -0.33 -0.06 -0.51 0.00 0.00 0.00 175.76 174.99 1fg2 s LEU 206 N 1.45 2.38 -1.27 0.00 1.43 -0.49 -2.26 118.68 119.92 1fg2 s LEU 206 Ca 0.02 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.99 1fg2 s LEU 206 Cb -0.13 -0.41 0.00 0.00 0.03 0.00 0.00 46.19 45.68 1fg2 s LEU 206 CO -0.08 -0.39 0.00 0.61 0.23 0.00 0.00 176.35 176.72 1fg2 n GLY 207 N -0.38 0.14 3.96 -3.19 0.00 -1.16 -1.60 105.19 102.96 1fg2 n GLY 207 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 1fg2 n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1fg2 s PHE 208 N -2.49 3.35 -0.28 1.61 -0.12 -1.19 -4.63 117.98 114.23 1fg2 s PHE 208 Ca 0.00 0.17 -0.24 0.00 -0.05 0.00 0.00 56.93 56.81 1fg2 s PHE 208 Cb 0.00 -1.98 0.11 0.00 -0.63 0.00 0.00 43.02 40.51 1fg2 s PHE 208 CO 0.00 0.01 0.93 -0.47 -0.05 0.00 0.00 175.22 175.64 1fg2 s TYR 209 N -2.31 -0.59 1.34 3.49 5.04 0.70 -1.13 117.35 123.89 1fg2 s TYR 209 Ca 0.42 1.42 -0.22 0.00 -2.44 0.00 0.00 57.07 56.25 1fg2 s TYR 209 Cb -0.10 0.34 0.34 0.00 0.35 0.00 0.00 41.96 42.90 1fg2 s TYR 209 CO 0.35 -0.29 1.00 -2.14 -1.34 0.00 0.00 175.55 173.13 1fg2 s PRO 210 N 0.38 -2.32 0.51 4.97 0.02 -1.26 -1.72 135.00 135.59 1fg2 s PRO 210 Ca 0.01 0.04 0.28 0.00 0.02 0.00 0.00 61.00 61.35 1fg2 s PRO 210 Cb -0.05 -1.46 1.38 0.00 0.02 0.00 0.00 34.50 34.39 1fg2 s PRO 210 CO -0.05 -4.46 2.03 0.00 -0.33 0.00 0.00 177.00 174.19 1fg2 h ALA 211 N -3.12 1.19 -2.87 -1.55 0.00 -1.96 -3.45 119.26 107.50 1fg2 h ALA 211 Ca -0.44 -0.12 -0.53 0.00 0.00 0.00 0.00 54.91 53.82 1fg2 h ALA 211 Cb 1.32 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 19.19 1fg2 h ALA 211 CO 0.30 0.16 0.85 -0.51 0.00 0.00 0.00 179.25 180.05 1fg2 s ASP 212 N -6.08 6.33 -0.20 0.00 1.01 -1.26 -4.97 116.67 111.50 1fg2 s ASP 212 Ca -0.02 3.03 -0.35 0.00 0.71 0.00 0.00 52.55 55.92 1fg2 s ASP 212 Cb 0.12 -2.65 0.14 0.00 1.01 0.00 0.00 42.92 41.54 1fg2 s ASP 212 CO 0.58 -0.92 1.22 -0.51 0.21 0.00 0.00 175.17 175.75 1fg2 s ILE 213 N -0.52 0.00 -0.03 0.77 2.07 -1.26 -4.88 121.20 117.35 1fg2 s ILE 213 Ca 0.59 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.81 1fg2 s ILE 213 Cb -0.48 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.13 1fg2 s ILE 213 CO 0.56 0.00 0.08 -0.89 -1.91 0.00 0.00 174.94 172.77 1fg2 s THR 214 N -2.29 -0.03 -0.03 4.00 2.01 -1.05 -5.04 115.64 113.21 1fg2 s THR 214 Ca 0.09 0.11 0.07 0.00 0.31 0.00 0.00 61.69 62.27 1fg2 s THR 214 Cb -0.01 -0.13 -0.02 0.00 0.01 0.00 0.00 72.50 72.35 1fg2 s THR 214 CO -0.05 0.05 -0.23 -0.76 -0.69 0.00 0.00 174.62 172.94 1fg2 s LEU 215 N 0.64 2.04 0.01 4.42 1.02 -1.26 -2.15 118.68 123.40 1fg2 s LEU 215 Ca -0.05 -0.44 -0.04 0.00 0.02 0.00 0.00 54.13 53.62 1fg2 s LEU 215 Cb -0.07 -1.23 -0.01 0.00 0.02 0.00 0.00 46.19 44.91 1fg2 s LEU 215 CO -0.02 0.27 0.07 0.42 0.02 0.00 0.00 176.35 177.10 1fg2 s THR 216 N -0.41 0.09 -0.16 5.49 -4.23 -0.94 -4.98 115.64 110.50 1fg2 s THR 216 Ca 0.05 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.78 1fg2 s THR 216 Cb -0.10 -0.37 0.00 0.00 1.34 0.00 0.00 72.50 73.36 1fg2 s THR 216 CO 0.00 -0.43 -0.15 0.26 -0.54 0.00 0.00 174.62 173.76 1fg2 s TRP 217 N -1.44 2.79 -0.03 3.99 0.52 -1.26 -0.60 118.94 122.92 1fg2 s TRP 217 Ca -0.15 -1.12 0.01 0.00 0.02 0.00 0.00 56.10 54.86 1fg2 s TRP 217 Cb -0.08 -1.91 -0.03 0.00 -1.15 0.00 0.00 33.47 30.29 1fg2 s TRP 217 CO 0.01 -0.53 -0.03 -0.65 0.02 0.00 0.00 176.95 175.76 1fg2 s GLN 218 N 0.95 2.75 -0.62 4.98 -0.21 0.54 -0.41 119.66 127.65 1fg2 s GLN 218 Ca -0.03 -0.59 -0.10 0.00 0.02 0.00 0.00 55.36 54.66 1fg2 s GLN 218 Cb -0.15 -2.63 0.16 0.00 1.00 0.00 0.00 33.01 31.39 1fg2 s GLN 218 CO -0.02 0.64 0.51 -1.17 -2.12 0.00 0.00 175.29 173.13 1fg2 s LEU 219 N -1.27 5.98 -1.44 2.90 2.96 -0.95 -1.76 118.68 125.09 1fg2 s LEU 219 Ca 0.16 -2.33 -0.18 0.00 -0.22 0.00 0.00 54.13 51.56 1fg2 s LEU 219 Cb -0.11 -2.06 0.18 0.00 0.50 0.00 0.00 46.19 44.70 1fg2 s LEU 219 CO 0.06 -0.61 0.46 -0.46 -1.32 0.00 0.00 176.35 174.48 1fg2 n ASN 220 N 4.37 -1.55 0.00 3.68 0.23 -0.22 -4.11 115.26 117.66 1fg2 n ASN 220 Ca 0.01 -0.88 0.00 0.00 -0.53 0.00 0.00 54.58 53.18 1fg2 n ASN 220 Cb 0.42 -1.37 0.00 0.00 -2.08 0.00 0.00 39.78 36.75 1fg2 n ASN 220 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fg2 n GLY 221 N -0.92 -1.20 3.81 4.83 0.00 -1.26 -5.14 105.19 105.30 1fg2 n GLY 221 Ca 0.09 0.47 -0.32 0.00 0.00 0.00 0.00 46.02 46.27 1fg2 n GLY 221 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1fg2 s GLU 222 N 0.00 3.13 1.14 1.61 1.03 -1.26 -4.91 118.70 119.44 1fg2 s GLU 222 Ca 0.00 1.06 -0.19 0.00 0.03 0.00 0.00 54.97 55.87 1fg2 s GLU 222 Cb 0.00 -2.01 0.29 0.00 -0.80 0.00 0.00 34.13 31.61 1fg2 s GLU 222 CO 0.00 -0.95 0.66 0.39 -1.33 0.00 0.00 175.26 174.03 1fg2 n GLU 223 N -2.62 -4.04 -3.35 -4.83 1.02 -1.26 -2.24 120.64 103.31 1fg2 n GLU 223 Ca 0.08 -1.11 -0.20 0.00 -0.02 0.00 0.00 57.16 55.91 1fg2 n GLU 223 Cb 0.53 -1.48 -0.08 0.00 -0.02 0.00 0.00 31.44 30.39 1fg2 n GLU 223 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1fg2 s LEU 224 N 0.00 0.33 -0.02 -4.62 2.96 0.45 -4.54 118.68 113.24 1fg2 s LEU 224 Ca 0.51 -1.99 0.01 0.00 -0.22 0.00 0.00 54.13 52.45 1fg2 s LEU 224 Cb -0.09 0.27 0.08 0.00 0.50 0.00 0.00 46.19 46.95 1fg2 s LEU 224 CO 0.43 -0.24 0.65 0.41 -1.32 0.00 0.00 176.35 176.28 1fg2 n THR 225 N 3.87 0.28 -1.87 3.68 -1.04 -1.26 -4.50 114.28 113.43 1fg2 n THR 225 Ca 0.15 -0.14 -0.22 0.00 -2.04 0.00 0.00 64.05 61.80 1fg2 n THR 225 Cb 0.44 -0.45 -0.06 0.00 -1.82 0.00 0.00 70.33 68.45 1fg2 n THR 225 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1fg2 s GLN 226 N -1.22 2.18 -1.31 -2.82 -0.44 -1.26 -4.00 119.66 110.80 1fg2 s GLN 226 Ca 0.06 -0.06 -0.16 0.00 -2.50 0.00 0.00 55.36 52.70 1fg2 s GLN 226 Cb 0.04 -4.97 0.16 0.00 -1.64 0.00 0.00 33.01 26.61 1fg2 s GLN 226 CO 0.02 -3.83 0.41 -3.47 0.50 0.00 0.00 175.29 168.92 1fg2 n ASP 227 N 15.78 -1.24 -4.70 6.67 2.03 -1.26 -4.80 116.55 129.04 1fg2 n ASP 227 Ca 0.43 -0.87 -0.42 0.00 0.52 0.00 0.00 54.79 54.45 1fg2 n ASP 227 Cb 0.46 -1.11 -0.03 0.00 -0.72 0.00 0.00 41.12 39.72 1fg2 n ASP 227 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 1fg2 s MET 228 N -5.35 4.22 0.09 -0.67 -2.45 -1.26 -4.88 119.30 109.00 1fg2 s MET 228 Ca 0.57 2.28 -0.13 0.00 -1.25 0.00 0.00 55.69 57.17 1fg2 s MET 228 Cb -0.33 -3.46 -0.06 0.00 1.25 0.00 0.00 34.83 32.22 1fg2 s MET 228 CO 0.71 -0.66 0.46 -2.00 1.05 0.00 0.00 175.02 174.58 1fg2 s GLU 229 N 2.12 3.88 0.16 4.11 2.12 -0.25 -4.90 118.70 125.95 1fg2 s GLU 229 Ca 0.71 0.35 -0.02 0.00 0.36 0.00 0.00 54.97 56.37 1fg2 s GLU 229 Cb -0.40 -3.02 0.01 0.00 0.26 0.00 0.00 34.13 30.98 1fg2 s GLU 229 CO 0.31 0.56 0.25 1.47 -0.54 0.00 0.00 175.26 177.31 1fg2 n LEU 230 N 1.07 0.00 -4.04 2.70 -0.00 -1.26 0.50 117.00 115.97 1fg2 n LEU 230 Ca -0.08 -1.23 -0.09 0.00 -0.00 0.00 0.00 56.01 54.61 1fg2 n LEU 230 Cb 0.52 1.29 -0.11 0.00 -0.00 0.00 0.00 43.42 45.12 1fg2 n LEU 230 CO 0.41 -0.32 -0.36 0.68 -0.00 0.00 0.00 177.39 177.80 1fg2 s VAL 231 N -2.60 0.22 0.51 1.47 -7.23 -1.14 -5.01 120.40 106.62 1fg2 s VAL 231 Ca 0.11 -1.34 -0.22 0.00 -1.81 0.00 0.00 61.98 58.72 1fg2 s VAL 231 Cb -0.01 -0.87 -0.06 0.00 0.56 0.00 0.00 36.38 36.00 1fg2 s VAL 231 CO 0.08 -0.71 1.30 -0.70 -0.31 0.00 0.00 175.10 174.75 1fg2 s GLU 232 N -2.59 3.41 0.27 4.82 2.12 -1.26 -4.61 118.70 120.86 1fg2 s GLU 232 Ca -0.05 2.09 -0.31 0.00 0.36 0.00 0.00 54.97 57.06 1fg2 s GLU 232 Cb -0.02 -2.35 -0.12 0.00 0.26 0.00 0.00 34.13 31.90 1fg2 s GLU 232 CO -0.05 -0.93 1.63 2.41 -0.54 0.00 0.00 175.26 177.78 1fg2 n THR 233 N -0.75 0.73 -4.30 -1.70 -1.04 -1.26 -4.87 114.28 101.09 1fg2 n THR 233 Ca 0.09 -0.18 -0.20 0.00 -2.04 0.00 0.00 64.05 61.71 1fg2 n THR 233 Cb 0.46 -1.96 -0.11 0.00 -1.82 0.00 0.00 70.33 66.90 1fg2 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1fg2 s ARG 234 N -0.03 1.18 0.15 -2.82 1.04 -0.55 -4.96 118.95 112.97 1fg2 s ARG 234 Ca 0.67 -1.35 -0.29 0.00 -1.04 0.00 0.00 55.73 53.72 1fg2 s ARG 234 Cb -0.50 -1.15 -0.07 0.00 -2.04 0.00 0.00 34.95 31.18 1fg2 s ARG 234 CO 0.44 0.23 0.90 -1.25 -0.04 0.00 0.00 175.30 175.58 1fg2 s PRO 235 N -2.80 4.71 0.34 3.89 0.04 -1.26 0.15 135.00 140.06 1fg2 s PRO 235 Ca 0.14 1.38 0.26 0.00 0.04 0.00 0.00 61.00 62.81 1fg2 s PRO 235 Cb -0.05 -3.33 0.76 0.00 0.04 0.00 0.00 34.50 31.93 1fg2 s PRO 235 CO 0.05 0.37 1.74 0.00 0.04 0.00 0.00 177.00 179.20 1fg2 h ALA 236 N 4.97 1.00 0.00 8.56 0.00 -1.21 -3.46 119.26 129.11 1fg2 h ALA 236 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1fg2 h ALA 236 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1fg2 h ALA 236 CO 0.70 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.36 1fg2 n GLY 237 N 0.86 0.21 0.91 0.00 0.00 -1.26 -4.91 105.19 101.00 1fg2 n GLY 237 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1fg2 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fg2 n ASP 238 N 0.00 3.70 0.00 1.61 5.68 -1.26 -4.93 116.55 121.34 1fg2 n ASP 238 Ca 0.00 -2.57 0.00 0.00 -0.50 0.00 0.00 54.79 51.72 1fg2 n ASP 238 Cb 0.00 -0.44 0.00 0.00 -1.14 0.00 0.00 41.12 39.54 1fg2 n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fg2 n GLY 239 N 0.09 3.24 3.94 6.12 0.00 -1.26 -5.05 105.19 112.27 1fg2 n GLY 239 Ca 0.18 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.01 1fg2 n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fg2 s THR 240 N -2.91 2.85 0.24 2.61 -4.23 -1.26 -4.89 115.64 108.05 1fg2 s THR 240 Ca 0.00 -1.18 0.11 0.00 -1.18 0.00 0.00 61.69 59.44 1fg2 s THR 240 Cb 0.00 -3.01 -0.05 0.00 1.34 0.00 0.00 72.50 70.78 1fg2 s THR 240 CO 0.00 -0.01 -0.21 -0.36 -0.54 0.00 0.00 174.62 173.51 1fg2 s PHE 241 N -2.41 2.20 0.26 3.99 0.40 -0.28 -0.66 117.98 121.48 1fg2 s PHE 241 Ca 0.51 -0.37 0.07 0.00 -0.60 0.00 0.00 56.93 56.54 1fg2 s PHE 241 Cb -0.06 -1.01 -0.05 0.00 0.51 0.00 0.00 43.02 42.40 1fg2 s PHE 241 CO 0.30 0.59 -0.09 -0.65 0.70 0.00 0.00 175.22 176.07 1fg2 s GLN 242 N -3.21 1.49 -0.24 0.44 -0.21 0.12 -3.00 119.66 115.05 1fg2 s GLN 242 Ca 0.25 -1.73 -0.30 0.00 0.02 0.00 0.00 55.36 53.60 1fg2 s GLN 242 Cb -0.06 -1.16 0.17 0.00 1.00 0.00 0.00 33.01 32.96 1fg2 s GLN 242 CO 0.12 0.09 1.23 0.21 -2.12 0.00 0.00 175.29 174.82 1fg2 s LYS 243 N -3.70 0.25 0.03 2.91 2.20 -0.96 -1.48 119.74 118.99 1fg2 s LYS 243 Ca 0.28 0.04 -0.16 0.00 -0.36 0.00 0.00 55.97 55.76 1fg2 s LYS 243 Cb 0.02 0.12 0.03 0.00 -1.51 0.00 0.00 37.83 36.49 1fg2 s LYS 243 CO 0.11 -0.08 0.36 1.67 -0.36 0.00 0.00 175.35 177.04 1fg2 s TRP 244 N -1.23 -0.20 0.01 4.03 1.48 -1.26 -0.89 118.94 120.88 1fg2 s TRP 244 Ca 0.06 0.17 0.03 0.00 -1.06 0.00 0.00 56.10 55.30 1fg2 s TRP 244 Cb -0.01 0.15 -0.01 0.00 -1.16 0.00 0.00 33.47 32.44 1fg2 s TRP 244 CO -0.05 -0.50 -0.09 0.00 -4.06 0.00 0.00 176.95 172.25 1fg2 s ALA 245 N -2.18 0.72 0.11 2.67 0.00 -0.43 -2.87 121.76 119.78 1fg2 s ALA 245 Ca -0.07 -0.50 -0.00 0.00 0.00 0.00 0.00 51.96 51.39 1fg2 s ALA 245 Cb -0.02 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 1fg2 s ALA 245 CO -0.01 0.13 0.01 -1.54 0.00 0.00 0.00 175.76 174.36 1fg2 s SER 246 N -0.60 0.59 0.03 0.00 1.04 0.18 0.12 113.70 115.05 1fg2 s SER 246 Ca 0.00 -1.12 -0.11 0.00 0.48 0.00 0.00 55.95 55.20 1fg2 s SER 246 Cb -0.05 0.22 0.01 0.00 0.10 0.00 0.00 66.02 66.30 1fg2 s SER 246 CO 0.00 -0.64 0.23 0.68 0.98 0.00 0.00 173.24 174.49 1fg2 s VAL 247 N -3.91 0.09 -0.23 5.02 -7.23 -0.40 -1.09 120.40 112.65 1fg2 s VAL 247 Ca 0.18 -0.76 -0.26 0.00 -1.81 0.00 0.00 61.98 59.33 1fg2 s VAL 247 Cb 0.07 -0.83 -0.00 0.00 0.56 0.00 0.00 36.38 36.18 1fg2 s VAL 247 CO -0.02 -0.42 0.88 0.68 -0.31 0.00 0.00 175.10 175.91 1fg2 s VAL 248 N -2.26 4.81 -0.04 1.32 -7.23 -1.26 -1.37 120.40 114.36 1fg2 s VAL 248 Ca -0.07 1.68 0.03 0.00 -1.81 0.00 0.00 61.98 61.80 1fg2 s VAL 248 Cb -0.02 -4.16 0.00 0.00 0.56 0.00 0.00 36.38 32.76 1fg2 s VAL 248 CO -0.02 -0.09 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.88 1fg2 s VAL 249 N 2.85 0.99 -0.16 1.32 1.01 0.50 -4.99 120.40 121.92 1fg2 s VAL 249 Ca 0.37 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.60 1fg2 s VAL 249 Cb -0.15 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.31 1fg2 s VAL 249 CO 0.08 0.30 1.82 -2.16 0.00 0.00 0.00 175.10 175.14 1fg2 s PRO 250 N 0.23 3.73 0.13 2.72 0.04 -1.26 -0.23 135.00 140.35 1fg2 s PRO 250 Ca -0.05 1.96 -0.25 0.00 0.04 0.00 0.00 61.00 62.70 1fg2 s PRO 250 Cb -0.10 -4.14 -0.14 0.00 0.04 0.00 0.00 34.50 30.16 1fg2 s PRO 250 CO 0.01 -1.39 0.52 -0.11 0.04 0.00 0.00 177.00 176.07 1fg2 n LEU 251 N 8.94 -0.81 0.00 -3.56 0.00 -1.10 -0.57 117.00 119.89 1fg2 n LEU 251 Ca 0.21 0.93 0.00 0.00 0.00 0.00 0.00 56.01 57.15 1fg2 n LEU 251 Cb 0.44 -0.77 0.00 0.00 0.00 0.00 0.00 43.42 43.09 1fg2 n LEU 251 CO 0.66 -2.26 0.00 0.61 0.00 0.00 0.00 177.39 176.40 1fg2 n GLY 252 N 1.55 1.67 1.29 -3.96 0.00 -1.26 -4.75 105.19 99.72 1fg2 n GLY 252 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1fg2 n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fg2 n LYS 253 N 0.00 0.99 0.00 1.61 4.76 0.26 -4.74 118.16 121.04 1fg2 n LYS 253 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1fg2 n LYS 253 Cb 0.00 -1.01 0.00 0.00 -1.84 0.00 0.00 35.03 32.18 1fg2 n LYS 253 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1fg2 n GLU 254 N 1.08 3.57 0.00 1.97 0.28 -1.26 -4.58 120.64 121.70 1fg2 n GLU 254 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1fg2 n GLU 254 Cb 0.49 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.36 1fg2 n GLU 254 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1fg2 n GLN 255 N 0.00 0.00 -0.01 3.44 1.13 -1.26 -4.23 117.38 116.45 1fg2 n GLN 255 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1fg2 n GLN 255 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1fg2 n GLN 255 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1fg2 n ASN 256 N 0.96 0.57 -4.17 1.08 6.94 -1.26 -4.50 115.26 114.89 1fg2 n ASN 256 Ca 0.00 -2.00 -0.34 0.00 -0.02 0.00 0.00 54.58 52.22 1fg2 n ASN 256 Cb 0.00 -0.27 -0.14 0.00 -2.36 0.00 0.00 39.78 37.01 1fg2 n ASN 256 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1fg2 s TYR 257 N -1.47 3.14 0.13 -2.53 1.51 -1.26 -1.06 117.35 115.81 1fg2 s TYR 257 Ca 0.00 -1.78 0.09 0.00 -1.01 0.00 0.00 57.07 54.37 1fg2 s TYR 257 Cb 0.00 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 1fg2 s TYR 257 CO 0.00 -0.78 -0.16 0.95 -1.11 0.00 0.00 175.55 174.45 1fg2 s THR 258 N 1.26 2.93 -0.03 -0.71 -4.23 -0.72 -4.66 115.64 109.48 1fg2 s THR 258 Ca -0.03 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1fg2 s THR 258 Cb -0.18 -2.37 -0.03 0.00 1.34 0.00 0.00 72.50 71.26 1fg2 s THR 258 CO -0.04 0.06 -0.00 0.00 -0.54 0.00 0.00 174.62 174.10 1fg2 s ARG 260 N -1.31 2.80 -0.27 0.00 1.81 0.23 -1.20 118.95 121.00 1fg2 s ARG 260 Ca 0.17 -0.87 0.01 0.00 -1.72 0.00 0.00 55.73 53.33 1fg2 s ARG 260 Cb -0.11 -2.26 0.07 0.00 -0.45 0.00 0.00 34.95 32.20 1fg2 s ARG 260 CO 0.07 0.31 -0.01 0.08 -0.68 0.00 0.00 175.30 175.08 1fg2 s VAL 261 N 0.03 1.54 -0.17 3.52 1.01 -0.49 -2.20 120.40 123.63 1fg2 s VAL 261 Ca -0.09 -1.44 -0.09 0.00 0.00 0.00 0.00 61.98 60.36 1fg2 s VAL 261 Cb -0.15 -1.92 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 1fg2 s VAL 261 CO 0.05 -0.29 0.13 -0.31 0.00 0.00 0.00 175.10 174.69 1fg2 s TYR 262 N 1.35 3.46 0.23 5.22 1.51 -0.92 -0.78 117.35 127.43 1fg2 s TYR 262 Ca -0.00 0.38 0.00 0.00 -1.01 0.00 0.00 57.07 56.44 1fg2 s TYR 262 Cb -0.19 -2.08 0.00 0.00 -0.11 0.00 0.00 41.96 39.59 1fg2 s TYR 262 CO -0.10 0.44 0.00 1.58 -1.11 0.00 0.00 175.55 176.36 1fg2 n HIS 263 N 2.99 -2.18 0.00 2.71 -0.00 -1.26 -2.54 115.22 114.94 1fg2 n HIS 263 Ca -0.17 0.46 0.00 0.00 0.46 0.00 0.00 57.72 58.46 1fg2 n HIS 263 Cb 0.53 0.96 0.00 0.00 -0.12 0.00 0.00 29.99 31.36 1fg2 n HIS 263 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 1fg2 n GLU 264 N -3.19 0.00 -0.63 1.57 2.13 -1.26 -4.81 120.64 114.46 1fg2 n GLU 264 Ca 0.00 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.80 1fg2 n GLU 264 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.70 1fg2 n GLU 264 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1fg2 n GLY 265 N -1.70 0.18 3.12 8.31 0.00 -1.26 -4.79 105.19 109.05 1fg2 n GLY 265 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1fg2 n GLY 265 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fg2 s LEU 266 N -1.20 3.96 0.08 0.99 2.96 -1.26 -4.63 118.68 119.57 1fg2 s LEU 266 Ca 0.00 -1.48 -0.15 0.00 -0.22 0.00 0.00 54.13 52.28 1fg2 s LEU 266 Cb 0.00 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 1fg2 s LEU 266 CO 0.00 -0.27 0.78 -2.65 -1.32 0.00 0.00 176.35 172.88 1fg2 n PRO 267 N 4.51 -0.21 -4.08 0.98 -0.02 -1.26 -4.59 135.00 130.34 1fg2 n PRO 267 Ca -0.11 0.76 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1fg2 n PRO 267 Cb 0.43 -1.12 -0.09 0.00 -0.02 0.00 0.00 33.50 32.70 1fg2 n PRO 267 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1fg2 s GLU 268 N -5.10 1.05 0.51 -0.52 2.02 -1.26 -5.10 118.70 110.30 1fg2 s GLU 268 Ca -0.06 -1.35 -0.23 0.00 0.02 0.00 0.00 54.97 53.36 1fg2 s GLU 268 Cb 0.05 0.30 -0.06 0.00 0.10 0.00 0.00 34.13 34.52 1fg2 s GLU 268 CO 0.30 -0.34 1.30 -2.30 0.02 0.00 0.00 175.26 174.23 1fg2 n PRO 269 N -0.16 1.70 -3.10 0.39 -0.02 -1.26 -4.95 135.00 127.60 1fg2 n PRO 269 Ca -0.06 0.62 -0.33 0.00 -2.02 0.00 0.00 63.50 61.71 1fg2 n PRO 269 Cb 0.64 -2.48 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 1fg2 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1fg2 s LEU 270 N -2.78 4.11 -0.06 2.45 1.43 0.04 -4.86 118.68 119.02 1fg2 s LEU 270 Ca 0.69 1.34 0.02 0.00 -1.03 0.00 0.00 54.13 55.15 1fg2 s LEU 270 Cb -0.44 -4.02 0.01 0.00 0.03 0.00 0.00 46.19 41.77 1fg2 s LEU 270 CO 0.52 -0.17 -0.11 -0.89 0.23 0.00 0.00 176.35 175.92 1fg2 s THR 271 N -1.91 1.07 0.08 5.49 2.01 -1.26 -1.40 115.64 119.73 1fg2 s THR 271 Ca 0.53 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.09 1fg2 s THR 271 Cb -0.11 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 1fg2 s THR 271 CO 0.18 0.34 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.65 1fg2 s LEU 272 N 0.71 2.45 0.00 4.42 1.43 -0.34 -4.94 118.68 122.41 1fg2 s LEU 272 Ca -0.14 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 51.94 1fg2 s LEU 272 Cb -0.16 0.06 0.00 0.00 0.03 0.00 0.00 46.19 46.13 1fg2 s LEU 272 CO 0.03 -0.54 0.00 -2.11 0.23 0.00 0.00 176.35 173.96 1fg2 n ARG 273 N 0.01 0.07 0.00 1.70 0.00 -1.26 -0.73 116.66 116.46 1fg2 n ARG 273 Ca -0.12 0.00 0.12 0.00 -0.00 0.00 0.00 57.85 57.85 1fg2 n ARG 273 Cb 0.61 0.00 0.73 0.00 -0.00 0.00 0.00 32.46 33.80 1fg2 n ARG 273 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50