#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ggw s ILE 2 N 0.00 2.79 -0.27 0.53 1.01 -1.26 -4.99 121.20 119.00 3ggw s ILE 2 Ca 0.00 0.55 -0.14 0.00 0.00 0.00 0.00 60.65 61.06 3ggw s ILE 2 Cb 0.00 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 3ggw s ILE 2 CO 0.00 0.04 0.34 -0.69 0.00 0.00 0.00 174.94 174.63 3ggw s VAL 3 N 1.20 5.20 -0.30 2.92 1.01 -1.26 -4.79 120.40 124.37 3ggw s VAL 3 Ca 0.69 0.51 -0.10 0.00 0.00 0.00 0.00 61.98 63.08 3ggw s VAL 3 Cb -0.42 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 3ggw s VAL 3 CO 0.31 0.18 0.16 -0.04 0.00 0.00 0.00 175.10 175.70 3ggw s MET 4 N 2.00 3.46 -0.27 2.72 1.00 -1.26 -1.44 119.30 125.51 3ggw s MET 4 Ca 0.14 -0.64 -0.07 0.00 0.00 0.00 0.00 55.69 55.12 3ggw s MET 4 Cb -0.16 -3.57 -0.01 0.00 0.00 0.00 0.00 34.83 31.08 3ggw s MET 4 CO 0.10 -0.37 0.08 0.99 0.00 0.00 0.00 175.02 175.83 3ggw s THR 5 N 1.64 4.22 0.05 2.05 2.01 0.88 -4.07 115.64 122.42 3ggw s THR 5 Ca 0.05 -0.38 0.06 0.00 0.31 0.00 0.00 61.69 61.73 3ggw s THR 5 Cb -0.17 -3.06 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 3ggw s THR 5 CO 0.07 0.22 -0.17 -1.10 -0.69 0.00 0.00 174.62 172.95 3ggw s GLN 6 N 1.58 1.10 0.45 4.92 -0.21 -1.26 -1.30 119.66 124.94 3ggw s GLN 6 Ca 0.05 -0.86 -0.23 0.00 0.02 0.00 0.00 55.36 54.34 3ggw s GLN 6 Cb -0.16 -1.17 -0.08 0.00 1.00 0.00 0.00 33.01 32.61 3ggw s GLN 6 CO 0.03 0.29 1.16 0.00 -2.12 0.00 0.00 175.29 174.66 3ggw s ALA 7 N -0.87 3.01 0.30 6.09 0.00 -1.26 -4.64 121.76 124.39 3ggw s ALA 7 Ca 0.04 0.93 0.05 0.00 0.00 0.00 0.00 51.96 52.98 3ggw s ALA 7 Cb -0.08 -3.38 0.48 0.00 0.00 0.00 0.00 23.12 20.13 3ggw s ALA 7 CO 0.02 -0.62 1.74 0.00 0.00 0.00 0.00 175.76 176.90 3ggw h ALA 8 N 2.16 1.16 -3.41 0.00 0.00 -1.95 -3.29 119.26 113.93 3ggw h ALA 8 Ca -0.49 -0.35 -0.45 0.00 0.00 0.00 0.00 54.91 53.61 3ggw h ALA 8 Cb 1.24 -0.11 -0.21 0.00 0.00 0.00 0.00 17.79 18.72 3ggw h ALA 8 CO 0.61 0.54 -0.79 -0.06 0.00 0.00 0.00 179.25 179.55 3ggw s PHE 9 N -4.40 1.41 0.50 0.00 0.08 -1.26 -0.64 117.98 113.66 3ggw s PHE 9 Ca -0.06 -0.46 -0.12 0.00 0.12 0.00 0.00 56.93 56.42 3ggw s PHE 9 Cb 0.14 -0.78 -0.06 0.00 -0.57 0.00 0.00 43.02 41.75 3ggw s PHE 9 CO 0.78 0.11 0.90 -1.54 -0.10 0.00 0.00 175.22 175.37 3ggw s SER 10 N -1.90 6.44 0.41 1.36 1.04 -0.44 -4.84 113.70 115.78 3ggw s SER 10 Ca 0.02 1.30 -0.26 0.00 0.48 0.00 0.00 55.95 57.49 3ggw s SER 10 Cb -0.09 -2.40 -0.09 0.00 0.10 0.00 0.00 66.02 63.54 3ggw s SER 10 CO 0.03 -0.60 1.34 0.20 0.98 0.00 0.00 173.24 175.19 3ggw s ASN 11 N -3.54 6.21 0.15 7.02 0.01 -1.26 -4.64 114.94 118.89 3ggw s ASN 11 Ca 0.54 2.74 -0.34 0.00 -0.71 0.00 0.00 52.86 55.08 3ggw s ASN 11 Cb -0.10 -2.64 -0.15 0.00 0.41 0.00 0.00 41.25 38.76 3ggw s ASN 11 CO 0.39 -0.93 1.42 -2.65 -1.51 0.00 0.00 177.10 173.82 3ggw n PRO 12 N 0.07 1.68 -4.23 -0.60 -0.02 -1.26 -4.63 135.00 126.01 3ggw n PRO 12 Ca 0.04 0.61 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 3ggw n PRO 12 Cb 0.43 -2.28 -0.13 0.00 -0.02 0.00 0.00 33.50 31.50 3ggw n PRO 12 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ggw s VAL 13 N 0.46 3.83 0.26 -1.45 1.01 -0.32 -4.67 120.40 119.53 3ggw s VAL 13 Ca 0.78 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.10 3ggw s VAL 13 Cb -0.78 -2.70 -0.10 0.00 0.00 0.00 0.00 36.38 32.79 3ggw s VAL 13 CO 0.45 0.46 1.35 -0.89 0.00 0.00 0.00 175.10 176.46 3ggw s THR 14 N 0.74 2.85 0.37 3.92 2.01 -1.26 -0.57 115.64 123.71 3ggw s THR 14 Ca -0.01 0.76 -0.27 0.00 0.31 0.00 0.00 61.69 62.48 3ggw s THR 14 Cb -0.14 -3.48 -0.11 0.00 0.01 0.00 0.00 72.50 68.77 3ggw s THR 14 CO 0.02 0.14 1.32 0.18 -0.69 0.00 0.00 174.62 175.59 3ggw n LEU 15 N 1.87 3.91 0.00 4.42 4.77 -1.26 -2.16 117.00 128.55 3ggw n LEU 15 Ca 0.04 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.21 3ggw n LEU 15 Cb 0.42 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 3ggw n LEU 15 CO 0.59 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 3ggw n GLY 16 N 0.72 2.45 4.02 -0.72 0.00 0.44 -4.91 105.19 107.19 3ggw n GLY 16 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 3ggw n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ggw s THR 17 N -2.88 2.13 -0.11 2.61 -4.23 -0.92 -3.89 115.64 108.35 3ggw s THR 17 Ca 0.00 -0.82 -0.13 0.00 -1.18 0.00 0.00 61.69 59.56 3ggw s THR 17 Cb 0.00 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.48 3ggw s THR 17 CO 0.00 0.00 0.29 -0.44 -0.54 0.00 0.00 174.62 173.93 3ggw s SER 18 N -4.71 6.52 0.03 3.99 0.01 -1.26 -1.43 113.70 116.85 3ggw s SER 18 Ca 0.64 0.61 -0.01 0.00 1.31 0.00 0.00 55.95 58.51 3ggw s SER 18 Cb -0.05 -2.18 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 3ggw s SER 18 CO 0.41 0.22 0.17 0.00 0.41 0.00 0.00 173.24 174.46 3ggw s ALA 19 N -0.22 3.90 -0.03 1.44 0.00 0.61 -4.93 121.76 122.53 3ggw s ALA 19 Ca 0.18 -0.84 0.05 0.00 0.00 0.00 0.00 51.96 51.35 3ggw s ALA 19 Cb -0.14 -1.77 -0.01 0.00 0.00 0.00 0.00 23.12 21.20 3ggw s ALA 19 CO 0.06 0.78 -0.18 -1.54 0.00 0.00 0.00 175.76 174.88 3ggw s SER 20 N -2.24 2.19 -0.11 0.00 1.04 -1.26 -0.53 113.70 112.78 3ggw s SER 20 Ca 0.31 -0.35 0.02 0.00 0.48 0.00 0.00 55.95 56.41 3ggw s SER 20 Cb -0.13 -0.38 0.01 0.00 0.10 0.00 0.00 66.02 65.62 3ggw s SER 20 CO 0.23 0.20 -0.16 -0.63 0.98 0.00 0.00 173.24 173.86 3ggw s ILE 21 N -0.26 1.60 0.02 -1.02 1.01 0.25 -4.96 121.20 117.85 3ggw s ILE 21 Ca 0.03 -0.70 -0.05 0.00 0.00 0.00 0.00 60.65 59.93 3ggw s ILE 21 Cb -0.09 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.88 3ggw s ILE 21 CO 0.00 0.46 0.25 -0.44 0.00 0.00 0.00 174.94 175.22 3ggw s SER 22 N 0.96 6.45 -0.02 3.58 0.01 -1.26 -0.37 113.70 123.05 3ggw s SER 22 Ca -0.07 0.48 -0.03 0.00 1.31 0.00 0.00 55.95 57.64 3ggw s SER 22 Cb -0.15 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.03 3ggw s SER 22 CO -0.02 0.22 0.07 0.00 0.41 0.00 0.00 173.24 173.92 3ggw s ARG 24 N -0.28 1.29 0.09 0.00 0.52 -0.42 -0.39 118.95 119.76 3ggw s ARG 24 Ca -0.03 -0.89 0.07 0.00 -0.52 0.00 0.00 55.73 54.36 3ggw s ARG 24 Cb -0.02 -1.38 -0.04 0.00 0.52 0.00 0.00 34.95 34.03 3ggw s ARG 24 CO 0.00 0.35 -0.11 -1.54 0.02 0.00 0.00 175.30 174.02 3ggw s SER 25 N -1.14 4.31 0.50 0.23 1.04 -0.01 -0.08 113.70 118.55 3ggw s SER 25 Ca 0.06 -0.38 0.31 0.00 0.48 0.00 0.00 55.95 56.42 3ggw s SER 25 Cb -0.09 -0.81 1.22 0.00 0.10 0.00 0.00 66.02 66.44 3ggw s SER 25 CO 0.02 0.19 1.91 0.77 0.98 0.00 0.00 173.24 177.11 3ggw h SER 26 N 3.79 0.00 -4.31 7.02 4.64 -1.57 -3.44 113.55 119.68 3ggw h SER 26 Ca -0.49 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.45 3ggw h SER 26 Cb 1.17 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 63.00 3ggw h SER 26 CO 0.51 0.00 -0.77 -0.75 -0.87 0.00 0.00 176.83 174.95 3ggw s LYS 27 N -3.57 0.74 0.00 4.77 2.20 -1.26 -4.98 119.74 117.64 3ggw s LYS 27 Ca 0.02 -0.61 0.00 0.00 -0.36 0.00 0.00 55.97 55.03 3ggw s LYS 27 Cb 0.09 -0.69 0.00 0.00 -1.51 0.00 0.00 37.83 35.72 3ggw s LYS 27 CO 0.54 0.17 0.00 0.45 -0.36 0.00 0.00 175.35 176.15 3ggw n SER 27 N 2.11 -1.62 -1.85 1.43 2.88 -1.26 -4.72 113.62 110.59 3ggw n SER 27 Ca -0.18 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.29 3ggw n SER 27 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 3ggw n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3ggw n LEU 27 N 0.00 -4.90 -4.92 2.46 7.94 -1.26 -4.99 117.00 111.32 3ggw n LEU 27 Ca 0.00 2.79 -0.21 0.00 -1.11 0.00 0.00 56.01 57.48 3ggw n LEU 27 Cb 0.00 -2.85 -0.01 0.00 0.53 0.00 0.00 43.42 41.09 3ggw n LEU 27 CO 0.00 -0.63 0.07 -2.28 -1.11 0.00 0.00 177.39 173.45 3ggw s HIS 27 N -1.60 2.36 -0.41 1.96 5.65 0.24 -4.97 115.29 118.52 3ggw s HIS 27 Ca 0.00 -0.57 0.26 0.00 0.25 0.00 0.00 55.06 54.99 3ggw s HIS 27 Cb 0.00 -2.16 1.01 0.00 -1.18 0.00 0.00 32.58 30.26 3ggw s HIS 27 CO 0.00 -0.36 1.76 0.66 -0.65 0.00 0.00 174.74 176.16 3ggw h SER 27 N 0.82 0.00 0.27 9.88 4.64 -2.04 -1.94 113.55 125.18 3ggw h SER 27 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3ggw h SER 27 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3ggw h SER 27 CO 0.54 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.60 3ggw n ASP 28 N -2.40 0.00 0.00 4.97 5.68 -1.26 -4.90 116.55 118.64 3ggw n ASP 28 Ca 0.02 -0.56 0.00 0.00 -0.50 0.00 0.00 54.79 53.76 3ggw n ASP 28 Cb 0.27 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 3ggw n ASP 28 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ggw n GLY 29 N 1.06 0.89 3.81 6.12 0.00 -0.73 -5.04 105.19 111.30 3ggw n GLY 29 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3ggw n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ggw s ILE 30 N -2.62 4.99 -0.33 -0.61 1.01 -1.26 -4.85 121.20 117.52 3ggw s ILE 30 Ca 0.00 0.96 -0.12 0.00 0.00 0.00 0.00 60.65 61.49 3ggw s ILE 30 Cb 0.00 -3.78 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 3ggw s ILE 30 CO 0.00 0.52 0.21 -0.89 0.00 0.00 0.00 174.94 174.78 3ggw s THR 31 N -0.74 4.98 -1.29 2.92 2.01 -1.26 -0.59 115.64 121.67 3ggw s THR 31 Ca 0.25 -0.34 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 3ggw s THR 31 Cb -0.17 -3.57 0.15 0.00 0.01 0.00 0.00 72.50 68.93 3ggw s THR 31 CO 0.14 -0.00 2.11 -1.22 -0.69 0.00 0.00 174.62 174.96 3ggw n TYR 32 N 5.05 2.72 -4.94 4.92 4.02 -1.26 -2.64 117.16 125.03 3ggw n TYR 32 Ca -0.13 -2.79 -0.33 0.00 -0.01 0.00 0.00 57.90 54.65 3ggw n TYR 32 Cb 0.49 -1.84 -0.15 0.00 -0.02 0.00 0.00 39.34 37.83 3ggw n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 3ggw s LEU 33 N -1.35 2.52 0.04 7.72 1.98 -1.26 -1.94 118.68 126.39 3ggw s LEU 33 Ca 0.46 -0.37 0.05 0.00 -2.89 0.00 0.00 54.13 51.38 3ggw s LEU 33 Cb 0.14 -1.54 -0.02 0.00 0.66 0.00 0.00 46.19 45.43 3ggw s LEU 33 CO -0.04 0.20 -0.16 -0.31 -1.89 0.00 0.00 176.35 174.15 3ggw s TYR 34 N 0.12 1.37 -0.07 5.38 1.51 -0.24 0.76 117.35 126.18 3ggw s TYR 34 Ca -0.08 -0.35 0.03 0.00 -1.01 0.00 0.00 57.07 55.66 3ggw s TYR 34 Cb -0.15 -0.81 -0.02 0.00 -0.11 0.00 0.00 41.96 40.87 3ggw s TYR 34 CO 0.05 0.05 -0.17 -1.58 -1.11 0.00 0.00 175.55 172.79 3ggw s TRP 35 N -0.83 2.65 0.13 2.71 0.52 -0.22 -0.94 118.94 122.96 3ggw s TRP 35 Ca 0.03 -0.44 0.08 0.00 0.02 0.00 0.00 56.10 55.79 3ggw s TRP 35 Cb -0.08 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.53 3ggw s TRP 35 CO 0.01 -0.03 -0.19 0.71 0.02 0.00 0.00 176.95 177.47 3ggw s TYR 36 N -0.29 1.76 -0.06 -1.98 1.51 0.10 0.05 117.35 118.45 3ggw s TYR 36 Ca 0.02 -0.45 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 3ggw s TYR 36 Cb -0.13 -0.93 -0.00 0.00 -0.11 0.00 0.00 41.96 40.79 3ggw s TYR 36 CO 0.03 0.25 -0.20 -1.17 -1.11 0.00 0.00 175.55 173.34 3ggw s LEU 37 N -2.24 1.97 -0.25 -1.29 2.96 -0.32 0.28 118.68 119.79 3ggw s LEU 37 Ca 0.10 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.61 3ggw s LEU 37 Cb -0.08 -1.14 0.06 0.00 0.50 0.00 0.00 46.19 45.52 3ggw s LEU 37 CO 0.05 0.18 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.56 3ggw s GLN 38 N 0.04 2.32 0.51 1.98 0.74 0.05 -0.90 119.66 124.40 3ggw s GLN 38 Ca -0.06 -1.30 -0.16 0.00 0.05 0.00 0.00 55.36 53.89 3ggw s GLN 38 Cb -0.13 -2.86 -0.08 0.00 1.10 0.00 0.00 33.01 31.04 3ggw s GLN 38 CO 0.03 -0.53 0.97 0.15 -0.55 0.00 0.00 175.29 175.36 3ggw s LYS 39 N 1.12 3.92 -0.08 1.67 1.02 -1.26 -1.43 119.74 124.70 3ggw s LYS 39 Ca -0.08 0.91 -0.37 0.00 0.02 0.00 0.00 55.97 56.46 3ggw s LYS 39 Cb -0.19 -2.16 -0.14 0.00 -0.52 0.00 0.00 37.83 34.82 3ggw s LYS 39 CO -0.06 -0.26 1.70 -2.30 -0.92 0.00 0.00 175.35 173.51 3ggw n PRO 40 N -1.59 1.66 -0.97 -1.68 -0.02 -1.26 -1.47 135.00 129.67 3ggw n PRO 40 Ca 0.06 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3ggw n PRO 40 Cb 0.54 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 3ggw n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ggw n GLY 41 N 3.86 0.39 3.74 -1.23 0.00 -1.26 -5.01 105.19 105.67 3ggw n GLY 41 Ca 0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 3ggw n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ggw s GLN 42 N -0.60 2.40 0.45 1.61 -0.21 -0.54 -5.11 119.66 117.66 3ggw s GLN 42 Ca 0.00 -1.53 -0.23 0.00 0.02 0.00 0.00 55.36 53.62 3ggw s GLN 42 Cb 0.00 -2.19 -0.08 0.00 1.00 0.00 0.00 33.01 31.73 3ggw s GLN 42 CO 0.00 0.10 1.09 -1.54 -2.12 0.00 0.00 175.29 172.82 3ggw s SER 43 N -3.86 6.42 0.63 5.90 1.04 -1.26 -4.66 113.70 117.90 3ggw s SER 43 Ca 0.38 2.11 -0.18 0.00 0.48 0.00 0.00 55.95 58.73 3ggw s SER 43 Cb -0.03 -2.59 -0.03 0.00 0.10 0.00 0.00 66.02 63.48 3ggw s SER 43 CO 0.23 -0.74 1.18 -2.65 0.98 0.00 0.00 173.24 172.24 3ggw n PRO 44 N -0.47 1.06 -3.93 4.02 -0.02 -1.26 -4.63 135.00 129.76 3ggw n PRO 44 Ca 0.07 0.41 -0.10 0.00 -2.02 0.00 0.00 63.50 61.87 3ggw n PRO 44 Cb 0.50 -2.40 -0.10 0.00 -0.02 0.00 0.00 33.50 31.48 3ggw n PRO 44 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3ggw s HIS 45 N -1.43 0.19 0.11 6.00 -3.43 -0.08 -4.95 115.29 111.70 3ggw s HIS 45 Ca 0.80 -0.43 -0.30 0.00 -0.80 0.00 0.00 55.06 54.32 3ggw s HIS 45 Cb -0.39 -0.14 -0.07 0.00 -1.43 0.00 0.00 32.58 30.55 3ggw s HIS 45 CO 0.43 -0.30 1.19 -1.17 -2.00 0.00 0.00 174.74 172.90 3ggw s LEU 46 N -1.77 4.41 -0.23 5.38 2.96 -1.26 -1.17 118.68 127.00 3ggw s LEU 46 Ca -0.10 2.09 -0.11 0.00 -0.22 0.00 0.00 54.13 55.80 3ggw s LEU 46 Cb -0.05 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.95 3ggw s LEU 46 CO -0.02 -0.42 -0.29 0.18 -1.32 0.00 0.00 176.35 174.49 3ggw n LEU 47 N 3.34 1.68 -3.86 -0.68 4.77 0.11 -4.78 117.00 117.58 3ggw n LEU 47 Ca 0.07 0.25 -0.14 0.00 -0.03 0.00 0.00 56.01 56.16 3ggw n LEU 47 Cb 0.46 -0.67 -0.15 0.00 -2.33 0.00 0.00 43.42 40.73 3ggw n LEU 47 CO 0.55 0.49 -0.37 -0.63 -1.33 0.00 0.00 177.39 176.11 3ggw s ILE 48 N -2.41 0.08 0.17 -0.08 -1.09 -1.05 -1.13 121.20 115.69 3ggw s ILE 48 Ca -0.32 0.02 0.09 0.00 -2.23 0.00 0.00 60.65 58.22 3ggw s ILE 48 Cb 0.12 -0.12 -0.04 0.00 -1.58 0.00 0.00 42.46 40.84 3ggw s ILE 48 CO 0.40 0.06 -0.20 -0.72 -1.23 0.00 0.00 174.94 173.25 3ggw s TYR 49 N 0.34 1.96 -1.35 3.97 1.13 0.27 -1.05 117.35 122.61 3ggw s TYR 49 Ca -0.03 -0.43 -0.04 0.00 -1.41 0.00 0.00 57.07 55.16 3ggw s TYR 49 Cb -0.05 -0.98 0.02 0.00 -1.10 0.00 0.00 41.96 39.85 3ggw s TYR 49 CO -0.01 0.36 0.88 0.72 -2.51 0.00 0.00 175.55 175.00 3ggw n HIS 50 N 0.38 -2.18 0.00 -3.49 8.25 -0.85 -1.13 115.22 116.20 3ggw n HIS 50 Ca -0.14 0.90 0.00 0.00 -0.26 0.00 0.00 57.72 58.22 3ggw n HIS 50 Cb 0.56 -4.49 0.00 0.00 1.12 0.00 0.00 29.99 27.18 3ggw n HIS 50 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3ggw n LEU 51 N -4.44 0.00 0.00 2.41 7.94 0.23 -4.16 117.00 118.98 3ggw n LEU 51 Ca -0.18 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 3ggw n LEU 51 Cb 0.63 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.58 3ggw n LEU 51 CO 0.68 0.00 0.15 -1.54 -1.11 0.00 0.00 177.39 175.58 3ggw n SER 52 N 1.89 0.26 -4.73 1.96 3.41 -1.21 -4.13 113.62 111.07 3ggw n SER 52 Ca 0.00 -1.08 -0.36 0.00 -0.26 0.00 0.00 58.87 57.17 3ggw n SER 52 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 3ggw n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3ggw s ASN 53 N -0.08 6.39 0.09 4.04 0.01 -0.29 -4.63 114.94 120.47 3ggw s ASN 53 Ca 0.00 0.46 -0.30 0.00 -0.71 0.00 0.00 52.86 52.30 3ggw s ASN 53 Cb 0.00 -2.16 -0.06 0.00 0.41 0.00 0.00 41.25 39.44 3ggw s ASN 53 CO 0.00 0.12 1.18 -0.22 -1.51 0.00 0.00 177.10 176.67 3ggw s LEU 54 N 0.41 4.40 0.66 0.60 2.96 -1.26 -0.57 118.68 125.88 3ggw s LEU 54 Ca 0.15 2.04 -0.10 0.00 -0.22 0.00 0.00 54.13 56.00 3ggw s LEU 54 Cb -0.13 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.99 3ggw s LEU 54 CO 0.03 -0.42 1.04 0.00 -1.32 0.00 0.00 176.35 175.68 3ggw s ALA 55 N 0.76 3.02 0.34 5.97 0.00 -0.28 -4.88 121.76 126.69 3ggw s ALA 55 Ca 0.57 -0.41 -0.28 0.00 0.00 0.00 0.00 51.96 51.84 3ggw s ALA 55 Cb -0.29 -2.92 -0.12 0.00 0.00 0.00 0.00 23.12 19.78 3ggw s ALA 55 CO 0.31 -0.99 1.32 0.43 0.00 0.00 0.00 175.76 176.82 3ggw n SER 56 N -2.86 2.88 0.00 0.00 7.64 -1.26 -2.59 113.62 117.43 3ggw n SER 56 Ca 0.06 1.21 0.00 0.00 1.01 0.00 0.00 58.87 61.15 3ggw n SER 56 Cb 0.57 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 3ggw n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ggw n GLY 57 N 0.80 0.53 3.40 0.23 0.00 -1.26 -4.98 105.19 103.91 3ggw n GLY 57 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3ggw n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ggw s VAL 58 N -2.28 3.49 0.54 1.61 1.01 -1.07 -5.10 120.40 118.60 3ggw s VAL 58 Ca 0.00 -0.49 -0.18 0.00 0.00 0.00 0.00 61.98 61.31 3ggw s VAL 58 Cb 0.00 -2.53 -0.06 0.00 0.00 0.00 0.00 36.38 33.79 3ggw s VAL 58 CO 0.00 0.48 1.06 -2.16 0.00 0.00 0.00 175.10 174.48 3ggw s PRO 59 N 0.73 3.51 0.00 2.72 0.04 -1.26 -4.81 135.00 135.92 3ggw s PRO 59 Ca -0.03 1.35 0.10 0.00 0.04 0.00 0.00 61.00 62.46 3ggw s PRO 59 Cb -0.15 -2.05 0.60 0.00 0.04 0.00 0.00 34.50 32.94 3ggw s PRO 59 CO 0.02 -0.67 1.02 -0.40 0.04 0.00 0.00 177.00 177.01 3ggw n ASP 60 N -1.46 0.00 0.03 6.66 5.68 -1.26 -2.14 116.55 124.07 3ggw n ASP 60 Ca 0.10 -0.43 0.09 0.00 -0.50 0.00 0.00 54.79 54.05 3ggw n ASP 60 Cb 0.52 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 40.91 3ggw n ASP 60 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 3ggw n ARG 61 N -0.92 0.06 -3.31 0.11 1.85 -1.26 -4.60 116.66 108.58 3ggw n ARG 61 Ca 0.08 0.25 -0.38 0.00 -1.00 0.00 0.00 57.85 56.79 3ggw n ARG 61 Cb 0.03 -1.60 -0.06 0.00 -1.05 0.00 0.00 32.46 29.79 3ggw n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3ggw s PHE 62 N -3.08 3.58 0.16 2.89 0.40 -0.91 -1.27 117.98 119.76 3ggw s PHE 62 Ca 0.08 0.98 -0.09 0.00 -0.60 0.00 0.00 56.93 57.30 3ggw s PHE 62 Cb 0.11 -2.53 -0.01 0.00 0.51 0.00 0.00 43.02 41.10 3ggw s PHE 62 CO 0.35 0.28 0.27 -1.54 0.70 0.00 0.00 175.22 175.29 3ggw s SER 63 N 0.19 0.05 0.03 1.36 1.04 -0.68 -4.95 113.70 110.74 3ggw s SER 63 Ca 0.27 -0.88 -0.16 0.00 0.48 0.00 0.00 55.95 55.67 3ggw s SER 63 Cb -0.16 0.43 0.03 0.00 0.10 0.00 0.00 66.02 66.41 3ggw s SER 63 CO 0.12 -0.89 0.34 -0.55 0.98 0.00 0.00 173.24 173.25 3ggw s SER 64 N -2.97 -0.20 0.19 7.02 0.15 -1.26 -0.07 113.70 116.56 3ggw s SER 64 Ca 0.17 -0.05 -0.12 0.00 0.70 0.00 0.00 55.95 56.65 3ggw s SER 64 Cb 0.03 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 3ggw s SER 64 CO -0.00 -0.59 0.38 -0.94 1.20 0.00 0.00 173.24 173.29 3ggw s SER 65 N -1.84 -0.06 0.00 5.45 1.04 -0.76 -4.36 113.70 113.17 3ggw s SER 65 Ca -0.07 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.57 3ggw s SER 65 Cb -0.02 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3ggw s SER 65 CO -0.01 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 173.84 3ggw n GLY 66 N -0.28 0.88 0.00 7.32 0.00 -1.26 -0.46 105.19 111.39 3ggw n GLY 66 Ca -0.07 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.96 3ggw n GLY 66 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ggw n SER 67 N 0.00 0.00 0.20 1.61 3.41 -0.60 -4.97 113.62 113.27 3ggw n SER 67 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 3ggw n SER 67 Cb 0.00 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.21 3ggw n SER 67 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3ggw h GLY 68 N 0.00 0.00 0.00 5.00 0.00 -1.98 -3.39 103.07 102.70 3ggw h GLY 68 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ggw h GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 3ggw n THR 69 N -2.93 0.00 -3.69 4.70 -2.24 -1.26 -4.32 114.28 104.54 3ggw n THR 69 Ca 0.04 -0.27 -0.26 0.00 -2.27 0.00 0.00 64.05 61.29 3ggw n THR 69 Cb 0.49 1.09 -0.17 0.00 -2.10 0.00 0.00 70.33 69.64 3ggw n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ggw s ASP 70 N -0.44 2.42 0.02 3.42 -1.08 -1.26 -0.83 116.67 118.91 3ggw s ASP 70 Ca 0.00 -0.59 0.06 0.00 -0.52 0.00 0.00 52.55 51.50 3ggw s ASP 70 Cb 0.00 -0.42 -0.02 0.00 -1.46 0.00 0.00 42.92 41.02 3ggw s ASP 70 CO 0.00 -0.30 -0.19 -0.36 0.52 0.00 0.00 175.17 174.84 3ggw s PHE 71 N 1.99 1.67 -0.10 -5.34 0.08 0.48 -1.56 117.98 115.20 3ggw s PHE 71 Ca 0.01 -0.34 -0.00 0.00 0.12 0.00 0.00 56.93 56.72 3ggw s PHE 71 Cb -0.16 -1.03 0.02 0.00 -0.57 0.00 0.00 43.02 41.29 3ggw s PHE 71 CO -0.08 0.03 -0.06 0.99 -0.10 0.00 0.00 175.22 176.00 3ggw s THR 72 N -0.63 0.89 -0.07 0.64 2.01 0.40 -1.62 115.64 117.26 3ggw s THR 72 Ca 0.07 -0.22 -0.23 0.00 0.31 0.00 0.00 61.69 61.62 3ggw s THR 72 Cb -0.08 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.46 3ggw s THR 72 CO 0.01 0.34 0.67 -0.22 -0.69 0.00 0.00 174.62 174.73 3ggw s LEU 73 N 1.66 4.32 -0.14 4.42 2.96 0.50 -1.84 118.68 130.56 3ggw s LEU 73 Ca 0.03 1.14 0.00 0.00 -0.22 0.00 0.00 54.13 55.09 3ggw s LEU 73 Cb -0.13 -3.03 -0.01 0.00 0.50 0.00 0.00 46.19 43.53 3ggw s LEU 73 CO -0.07 -0.09 -0.14 -0.60 -1.32 0.00 0.00 176.35 174.13 3ggw s ARG 74 N 0.72 3.28 -0.37 1.98 3.52 0.90 -0.58 118.95 128.41 3ggw s ARG 74 Ca 0.36 -0.73 -0.04 0.00 -0.13 0.00 0.00 55.73 55.19 3ggw s ARG 74 Cb -0.17 -2.62 0.07 0.00 -1.56 0.00 0.00 34.95 30.67 3ggw s ARG 74 CO 0.17 0.10 0.14 0.42 -0.81 0.00 0.00 175.30 175.32 3ggw s ILE 75 N 0.61 3.46 0.44 4.11 1.01 0.31 -1.68 121.20 129.46 3ggw s ILE 75 Ca -0.08 -1.57 -0.11 0.00 0.00 0.00 0.00 60.65 58.88 3ggw s ILE 75 Cb -0.16 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.11 3ggw s ILE 75 CO 0.03 -0.39 0.81 -0.94 0.00 0.00 0.00 174.94 174.45 3ggw s SER 76 N 1.63 6.50 -1.23 3.58 1.04 -0.40 -0.28 113.70 124.54 3ggw s SER 76 Ca 0.02 1.19 -0.19 0.00 0.48 0.00 0.00 55.95 57.45 3ggw s SER 76 Cb -0.21 -2.35 0.01 0.00 0.10 0.00 0.00 66.02 63.56 3ggw s SER 76 CO -0.01 -0.46 0.65 0.54 0.98 0.00 0.00 173.24 174.94 3ggw n ARG 77 N -1.47 -1.39 -1.71 4.02 1.74 -1.18 -4.84 116.66 111.83 3ggw n ARG 77 Ca 0.03 0.33 -0.43 0.00 -0.77 0.00 0.00 57.85 57.01 3ggw n ARG 77 Cb 0.54 -3.77 -0.01 0.00 -1.02 0.00 0.00 32.46 28.20 3ggw n ARG 77 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3ggw n VAL 78 N -4.47 1.61 -4.37 1.55 0.31 -0.52 -4.60 118.33 107.84 3ggw n VAL 78 Ca -0.15 -0.40 -0.24 0.00 -0.01 0.00 0.00 64.34 63.54 3ggw n VAL 78 Cb 0.61 -1.68 -0.08 0.00 -0.91 0.00 0.00 33.84 31.77 3ggw n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3ggw s GLU 79 N -1.37 2.03 0.28 5.55 2.02 -1.26 -0.42 118.70 125.53 3ggw s GLU 79 Ca 0.59 -1.59 -0.00 0.00 0.02 0.00 0.00 54.97 53.99 3ggw s GLU 79 Cb -0.56 -1.98 0.49 0.00 0.10 0.00 0.00 34.13 32.18 3ggw s GLU 79 CO 0.57 0.33 1.86 0.00 0.02 0.00 0.00 175.26 178.04 3ggw h ALA 80 N 2.03 1.47 0.00 5.21 0.00 -1.92 -1.45 119.26 124.60 3ggw h ALA 80 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3ggw h ALA 80 Cb 1.25 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3ggw h ALA 80 CO 0.61 0.33 0.00 -1.91 0.00 0.00 0.00 179.25 178.28 3ggw n GLU 81 N -4.56 0.24 0.00 0.00 4.07 -1.16 -2.77 120.64 116.47 3ggw n GLU 81 Ca 0.17 0.12 0.15 0.00 -0.06 0.00 0.00 57.16 57.54 3ggw n GLU 81 Cb 0.28 -1.50 0.73 0.00 -0.06 0.00 0.00 31.44 30.89 3ggw n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3ggw n ASP 82 N -1.21 0.37 -4.77 4.31 8.00 -0.55 -4.86 116.55 117.85 3ggw n ASP 82 Ca 0.07 -0.76 -0.41 0.00 0.71 0.00 0.00 54.79 54.40 3ggw n ASP 82 Cb 0.09 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 3ggw n ASP 82 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3ggw s VAL 83 N -2.28 2.10 -5.00 2.53 -7.23 -1.11 -4.83 120.40 104.58 3ggw s VAL 83 Ca 0.36 0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.62 3ggw s VAL 83 Cb 0.21 -3.06 0.00 0.00 0.56 0.00 0.00 36.38 34.09 3ggw s VAL 83 CO 0.42 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 3ggw n GLY 84 N 0.52 -1.50 3.33 2.32 0.00 -1.26 -4.70 105.19 103.90 3ggw n GLY 84 Ca 0.02 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 3ggw n GLY 84 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ggw s ILE 85 N -2.70 3.16 -0.23 -0.61 1.01 -0.52 -1.21 121.20 120.10 3ggw s ILE 85 Ca 0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 59.98 3ggw s ILE 85 Cb 0.00 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 3ggw s ILE 85 CO 0.00 0.48 0.07 -0.31 0.00 0.00 0.00 174.94 175.18 3ggw s TYR 86 N 0.94 3.13 -0.05 3.97 1.51 -0.63 -0.77 117.35 125.44 3ggw s TYR 86 Ca -0.02 -0.25 0.05 0.00 -1.01 0.00 0.00 57.07 55.84 3ggw s TYR 86 Cb -0.15 -2.19 -0.02 0.00 -0.11 0.00 0.00 41.96 39.49 3ggw s TYR 86 CO -0.00 -0.19 -0.18 0.71 -1.11 0.00 0.00 175.55 174.77 3ggw s TYR 87 N 1.22 2.59 0.24 2.71 2.02 0.14 -1.49 117.35 124.78 3ggw s TYR 87 Ca 0.05 -0.37 -0.02 0.00 -0.37 0.00 0.00 57.07 56.36 3ggw s TYR 87 Cb -0.14 -1.62 -0.05 0.00 -0.40 0.00 0.00 41.96 39.75 3ggw s TYR 87 CO 0.03 0.03 0.46 0.00 -1.57 0.00 0.00 175.55 174.50 3ggw s ALA 89 N -1.96 -0.91 0.36 0.00 0.00 -0.12 -1.10 121.76 118.04 3ggw s ALA 89 Ca 0.41 0.77 0.03 0.00 0.00 0.00 0.00 51.96 53.16 3ggw s ALA 89 Cb -0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 3ggw s ALA 89 CO 0.29 -0.22 0.54 -3.38 0.00 0.00 0.00 175.76 172.99 3ggw s HIS 90 N -0.49 3.32 -0.37 0.00 -3.43 -1.21 -1.07 115.29 112.04 3ggw s HIS 90 Ca -0.06 0.12 0.13 0.00 -0.80 0.00 0.00 55.06 54.45 3ggw s HIS 90 Cb -0.04 -1.99 0.38 0.00 -1.43 0.00 0.00 32.58 29.50 3ggw s HIS 90 CO 0.02 -0.00 0.81 -1.71 -2.00 0.00 0.00 174.74 171.86 3ggw n ASN 91 N -1.78 1.30 0.00 7.38 4.05 -0.82 -4.69 115.26 120.70 3ggw n ASN 91 Ca -0.03 -2.99 0.00 0.00 0.45 0.00 0.00 54.58 52.01 3ggw n ASN 91 Cb 0.57 -0.59 0.00 0.00 1.23 0.00 0.00 39.78 40.99 3ggw n ASN 91 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 3ggw n VAL 92 N 0.14 0.00 -3.79 3.44 0.24 -1.26 -4.91 118.33 112.19 3ggw n VAL 92 Ca 0.22 -0.41 -0.03 0.00 -2.04 0.00 0.00 64.34 62.08 3ggw n VAL 92 Cb 0.68 1.03 -0.00 0.00 -1.47 0.00 0.00 33.84 34.08 3ggw n VAL 92 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 3ggw s GLU 93 N -0.68 1.16 -0.05 7.34 -1.05 -1.26 -5.14 118.70 119.02 3ggw s GLU 93 Ca 0.00 -0.68 -0.03 0.00 -0.15 0.00 0.00 54.97 54.11 3ggw s GLU 93 Cb 0.00 0.37 -0.04 0.00 -0.44 0.00 0.00 34.13 34.02 3ggw s GLU 93 CO 0.00 -0.54 0.10 -0.51 0.95 0.00 0.00 175.26 175.26 3ggw s LEU 94 N -3.12 4.04 0.56 1.83 1.43 -1.26 -3.95 118.68 118.21 3ggw s LEU 94 Ca 0.16 0.26 -0.16 0.00 -1.03 0.00 0.00 54.13 53.36 3ggw s LEU 94 Cb -0.01 -2.19 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 3ggw s LEU 94 CO 0.03 0.33 1.03 -2.16 0.23 0.00 0.00 176.35 175.81 3ggw s PRO 95 N -1.42 3.56 0.13 1.29 0.04 -1.26 -5.02 135.00 132.32 3ggw s PRO 95 Ca 0.20 1.11 -0.30 0.00 0.04 0.00 0.00 61.00 62.04 3ggw s PRO 95 Cb -0.12 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.28 3ggw s PRO 95 CO 0.10 -0.61 1.21 1.03 0.04 0.00 0.00 177.00 178.77 3ggw s ARG 96 N -4.08 4.46 0.15 4.56 0.52 -1.25 -4.78 118.95 118.53 3ggw s ARG 96 Ca 0.62 1.84 0.05 0.00 -0.52 0.00 0.00 55.73 57.71 3ggw s ARG 96 Cb -0.14 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 32.00 3ggw s ARG 96 CO 0.35 -0.17 -0.10 0.95 0.02 0.00 0.00 175.30 176.35 3ggw s THR 97 N 0.47 1.20 0.11 0.02 -4.23 -1.26 -5.09 115.64 106.85 3ggw s THR 97 Ca 0.56 -2.07 0.05 0.00 -1.18 0.00 0.00 61.69 59.05 3ggw s THR 97 Cb -0.31 -1.87 -0.04 0.00 1.34 0.00 0.00 72.50 71.62 3ggw s THR 97 CO 0.33 -0.73 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.19 3ggw s PHE 98 N -3.31 1.28 0.87 3.99 0.40 -1.26 -3.31 117.98 116.63 3ggw s PHE 98 Ca 0.17 -0.57 -0.13 0.00 -0.60 0.00 0.00 56.93 55.80 3ggw s PHE 98 Cb 0.02 -0.68 0.13 0.00 0.51 0.00 0.00 43.02 43.00 3ggw s PHE 98 CO 0.01 0.09 1.23 0.20 0.70 0.00 0.00 175.22 177.45 3ggw s GLY 99 N -2.36 1.68 0.00 4.36 0.00 -0.25 -4.47 107.32 106.28 3ggw s GLY 99 Ca 0.06 -0.93 0.27 0.00 0.00 0.00 0.00 44.72 44.13 3ggw s GLY 99 CO 0.02 -0.32 1.73 0.61 0.00 0.00 0.00 173.10 175.14 3ggw n GLY 100 N -3.47 -1.38 0.00 0.20 0.00 -1.26 -4.74 105.19 94.53 3ggw n GLY 100 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3ggw n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ggw n GLY 101 N 1.49 -0.41 3.28 -0.02 0.00 -1.26 -5.00 105.19 103.27 3ggw n GLY 101 Ca 0.07 -1.34 -0.34 0.00 0.00 0.00 0.00 46.02 44.41 3ggw n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ggw s THR 102 N -1.29 2.94 -0.10 2.61 2.01 -0.56 -4.12 115.64 117.14 3ggw s THR 102 Ca 0.00 -0.66 -0.28 0.00 0.31 0.00 0.00 61.69 61.06 3ggw s THR 102 Cb 0.00 -2.28 -0.02 0.00 0.01 0.00 0.00 72.50 70.21 3ggw s THR 102 CO 0.00 0.49 0.92 -0.75 -0.69 0.00 0.00 174.62 174.58 3ggw s LYS 103 N 1.04 4.42 -0.11 4.92 2.20 0.18 -1.60 119.74 130.79 3ggw s LYS 103 Ca -0.00 1.24 -0.26 0.00 -0.36 0.00 0.00 55.97 56.58 3ggw s LYS 103 Cb -0.15 -3.52 -0.02 0.00 -1.51 0.00 0.00 37.83 32.63 3ggw s LYS 103 CO -0.02 -0.23 0.85 -1.17 -0.36 0.00 0.00 175.35 174.42 3ggw s LEU 104 N 1.73 4.24 -0.11 5.43 2.96 -0.35 -1.32 118.68 131.27 3ggw s LEU 104 Ca 0.45 1.30 -0.01 0.00 -0.22 0.00 0.00 54.13 55.65 3ggw s LEU 104 Cb -0.18 -3.30 -0.03 0.00 0.50 0.00 0.00 46.19 43.18 3ggw s LEU 104 CO 0.18 -0.33 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.13 3ggw s GLU 105 N 1.67 3.17 0.00 1.98 2.12 -1.26 -4.08 118.70 122.30 3ggw s GLU 105 Ca 0.42 -0.54 -0.16 0.00 0.36 0.00 0.00 54.97 55.05 3ggw s GLU 105 Cb -0.18 -2.73 -0.06 0.00 0.26 0.00 0.00 34.13 31.42 3ggw s GLU 105 CO 0.17 0.47 0.44 0.42 -0.54 0.00 0.00 175.26 176.22 3ggw s ILE 106 N -0.29 4.99 -0.00 -3.70 -1.09 -1.26 -1.17 121.20 118.68 3ggw s ILE 106 Ca 0.04 0.91 -0.22 0.00 -2.23 0.00 0.00 60.65 59.15 3ggw s ILE 106 Cb -0.13 -3.75 -0.05 0.00 -1.58 0.00 0.00 42.46 36.95 3ggw s ILE 106 CO 0.02 0.56 0.65 -0.75 -1.23 0.00 0.00 174.94 174.19 3ggw s LYS 107 N -0.95 4.39 0.31 2.79 2.20 0.27 -4.69 119.74 124.05 3ggw s LYS 107 Ca 0.25 0.84 0.02 0.00 -0.36 0.00 0.00 55.97 56.71 3ggw s LYS 107 Cb -0.17 -3.37 -0.02 0.00 -1.51 0.00 0.00 37.83 32.76 3ggw s LYS 107 CO 0.14 0.30 0.33 -0.98 -0.36 0.00 0.00 175.35 174.78 3ggw s ARG 108 N 0.01 1.71 0.49 4.03 1.70 -1.26 -4.25 118.95 121.38 3ggw s ARG 108 Ca 0.34 -1.83 -0.22 0.00 -0.47 0.00 0.00 55.73 53.54 3ggw s ARG 108 Cb -0.19 0.36 -0.06 0.00 -0.57 0.00 0.00 34.95 34.49 3ggw s ARG 108 CO 0.19 -0.65 1.21 0.00 -1.08 0.00 0.00 175.30 174.96 3ggw s ALA 109 N -3.46 2.90 0.50 7.88 0.00 -1.26 -4.95 121.76 123.36 3ggw s ALA 109 Ca 0.36 1.02 -0.23 0.00 0.00 0.00 0.00 51.96 53.11 3ggw s ALA 109 Cb 0.02 -3.43 -0.07 0.00 0.00 0.00 0.00 23.12 19.65 3ggw s ALA 109 CO 0.22 -0.85 1.35 -0.25 0.00 0.00 0.00 175.76 176.23 3ggw n ASP 110 N -0.72 2.80 -3.75 0.00 8.00 -1.26 -4.77 116.55 116.84 3ggw n ASP 110 Ca 0.09 1.04 -0.15 0.00 0.71 0.00 0.00 54.79 56.47 3ggw n ASP 110 Cb 0.48 -1.57 -0.16 0.00 -0.02 0.00 0.00 41.12 39.85 3ggw n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ggw s ALA 111 N -1.25 -0.01 0.37 2.24 0.00 0.06 -4.90 121.76 118.26 3ggw s ALA 111 Ca 0.67 0.42 -0.26 0.00 0.00 0.00 0.00 51.96 52.78 3ggw s ALA 111 Cb -0.44 -0.38 -0.09 0.00 0.00 0.00 0.00 23.12 22.21 3ggw s ALA 111 CO 0.53 -0.19 1.10 0.00 0.00 0.00 0.00 175.76 177.20 3ggw s ALA 112 N 1.29 3.19 0.45 0.00 0.00 -1.26 -1.31 121.76 124.12 3ggw s ALA 112 Ca -0.07 0.83 -0.22 0.00 0.00 0.00 0.00 51.96 52.50 3ggw s ALA 112 Cb -0.12 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.60 3ggw s ALA 112 CO -0.04 -0.29 1.09 -1.25 0.00 0.00 0.00 175.76 175.27 3ggw s PRO 113 N -2.15 3.89 -0.33 0.00 0.04 -1.26 -4.51 135.00 130.67 3ggw s PRO 113 Ca 0.54 1.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.92 3ggw s PRO 113 Cb -0.27 -2.35 -0.00 0.00 0.04 0.00 0.00 34.50 31.92 3ggw s PRO 113 CO 0.34 -0.39 0.70 0.99 0.04 0.00 0.00 177.00 178.68 3ggw s THR 114 N -1.71 4.86 -0.17 1.26 2.01 -0.17 -4.83 115.64 116.89 3ggw s THR 114 Ca 0.63 0.89 -0.06 0.00 0.31 0.00 0.00 61.69 63.46 3ggw s THR 114 Cb -0.23 -4.09 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 3ggw s THR 114 CO 0.28 -0.25 0.04 -0.69 -0.69 0.00 0.00 174.62 173.30 3ggw s VAL 115 N 2.80 4.59 -0.04 3.82 1.01 -1.26 -1.06 120.40 130.26 3ggw s VAL 115 Ca 0.28 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.17 3ggw s VAL 115 Cb -0.14 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.20 3ggw s VAL 115 CO 0.13 0.48 -0.08 -0.44 0.00 0.00 0.00 175.10 175.19 3ggw s SER 116 N 0.24 1.23 0.09 3.32 0.01 -0.35 -4.99 113.70 113.26 3ggw s SER 116 Ca 0.02 -0.19 0.09 0.00 1.31 0.00 0.00 55.95 57.18 3ggw s SER 116 Cb -0.13 -0.44 -0.04 0.00 0.21 0.00 0.00 66.02 65.62 3ggw s SER 116 CO 0.01 0.03 -0.21 -0.51 0.41 0.00 0.00 173.24 172.97 3ggw s ILE 117 N 0.46 2.60 -0.02 1.44 2.07 -1.26 -0.97 121.20 125.52 3ggw s ILE 117 Ca -0.07 -1.48 0.00 0.00 -1.41 0.00 0.00 60.65 57.68 3ggw s ILE 117 Cb -0.11 -2.14 0.02 0.00 0.13 0.00 0.00 42.46 40.36 3ggw s ILE 117 CO 0.01 0.18 0.01 -0.36 -1.91 0.00 0.00 174.94 172.87 3ggw s PHE 118 N -1.03 0.14 0.75 3.50 0.40 0.48 -4.99 117.98 117.22 3ggw s PHE 118 Ca 0.15 0.06 -0.11 0.00 -0.60 0.00 0.00 56.93 56.43 3ggw s PHE 118 Cb -0.10 -0.27 0.05 0.00 0.51 0.00 0.00 43.02 43.21 3ggw s PHE 118 CO 0.07 -0.09 1.12 -1.25 0.70 0.00 0.00 175.22 175.77 3ggw s PRO 119 N 0.84 2.34 0.29 0.24 0.04 -1.26 -1.52 135.00 135.97 3ggw s PRO 119 Ca -0.08 0.17 -0.30 0.00 0.04 0.00 0.00 61.00 60.84 3ggw s PRO 119 Cb -0.11 -2.02 -0.13 0.00 0.04 0.00 0.00 34.50 32.28 3ggw s PRO 119 CO -0.02 -1.32 1.37 -2.30 0.04 0.00 0.00 177.00 174.77 3ggw n PRO 120 N -3.12 2.14 -2.05 0.56 -0.02 -1.11 -4.85 135.00 126.55 3ggw n PRO 120 Ca 0.07 0.76 -0.34 0.00 -2.02 0.00 0.00 63.50 61.97 3ggw n PRO 120 Cb 0.59 -2.39 0.02 0.00 -0.02 0.00 0.00 33.50 31.70 3ggw n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3ggw s SER 121 N 0.02 5.55 0.28 2.55 1.04 -1.26 -4.93 113.70 116.95 3ggw s SER 121 Ca 0.61 2.02 0.01 0.00 0.48 0.00 0.00 55.95 59.07 3ggw s SER 121 Cb -0.60 -2.56 0.54 0.00 0.10 0.00 0.00 66.02 63.51 3ggw s SER 121 CO 0.56 -1.33 1.85 0.77 0.98 0.00 0.00 173.24 176.07 3ggw h SER 122 N 0.64 0.94 -0.47 7.02 4.64 -2.00 -1.29 113.55 123.04 3ggw h SER 122 Ca -0.48 0.04 0.04 0.00 -0.47 0.00 0.00 61.79 60.92 3ggw h SER 122 Cb 1.24 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 63.14 3ggw h SER 122 CO 0.56 0.52 0.22 -0.33 -0.87 0.00 0.00 176.83 176.93 3ggw h GLU 123 N 1.02 0.42 -0.44 4.77 3.07 -2.01 -2.43 114.58 118.98 3ggw h GLU 123 Ca 0.48 -0.03 -0.14 0.00 -0.50 0.00 0.00 59.36 59.18 3ggw h GLU 123 Cb 0.43 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3ggw h GLU 123 CO -0.24 0.28 -0.27 0.37 -1.40 0.00 0.00 179.01 177.75 3ggw h GLN 124 N 0.44 0.96 -0.12 2.33 4.15 -1.74 -3.09 115.11 118.03 3ggw h GLN 124 Ca 0.21 -0.44 0.03 0.00 0.77 0.00 0.00 58.65 59.22 3ggw h GLN 124 Cb 0.14 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.81 3ggw h GLN 124 CO -0.16 1.11 0.10 -0.07 -1.93 0.00 0.00 178.83 177.88 3ggw h LEU 125 N 0.79 0.00 -1.61 -2.39 3.38 -0.76 0.67 115.31 115.40 3ggw h LEU 125 Ca 0.09 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.29 3ggw h LEU 125 Cb 0.85 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.54 3ggw h LEU 125 CO 0.08 0.00 0.63 0.74 0.09 0.00 0.00 178.44 179.98 3ggw h THR 126 N 0.00 0.61 0.00 0.22 2.02 -1.43 -0.73 112.91 113.59 3ggw h THR 126 Ca 0.06 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3ggw h THR 126 Cb 0.26 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 3ggw h THR 126 CO -0.00 0.05 0.00 -1.54 0.37 0.00 0.00 175.52 174.40 3ggw n SER 127 N -4.46 0.40 0.00 4.18 3.41 0.23 -4.88 113.62 112.50 3ggw n SER 127 Ca 0.21 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.40 3ggw n SER 127 Cb 0.82 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 3ggw n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ggw n GLY 128 N 0.33 0.66 3.58 5.00 0.00 -0.28 -5.04 105.19 109.44 3ggw n GLY 128 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 3ggw n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ggw s GLY 129 N -2.00 1.73 -0.05 -0.02 0.00 -1.26 -0.96 107.32 104.76 3ggw s GLY 129 Ca 0.00 -1.64 -0.02 0.00 0.00 0.00 0.00 44.72 43.06 3ggw s GLY 129 CO 0.00 -1.70 0.09 0.00 0.00 0.00 0.00 173.10 171.49 3ggw s ALA 130 N -2.15 -0.00 -0.07 3.20 0.00 0.08 -3.82 121.76 119.00 3ggw s ALA 130 Ca 0.29 0.41 0.05 0.00 0.00 0.00 0.00 51.96 52.71 3ggw s ALA 130 Cb -0.07 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 3ggw s ALA 130 CO 0.17 -0.30 -0.23 -1.12 0.00 0.00 0.00 175.76 174.28 3ggw s SER 131 N 1.59 3.20 -0.18 0.00 0.01 -1.26 -0.90 113.70 116.15 3ggw s SER 131 Ca -0.03 -0.49 -0.06 0.00 1.31 0.00 0.00 55.95 56.68 3ggw s SER 131 Cb -0.12 -1.04 -0.03 0.00 0.21 0.00 0.00 66.02 65.04 3ggw s SER 131 CO -0.04 0.22 0.02 -0.69 0.41 0.00 0.00 173.24 173.16 3ggw s VAL 132 N -0.04 4.30 -0.07 3.43 1.01 0.08 -2.74 120.40 126.39 3ggw s VAL 132 Ca -0.07 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.73 3ggw s VAL 132 Cb -0.15 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 3ggw s VAL 132 CO 0.05 0.45 -0.11 -0.69 0.00 0.00 0.00 175.10 174.80 3ggw s VAL 133 N 0.62 3.33 -0.10 2.92 1.01 -0.58 -0.62 120.40 126.98 3ggw s VAL 133 Ca 0.01 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.39 3ggw s VAL 133 Cb -0.14 -2.34 0.01 0.00 0.00 0.00 0.00 36.38 33.92 3ggw s VAL 133 CO 0.02 0.58 -0.14 0.00 0.00 0.00 0.00 175.10 175.56 3ggw s PHE 135 N 0.94 3.54 -0.40 0.00 0.08 -0.15 -0.89 117.98 121.10 3ggw s PHE 135 Ca -0.08 0.47 0.02 0.00 0.12 0.00 0.00 56.93 57.45 3ggw s PHE 135 Cb -0.15 -2.01 0.12 0.00 -0.57 0.00 0.00 43.02 40.41 3ggw s PHE 135 CO -0.01 0.60 0.18 -0.51 -0.10 0.00 0.00 175.22 175.38 3ggw s LEU 136 N -0.59 2.97 0.01 -0.37 1.02 -0.05 -1.21 118.68 120.46 3ggw s LEU 136 Ca 0.13 -2.34 0.02 0.00 0.02 0.00 0.00 54.13 51.96 3ggw s LEU 136 Cb -0.12 -1.12 -0.04 0.00 0.02 0.00 0.00 46.19 44.94 3ggw s LEU 136 CO 0.02 -0.32 -0.01 0.20 0.02 0.00 0.00 176.35 176.26 3ggw s ASN 137 N 0.70 5.03 -1.07 2.29 0.01 -0.23 -0.77 114.94 120.91 3ggw s ASN 137 Ca 0.15 -0.05 -0.02 0.00 -0.71 0.00 0.00 52.86 52.22 3ggw s ASN 137 Cb -0.22 -1.28 -0.02 0.00 0.41 0.00 0.00 41.25 40.14 3ggw s ASN 137 CO -0.07 0.26 0.91 0.59 -1.51 0.00 0.00 177.10 177.28 3ggw n ASN 138 N 1.29 -3.66 -4.68 -1.22 4.13 -0.45 -0.99 115.26 109.68 3ggw n ASN 138 Ca -0.14 -0.61 -0.23 0.00 1.68 0.00 0.00 54.58 55.28 3ggw n ASN 138 Cb 0.53 -4.86 -0.07 0.00 -1.54 0.00 0.00 39.78 33.83 3ggw n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3ggw s PHE 139 N -3.35 2.70 -0.23 3.10 -0.12 0.23 -4.64 117.98 115.68 3ggw s PHE 139 Ca 0.16 -0.31 -0.19 0.00 -0.05 0.00 0.00 56.93 56.54 3ggw s PHE 139 Cb -0.02 -1.42 0.06 0.00 -0.63 0.00 0.00 43.02 41.01 3ggw s PHE 139 CO 0.69 0.49 0.59 -0.47 -0.05 0.00 0.00 175.22 176.47 3ggw s TYR 140 N -2.38 -0.71 1.07 3.49 6.14 -0.43 -0.30 117.35 124.24 3ggw s TYR 140 Ca 0.34 1.65 -0.17 0.00 0.64 0.00 0.00 57.07 59.53 3ggw s TYR 140 Cb -0.04 0.29 0.24 0.00 0.42 0.00 0.00 41.96 42.86 3ggw s TYR 140 CO 0.21 -0.35 1.21 -1.25 0.64 0.00 0.00 175.55 176.02 3ggw s PRO 141 N 0.60 -0.21 0.38 4.97 0.04 -1.26 -0.76 135.00 138.76 3ggw s PRO 141 Ca -0.02 -0.21 0.19 0.00 0.04 0.00 0.00 61.00 61.00 3ggw s PRO 141 Cb -0.05 -1.73 0.71 0.00 0.04 0.00 0.00 34.50 33.47 3ggw s PRO 141 CO -0.03 -3.01 1.75 1.57 0.04 0.00 0.00 177.00 177.31 3ggw h LYS 142 N -2.08 0.00 -6.31 4.56 2.10 -1.98 -3.44 116.57 109.42 3ggw h LYS 142 Ca -0.45 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 57.66 3ggw h LYS 142 Cb 1.27 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.60 3ggw h LYS 142 CO 0.38 0.36 1.03 -0.51 -2.00 0.00 0.00 179.45 178.71 3ggw s ASP 143 N -6.44 6.68 0.07 7.07 1.01 -1.26 -4.99 116.67 118.82 3ggw s ASP 143 Ca -0.00 2.26 -0.15 0.00 0.71 0.00 0.00 52.55 55.37 3ggw s ASP 143 Cb 0.11 -2.54 0.03 0.00 1.01 0.00 0.00 42.92 41.52 3ggw s ASP 143 CO 0.68 -0.89 0.35 -0.51 0.21 0.00 0.00 175.17 175.01 3ggw s ILE 144 N 3.55 0.08 -0.06 0.77 2.07 -1.26 -4.63 121.20 121.72 3ggw s ILE 144 Ca 0.72 -0.65 0.00 0.00 -1.41 0.00 0.00 60.65 59.32 3ggw s ILE 144 Cb -0.34 -1.05 0.02 0.00 0.13 0.00 0.00 42.46 41.22 3ggw s ILE 144 CO 0.29 -0.36 -0.04 0.21 -1.91 0.00 0.00 174.94 173.13 3ggw s ASN 145 N -2.34 1.25 -0.03 4.50 3.84 -0.75 -4.99 114.94 116.44 3ggw s ASN 145 Ca -0.02 -0.15 0.02 0.00 0.21 0.00 0.00 52.86 52.93 3ggw s ASN 145 Cb 0.01 -0.51 -0.03 0.00 -0.55 0.00 0.00 41.25 40.17 3ggw s ASN 145 CO -0.06 -0.08 -0.06 -0.69 -2.79 0.00 0.00 177.10 173.42 3ggw s VAL 146 N 1.20 3.76 0.05 -5.21 1.01 -1.26 0.41 120.40 120.36 3ggw s VAL 146 Ca -0.06 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.37 3ggw s VAL 146 Cb -0.14 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3ggw s VAL 146 CO -0.02 0.48 -0.20 -0.54 0.00 0.00 0.00 175.10 174.82 3ggw s LYS 147 N -1.18 1.30 -0.15 2.72 1.02 -0.09 -4.97 119.74 118.39 3ggw s LYS 147 Ca 0.15 -0.97 -0.06 0.00 0.02 0.00 0.00 55.97 55.12 3ggw s LYS 147 Cb -0.11 -1.43 -0.04 0.00 -0.52 0.00 0.00 37.83 35.73 3ggw s LYS 147 CO 0.05 0.36 0.06 -1.58 -0.92 0.00 0.00 175.35 173.32 3ggw s TRP 148 N -0.87 3.28 0.05 3.18 0.52 -1.26 -0.93 118.94 122.91 3ggw s TRP 148 Ca 0.07 0.17 0.05 0.00 0.02 0.00 0.00 56.10 56.40 3ggw s TRP 148 Cb -0.09 -1.98 -0.02 0.00 -1.15 0.00 0.00 33.47 30.23 3ggw s TRP 148 CO 0.02 0.33 -0.14 0.15 0.02 0.00 0.00 176.95 177.33 3ggw s LYS 149 N -0.19 0.89 -0.23 4.98 1.02 -0.46 -1.11 119.74 124.64 3ggw s LYS 149 Ca 0.07 -0.81 0.02 0.00 0.02 0.00 0.00 55.97 55.27 3ggw s LYS 149 Cb -0.12 -0.89 0.05 0.00 -0.52 0.00 0.00 37.83 36.34 3ggw s LYS 149 CO 0.01 0.21 -0.13 0.42 -0.92 0.00 0.00 175.35 174.95 3ggw s ILE 150 N -0.97 2.05 -1.61 2.17 1.01 0.44 -1.36 121.20 122.93 3ggw s ILE 150 Ca 0.00 -1.35 -0.11 0.00 0.00 0.00 0.00 60.65 59.19 3ggw s ILE 150 Cb -0.08 -2.08 0.10 0.00 0.01 0.00 0.00 42.46 40.40 3ggw s ILE 150 CO 0.02 0.15 0.57 0.47 0.00 0.00 0.00 174.94 176.15 3ggw n ASP 151 N 4.52 -1.82 0.00 3.58 8.00 0.97 -0.98 116.55 130.83 3ggw n ASP 151 Ca -0.16 -1.05 0.00 0.00 0.71 0.00 0.00 54.79 54.29 3ggw n ASP 151 Cb 0.45 -2.65 0.00 0.00 -0.02 0.00 0.00 41.12 38.90 3ggw n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ggw n GLY 152 N -1.69 2.51 3.67 0.44 0.00 -1.26 -5.02 105.19 103.83 3ggw n GLY 152 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 3ggw n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ggw s SER 153 N -3.26 6.36 0.22 1.61 0.01 -0.15 -4.98 113.70 113.51 3ggw s SER 153 Ca 0.00 0.42 -0.31 0.00 1.31 0.00 0.00 55.95 57.38 3ggw s SER 153 Cb 0.00 -2.20 -0.10 0.00 0.21 0.00 0.00 66.02 63.93 3ggw s SER 153 CO 0.00 -0.04 1.48 -0.70 0.41 0.00 0.00 173.24 174.39 3ggw s GLU 154 N 1.24 4.25 -0.18 12.44 2.12 -1.26 -0.42 118.70 136.89 3ggw s GLU 154 Ca 0.16 2.31 -0.00 0.00 0.36 0.00 0.00 54.97 57.80 3ggw s GLU 154 Cb -0.14 -3.13 0.01 0.00 0.26 0.00 0.00 34.13 31.12 3ggw s GLU 154 CO 0.07 -0.48 -0.15 0.50 -0.54 0.00 0.00 175.26 174.66 3ggw s ARG 155 N 0.18 3.15 -0.21 4.30 6.06 -0.26 -4.92 118.95 127.26 3ggw s ARG 155 Ca 0.63 -0.76 0.13 0.00 -2.50 0.00 0.00 55.73 53.23 3ggw s ARG 155 Cb -0.42 -2.68 -0.23 0.00 0.06 0.00 0.00 34.95 31.68 3ggw s ARG 155 CO 0.39 -0.13 0.02 1.04 -2.50 0.00 0.00 175.30 174.12 3ggw n GLN 156 N 4.46 0.68 -2.80 5.12 6.02 -1.26 -4.25 117.38 125.35 3ggw n GLN 156 Ca -0.20 0.06 -0.33 0.00 -0.01 0.00 0.00 57.00 56.52 3ggw n GLN 156 Cb 0.51 -1.54 -0.07 0.00 1.02 0.00 0.00 30.24 30.16 3ggw n GLN 156 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3ggw s ASN 157 N -5.84 6.92 0.00 1.08 4.22 -1.26 -3.72 114.94 116.33 3ggw s ASN 157 Ca -0.17 1.69 0.00 0.00 -2.14 0.00 0.00 52.86 52.24 3ggw s ASN 157 Cb 0.07 -2.54 0.00 0.00 1.28 0.00 0.00 41.25 40.06 3ggw s ASN 157 CO 0.76 -0.37 0.00 0.61 -2.04 0.00 0.00 177.10 176.06 3ggw n GLY 158 N -0.68 0.41 3.61 0.45 0.00 -1.26 -4.83 105.19 102.90 3ggw n GLY 158 Ca 0.07 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 3ggw n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ggw s VAL 159 N -2.00 4.15 -0.10 1.61 1.01 -1.24 -0.52 120.40 123.30 3ggw s VAL 159 Ca 0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.69 3ggw s VAL 159 Cb 0.00 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.63 3ggw s VAL 159 CO 0.00 0.56 -0.08 -0.22 0.00 0.00 0.00 175.10 175.37 3ggw s LEU 160 N -0.43 1.21 -0.02 3.92 0.20 0.34 -4.96 118.68 118.94 3ggw s LEU 160 Ca 0.08 -0.28 0.06 0.00 0.69 0.00 0.00 54.13 54.68 3ggw s LEU 160 Cb -0.12 -0.80 -0.02 0.00 -0.43 0.00 0.00 46.19 44.81 3ggw s LEU 160 CO 0.02 -0.10 -0.21 0.20 -0.29 0.00 0.00 176.35 175.97 3ggw s ASN 161 N 1.57 3.50 -0.00 3.68 0.01 -1.26 -0.74 114.94 121.70 3ggw s ASN 161 Ca 0.02 -0.38 -0.04 0.00 -0.71 0.00 0.00 52.86 51.74 3ggw s ASN 161 Cb -0.13 -0.55 -0.00 0.00 0.41 0.00 0.00 41.25 40.98 3ggw s ASN 161 CO -0.06 0.31 0.08 -0.55 -1.51 0.00 0.00 177.10 175.37 3ggw s SER 162 N -0.82 0.06 -0.03 -1.22 0.15 -0.17 -5.00 113.70 106.67 3ggw s SER 162 Ca 0.11 -0.21 0.04 0.00 0.70 0.00 0.00 55.95 56.59 3ggw s SER 162 Cb -0.10 0.18 -0.00 0.00 -1.71 0.00 0.00 66.02 64.38 3ggw s SER 162 CO 0.01 -0.28 -0.13 0.26 1.20 0.00 0.00 173.24 174.29 3ggw s TRP 163 N -1.12 1.29 0.63 3.44 0.51 -1.26 -1.06 118.94 121.35 3ggw s TRP 163 Ca -0.12 -0.31 -0.11 0.00 -2.12 0.00 0.00 56.10 53.44 3ggw s TRP 163 Cb -0.07 -0.87 -0.03 0.00 -0.81 0.00 0.00 33.47 31.69 3ggw s TRP 163 CO 0.01 -0.09 1.03 0.95 -0.51 0.00 0.00 176.95 178.33 3ggw s THR 164 N -0.03 4.55 0.79 2.01 -4.23 -0.23 -5.01 115.64 113.50 3ggw s THR 164 Ca -0.00 0.81 -0.11 0.00 -1.18 0.00 0.00 61.69 61.20 3ggw s THR 164 Cb -0.08 -3.82 0.07 0.00 1.34 0.00 0.00 72.50 70.01 3ggw s THR 164 CO 0.01 -1.07 1.11 -1.81 -0.54 0.00 0.00 174.62 172.32 3ggw s ASP 165 N -4.20 4.16 0.26 3.99 1.01 -1.26 -4.61 116.67 116.02 3ggw s ASP 165 Ca 0.55 1.96 -0.31 0.00 0.71 0.00 0.00 52.55 55.47 3ggw s ASP 165 Cb -0.11 -2.54 -0.12 0.00 1.01 0.00 0.00 42.92 41.16 3ggw s ASP 165 CO 0.53 -2.27 1.66 1.67 0.21 0.00 0.00 175.17 176.97 3ggw n GLN 166 N -3.53 2.75 -2.13 8.23 7.27 -1.26 -4.79 117.38 123.92 3ggw n GLN 166 Ca 0.10 0.99 -0.41 0.00 0.07 0.00 0.00 57.00 57.74 3ggw n GLN 166 Cb 0.52 -2.80 -0.03 0.00 2.41 0.00 0.00 30.24 30.35 3ggw n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3ggw s ASP 167 N 0.80 6.80 0.26 1.69 2.15 0.10 -4.90 116.67 123.56 3ggw s ASP 167 Ca 0.69 2.48 0.25 0.00 0.43 0.00 0.00 52.55 56.39 3ggw s ASP 167 Cb -0.50 -2.61 0.94 0.00 -0.30 0.00 0.00 42.92 40.45 3ggw s ASP 167 CO 0.41 -0.61 1.74 -1.20 -0.17 0.00 0.00 175.17 175.34 3ggw n SER 168 N 2.83 0.76 -0.11 -0.34 7.64 -1.26 -1.06 113.62 122.08 3ggw n SER 168 Ca 0.08 0.65 -0.18 0.00 1.01 0.00 0.00 58.87 60.42 3ggw n SER 168 Cb 0.42 -0.82 -0.07 0.00 -1.01 0.00 0.00 64.21 62.73 3ggw n SER 168 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3ggw n LYS 169 N -2.29 0.55 0.00 1.43 4.76 -1.26 -2.96 118.16 118.38 3ggw n LYS 169 Ca 0.03 0.30 0.08 0.00 -2.87 0.00 0.00 58.31 55.85 3ggw n LYS 169 Cb 0.30 -1.52 0.07 0.00 -1.84 0.00 0.00 35.03 32.04 3ggw n LYS 169 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3ggw n ASP 170 N -4.39 2.32 -0.83 4.39 5.68 -1.25 -4.93 116.55 117.53 3ggw n ASP 170 Ca -0.32 -1.66 -0.11 0.00 -0.50 0.00 0.00 54.79 52.21 3ggw n ASP 170 Cb 0.66 0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 40.61 3ggw n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3ggw n SER 171 N 0.87 -4.78 -4.98 -1.12 7.64 -0.23 -4.95 113.62 106.09 3ggw n SER 171 Ca 0.09 0.27 -0.19 0.00 1.01 0.00 0.00 58.87 60.05 3ggw n SER 171 Cb 0.40 -3.23 0.05 0.00 -1.01 0.00 0.00 64.21 60.42 3ggw n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3ggw s THR 172 N -2.25 2.42 0.21 0.44 -4.23 -1.26 -4.62 115.64 106.35 3ggw s THR 172 Ca 0.00 -0.93 0.09 0.00 -1.18 0.00 0.00 61.69 59.67 3ggw s THR 172 Cb 0.00 -2.49 -0.05 0.00 1.34 0.00 0.00 72.50 71.30 3ggw s THR 172 CO 0.00 0.00 -0.17 -0.31 -0.54 0.00 0.00 174.62 173.60 3ggw s TYR 173 N -2.64 1.87 0.04 3.99 1.51 0.60 -0.72 117.35 121.99 3ggw s TYR 173 Ca 0.60 -0.49 -0.02 0.00 -1.01 0.00 0.00 57.07 56.15 3ggw s TYR 173 Cb -0.07 -0.87 -0.03 0.00 -0.11 0.00 0.00 41.96 40.88 3ggw s TYR 173 CO 0.38 0.43 -0.01 -1.12 -1.11 0.00 0.00 175.55 174.12 3ggw s SER 174 N -3.19 0.36 0.01 2.29 0.01 -1.26 -0.60 113.70 111.32 3ggw s SER 174 Ca 0.22 -0.78 -0.02 0.00 1.31 0.00 0.00 55.95 56.68 3ggw s SER 174 Cb -0.03 0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.37 3ggw s SER 174 CO 0.09 -0.50 0.03 -0.32 0.41 0.00 0.00 173.24 172.95 3ggw s MET 175 N -3.01 0.33 -0.03 12.44 0.00 0.05 -1.06 119.30 128.01 3ggw s MET 175 Ca -0.01 -0.45 0.06 0.00 0.00 0.00 0.00 55.69 55.28 3ggw s MET 175 Cb 0.01 0.13 -0.01 0.00 0.00 0.00 0.00 34.83 34.96 3ggw s MET 175 CO -0.07 -0.06 -0.20 0.45 0.00 0.00 0.00 175.02 175.14 3ggw s SER 176 N -1.23 2.46 -0.04 1.11 0.15 -0.23 -0.87 113.70 115.05 3ggw s SER 176 Ca -0.13 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.13 3ggw s SER 176 Cb -0.08 -0.48 0.02 0.00 -1.71 0.00 0.00 66.02 63.77 3ggw s SER 176 CO -0.00 0.22 -0.03 -0.55 1.20 0.00 0.00 173.24 174.08 3ggw s SER 177 N -0.26 0.82 -0.10 5.45 0.15 -0.07 -1.00 113.70 118.69 3ggw s SER 177 Ca 0.02 -0.10 0.02 0.00 0.70 0.00 0.00 55.95 56.59 3ggw s SER 177 Cb -0.10 -0.38 0.02 0.00 -1.71 0.00 0.00 66.02 63.84 3ggw s SER 177 CO 0.01 -0.07 -0.13 -0.89 1.20 0.00 0.00 173.24 173.35 3ggw s THR 178 N 0.98 1.35 -0.22 6.45 2.01 0.08 -0.41 115.64 125.87 3ggw s THR 178 Ca -0.10 -0.55 -0.10 0.00 0.31 0.00 0.00 61.69 61.24 3ggw s THR 178 Cb -0.14 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.07 3ggw s THR 178 CO -0.01 0.41 0.14 -0.22 -0.69 0.00 0.00 174.62 174.26 3ggw s LEU 179 N 1.01 4.11 -0.07 4.42 2.96 0.20 -0.51 118.68 130.81 3ggw s LEU 179 Ca -0.07 0.14 0.05 0.00 -0.22 0.00 0.00 54.13 54.03 3ggw s LEU 179 Cb -0.15 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.45 3ggw s LEU 179 CO -0.01 0.11 -0.23 -0.89 -1.32 0.00 0.00 176.35 174.00 3ggw s THR 180 N 0.81 1.95 0.26 3.68 2.01 0.32 -0.74 115.64 123.93 3ggw s THR 180 Ca 0.07 -0.99 0.01 0.00 0.31 0.00 0.00 61.69 61.10 3ggw s THR 180 Cb -0.13 -1.67 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 3ggw s THR 180 CO 0.02 0.54 0.13 -0.76 -0.69 0.00 0.00 174.62 173.86 3ggw s LEU 181 N 0.08 1.52 0.63 4.42 1.02 -0.08 -4.64 118.68 121.63 3ggw s LEU 181 Ca -0.10 -1.44 -0.15 0.00 0.02 0.00 0.00 54.13 52.46 3ggw s LEU 181 Cb -0.15 0.17 -0.02 0.00 0.02 0.00 0.00 46.19 46.21 3ggw s LEU 181 CO 0.05 -0.81 1.07 0.42 0.02 0.00 0.00 176.35 177.11 3ggw s THR 182 N -3.81 3.65 0.25 5.49 -4.23 -1.26 -0.74 115.64 114.99 3ggw s THR 182 Ca 0.38 0.75 -0.04 0.00 -1.18 0.00 0.00 61.69 61.60 3ggw s THR 182 Cb 0.07 -3.29 0.22 0.00 1.34 0.00 0.00 72.50 70.84 3ggw s THR 182 CO 0.15 -0.50 1.81 0.50 -0.54 0.00 0.00 174.62 176.04 3ggw h LYS 183 N 0.18 0.77 -0.21 3.99 3.64 -1.30 -0.75 116.57 122.89 3ggw h LYS 183 Ca -0.46 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 3ggw h LYS 183 Cb 1.23 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 3ggw h LYS 183 CO 0.56 0.51 0.11 0.22 -2.27 0.00 0.00 179.45 178.58 3ggw h ASP 184 N 0.79 0.26 -0.51 4.20 3.58 -1.92 -1.48 116.42 121.34 3ggw h ASP 184 Ca 0.41 -0.10 -0.08 0.00 0.42 0.00 0.00 57.03 57.67 3ggw h ASP 184 Cb 0.39 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.36 3ggw h ASP 184 CO -0.26 0.29 -0.01 -0.08 -2.88 0.00 0.00 179.24 176.31 3ggw h GLU 185 N 0.22 0.91 -0.64 0.28 4.81 -1.87 -3.11 114.58 115.17 3ggw h GLU 185 Ca 0.07 -0.29 0.05 0.00 -0.13 0.00 0.00 59.36 59.06 3ggw h GLU 185 Cb 0.09 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.34 3ggw h GLU 185 CO -0.01 0.94 0.36 -0.92 -0.73 0.00 0.00 179.01 178.64 3ggw h TYR 186 N 0.77 0.65 0.00 0.92 3.20 -0.93 -2.22 116.97 119.37 3ggw h TYR 186 Ca 0.14 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.04 3ggw h TYR 186 Cb 0.53 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.60 3ggw h TYR 186 CO 0.04 0.32 0.00 0.39 -1.64 0.00 0.00 178.16 177.27 3ggw n GLU 187 N -4.79 0.94 0.00 1.82 1.02 -0.58 -2.99 120.64 116.06 3ggw n GLU 187 Ca 0.07 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.30 3ggw n GLU 187 Cb 0.15 -1.02 0.06 0.00 -0.02 0.00 0.00 31.44 30.61 3ggw n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3ggw n ARG 188 N -0.47 1.51 -4.16 3.49 1.74 -0.83 -5.01 116.66 112.93 3ggw n ARG 188 Ca 0.00 -1.40 -0.10 0.00 -0.77 0.00 0.00 57.85 55.58 3ggw n ARG 188 Cb 0.01 -1.33 -0.10 0.00 -1.02 0.00 0.00 32.46 30.02 3ggw n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3ggw s HIS 189 N -1.59 0.83 -0.08 -1.55 3.76 -1.16 -5.11 115.29 110.39 3ggw s HIS 189 Ca 0.19 -1.00 -0.09 0.00 -0.15 0.00 0.00 55.06 54.01 3ggw s HIS 189 Cb 0.15 -0.50 -0.04 0.00 1.11 0.00 0.00 32.58 33.29 3ggw s HIS 189 CO 0.27 -0.25 -0.19 -1.71 -0.85 0.00 0.00 174.74 172.00 3ggw n ASN 190 N -0.03 1.38 -4.52 1.40 5.15 -1.26 -4.73 115.26 112.65 3ggw n ASN 190 Ca -0.11 0.22 -0.40 0.00 -0.60 0.00 0.00 54.58 53.69 3ggw n ASN 190 Cb 0.61 -0.51 -0.11 0.00 -0.53 0.00 0.00 39.78 39.24 3ggw n ASN 190 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3ggw s SER 191 N -6.09 6.00 -0.20 1.20 0.15 -1.26 -0.69 113.70 112.81 3ggw s SER 191 Ca -0.17 -0.40 -0.04 0.00 0.70 0.00 0.00 55.95 56.04 3ggw s SER 191 Cb 0.04 -2.12 -0.02 0.00 -1.71 0.00 0.00 66.02 62.22 3ggw s SER 191 CO 0.24 -0.21 -0.04 -0.31 1.20 0.00 0.00 173.24 174.12 3ggw s TYR 192 N 1.71 2.97 -0.04 3.44 2.02 -0.26 -0.02 117.35 127.17 3ggw s TYR 192 Ca 0.06 -0.72 0.04 0.00 -0.37 0.00 0.00 57.07 56.08 3ggw s TYR 192 Cb -0.17 -2.06 0.00 0.00 -0.40 0.00 0.00 41.96 39.33 3ggw s TYR 192 CO 0.10 -0.38 -0.14 0.95 -1.57 0.00 0.00 175.55 174.51 3ggw s THR 193 N 1.12 1.18 -0.17 -0.71 -4.23 -0.47 -0.35 115.64 112.01 3ggw s THR 193 Ca 0.02 -0.57 -0.06 0.00 -1.18 0.00 0.00 61.69 59.90 3ggw s THR 193 Cb -0.15 -1.03 -0.03 0.00 1.34 0.00 0.00 72.50 72.63 3ggw s THR 193 CO -0.00 0.35 0.01 0.00 -0.54 0.00 0.00 174.62 174.44 3ggw s GLU 195 N 0.44 1.39 -0.09 0.00 2.02 -0.11 -1.84 118.70 120.51 3ggw s GLU 195 Ca -0.00 -0.69 -0.01 0.00 0.02 0.00 0.00 54.97 54.28 3ggw s GLU 195 Cb -0.13 -2.26 -0.03 0.00 0.10 0.00 0.00 34.13 31.81 3ggw s GLU 195 CO 0.02 -0.53 -0.02 0.00 0.02 0.00 0.00 175.26 174.74 3ggw s ALA 196 N 1.58 3.15 -0.20 5.21 0.00 0.17 -0.91 121.76 130.75 3ggw s ALA 196 Ca -0.02 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.06 3ggw s ALA 196 Cb -0.17 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.50 3ggw s ALA 196 CO -0.07 0.51 -0.01 0.99 0.00 0.00 0.00 175.76 177.17 3ggw s THR 197 N -0.61 3.80 0.01 0.00 2.01 0.16 0.04 115.64 121.05 3ggw s THR 197 Ca 0.10 -0.36 -0.09 0.00 0.31 0.00 0.00 61.69 61.64 3ggw s THR 197 Cb -0.12 -2.72 0.01 0.00 0.01 0.00 0.00 72.50 69.68 3ggw s THR 197 CO 0.02 0.43 0.19 -2.28 -0.69 0.00 0.00 174.62 172.28 3ggw s HIS 198 N 1.10 -0.00 -0.00 4.92 5.04 -1.26 -1.80 115.29 123.29 3ggw s HIS 198 Ca 0.02 -0.09 0.28 0.00 -1.54 0.00 0.00 55.06 53.74 3ggw s HIS 198 Cb -0.14 -0.01 1.47 0.00 0.04 0.00 0.00 32.58 33.94 3ggw s HIS 198 CO 0.01 -0.34 1.86 1.57 -2.34 0.00 0.00 174.74 175.49 3ggw h LYS 199 N 3.99 0.00 -0.02 2.88 2.10 -1.94 -1.89 116.57 121.70 3ggw h LYS 199 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 3ggw h LYS 199 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 3ggw h LYS 199 CO 0.42 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.12 3ggw n THR 200 N -2.49 0.02 -3.82 0.07 -2.24 -1.26 -4.76 114.28 99.79 3ggw n THR 200 Ca -0.01 -0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.59 3ggw n THR 200 Cb 0.07 -0.26 -0.14 0.00 -2.10 0.00 0.00 70.33 67.91 3ggw n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3ggw s SER 201 N -1.79 -0.03 0.41 3.42 0.15 -0.71 -4.98 113.70 110.17 3ggw s SER 201 Ca 0.37 0.11 0.23 0.00 0.70 0.00 0.00 55.95 57.37 3ggw s SER 201 Cb 0.18 0.07 0.36 0.00 -1.71 0.00 0.00 66.02 64.92 3ggw s SER 201 CO 0.29 -0.06 1.60 0.71 1.20 0.00 0.00 173.24 176.98 3ggw h THR 202 N 5.47 0.00 -2.53 6.45 1.35 -1.85 -3.41 112.91 118.38 3ggw h THR 202 Ca -0.32 -0.96 -0.60 0.00 -0.55 0.00 0.00 66.41 63.99 3ggw h THR 202 Cb 1.18 1.94 -0.12 0.00 -1.73 0.00 0.00 68.15 69.41 3ggw h THR 202 CO 0.47 0.00 -0.71 -0.94 -0.25 0.00 0.00 175.52 174.10 3ggw s SER 203 N -6.05 4.19 0.28 5.36 1.04 -1.26 -5.10 113.70 112.16 3ggw s SER 203 Ca 0.07 -0.71 -0.28 0.00 0.48 0.00 0.00 55.95 55.50 3ggw s SER 203 Cb 0.06 -0.66 -0.14 0.00 0.10 0.00 0.00 66.02 65.38 3ggw s SER 203 CO 0.67 0.05 1.00 -2.65 0.98 0.00 0.00 173.24 173.29 3ggw n PRO 204 N -0.45 1.28 -3.28 4.02 -0.02 -1.26 -4.86 135.00 130.42 3ggw n PRO 204 Ca -0.08 0.45 -0.41 0.00 -2.02 0.00 0.00 63.50 61.44 3ggw n PRO 204 Cb 0.58 -1.81 -0.08 0.00 -0.02 0.00 0.00 33.50 32.16 3ggw n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3ggw s ILE 205 N -0.98 5.07 -0.03 4.25 1.01 0.11 -4.88 121.20 125.74 3ggw s ILE 205 Ca 0.60 0.41 0.06 0.00 0.00 0.00 0.00 60.65 61.71 3ggw s ILE 205 Cb -0.72 -3.89 -0.01 0.00 0.01 0.00 0.00 42.46 37.85 3ggw s ILE 205 CO 0.59 -0.10 -0.20 -0.69 0.00 0.00 0.00 174.94 174.53 3ggw s VAL 206 N 2.28 1.64 0.01 2.92 1.01 -1.26 -0.66 120.40 126.34 3ggw s VAL 206 Ca 0.18 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.34 3ggw s VAL 206 Cb -0.16 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 3ggw s VAL 206 CO 0.12 0.46 -0.15 -0.54 0.00 0.00 0.00 175.10 174.99 3ggw s LYS 207 N -0.29 1.14 0.10 2.72 -0.14 -0.77 -5.02 119.74 117.49 3ggw s LYS 207 Ca 0.03 -0.63 0.07 0.00 -1.36 0.00 0.00 55.97 54.08 3ggw s LYS 207 Cb -0.10 -1.13 -0.03 0.00 -1.68 0.00 0.00 37.83 34.88 3ggw s LYS 207 CO 0.01 0.30 -0.19 -1.54 -0.76 0.00 0.00 175.35 173.17 3ggw s SER 208 N -0.64 2.29 -0.10 2.83 1.04 -1.26 -1.58 113.70 116.28 3ggw s SER 208 Ca 0.05 -0.69 0.03 0.00 0.48 0.00 0.00 55.95 55.82 3ggw s SER 208 Cb -0.07 -0.11 0.01 0.00 0.10 0.00 0.00 66.02 65.95 3ggw s SER 208 CO 0.00 0.00 -0.19 0.12 0.98 0.00 0.00 173.24 174.15 3ggw s PHE 209 N -1.31 2.22 -0.24 5.02 5.36 0.52 -4.97 117.98 124.58 3ggw s PHE 209 Ca 0.05 -0.95 -0.10 0.00 -0.96 0.00 0.00 56.93 54.97 3ggw s PHE 209 Cb -0.09 -1.53 -0.05 0.00 -0.34 0.00 0.00 43.02 41.01 3ggw s PHE 209 CO 0.04 -0.43 0.14 -0.80 -1.46 0.00 0.00 175.22 172.71 3ggw s ASN 210 N 0.60 5.90 0.28 6.13 0.01 -1.26 -1.10 114.94 125.49 3ggw s ASN 210 Ca -0.14 0.04 -0.02 0.00 -0.71 0.00 0.00 52.86 52.03 3ggw s ASN 210 Cb -0.17 -2.06 0.38 0.00 0.41 0.00 0.00 41.25 39.81 3ggw s ASN 210 CO 0.04 0.05 1.86 -0.09 -1.51 0.00 0.00 177.10 177.45 3ggw h ARG 211 N 7.64 0.96 -6.10 -0.60 2.43 -1.20 -3.25 114.38 114.26 3ggw h ARG 211 Ca -0.37 -0.15 -0.51 0.00 -0.81 0.00 0.00 59.98 58.14 3ggw h ARG 211 Cb 1.17 -0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 30.48 3ggw h ARG 211 CO 0.63 0.77 1.20 1.21 -1.51 0.00 0.00 179.97 182.28 3ggw s ASN 212 N -6.47 5.96 -0.07 -3.80 2.47 -1.26 -4.71 114.94 107.06 3ggw s ASN 212 Ca -0.11 -0.73 0.07 0.00 0.42 0.00 0.00 52.86 52.52 3ggw s ASN 212 Cb 0.16 -2.56 -0.10 0.00 -1.45 0.00 0.00 41.25 37.31 3ggw s ASN 212 CO 0.80 -1.97 0.03 -1.84 -3.72 0.00 0.00 177.10 170.41 3ggw n GLU 213 N 9.08 2.69 0.00 0.43 0.28 -1.23 -5.16 120.64 126.73 3ggw n GLU 213 Ca 0.23 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.22 3ggw n GLU 213 Cb 0.50 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.17 3ggw n GLU 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97