#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gk3 s LYS 7 N 0.00 3.06 -0.16 1.64 1.02 -1.26 -5.04 119.74 119.00 2gk3 s LYS 7 Ca 0.00 -1.85 -0.18 0.00 0.02 0.00 0.00 55.97 53.96 2gk3 s LYS 7 Cb 0.00 -4.29 -0.04 0.00 -0.52 0.00 0.00 37.83 32.98 2gk3 s LYS 7 CO 0.00 -1.31 0.49 -0.51 -0.92 0.00 0.00 175.35 173.10 2gk3 s LEU 8 N 1.33 4.22 -0.35 3.17 1.43 -1.26 -4.99 118.68 122.23 2gk3 s LEU 8 Ca 0.06 0.74 -0.12 0.00 -1.03 0.00 0.00 54.13 53.78 2gk3 s LEU 8 Cb -0.26 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.27 2gk3 s LEU 8 CO 0.01 -0.08 0.21 -0.75 0.23 0.00 0.00 176.35 175.97 2gk3 s LYS 9 N 1.08 3.23 -0.07 1.70 2.20 -1.26 -0.79 119.74 125.83 2gk3 s LYS 9 Ca 0.25 -0.81 0.05 0.00 -0.36 0.00 0.00 55.97 55.09 2gk3 s LYS 9 Cb -0.15 -3.73 -0.00 0.00 -1.51 0.00 0.00 37.83 32.43 2gk3 s LYS 9 CO 0.10 -0.53 -0.23 0.08 -0.36 0.00 0.00 175.35 174.41 2gk3 s VAL 10 N 1.64 1.92 -0.31 4.02 1.01 -0.29 0.26 120.40 128.66 2gk3 s VAL 10 Ca 0.05 -0.97 -0.17 0.00 0.00 0.00 0.00 61.98 60.88 2gk3 s VAL 10 Cb -0.18 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 2gk3 s VAL 10 CO 0.08 0.53 0.48 -0.22 0.00 0.00 0.00 175.10 175.98 2gk3 s LEU 11 N 0.08 4.21 -0.32 3.92 0.20 -0.64 -1.50 118.68 124.63 2gk3 s LEU 11 Ca -0.09 0.17 -0.09 0.00 0.69 0.00 0.00 54.13 54.81 2gk3 s LEU 11 Cb -0.15 -2.56 0.01 0.00 -0.43 0.00 0.00 46.19 43.05 2gk3 s LEU 11 CO 0.05 -0.37 0.14 0.12 -0.29 0.00 0.00 176.35 176.01 2gk3 s PHE 12 N 2.29 3.18 -0.17 5.38 5.36 0.22 -0.62 117.98 133.62 2gk3 s PHE 12 Ca 0.18 -0.79 -0.05 0.00 -0.96 0.00 0.00 56.93 55.31 2gk3 s PHE 12 Cb -0.16 -2.34 -0.03 0.00 -0.34 0.00 0.00 43.02 40.15 2gk3 s PHE 12 CO 0.11 -0.53 0.00 0.42 -1.46 0.00 0.00 175.22 173.76 2gk3 s ILE 13 N 1.56 4.23 0.00 3.12 1.01 0.17 -4.41 121.20 126.88 2gk3 s ILE 13 Ca 0.03 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.45 2gk3 s ILE 13 Cb -0.18 -2.88 0.00 0.00 0.01 0.00 0.00 42.46 39.42 2gk3 s ILE 13 CO 0.05 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.08 2gk3 n GLY 14 N 3.55 0.20 3.64 6.18 0.00 -1.26 -1.40 105.19 116.10 2gk3 n GLY 14 Ca -0.17 -1.87 -0.27 0.00 0.00 0.00 0.00 46.02 43.71 2gk3 n GLY 14 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gk3 n GLU 15 N 0.00 -4.97 -3.96 1.61 -0.58 -0.09 -4.14 120.64 108.51 2gk3 n GLU 15 Ca 0.00 0.62 -0.09 0.00 -0.42 0.00 0.00 57.16 57.27 2gk3 n GLU 15 Cb 0.00 -5.47 -0.10 0.00 -0.57 0.00 0.00 31.44 25.30 2gk3 n GLU 15 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2gk3 s SER 16 N -3.06 0.22 0.10 1.62 1.04 -1.26 0.12 113.70 112.47 2gk3 s SER 16 Ca 0.55 -0.56 -0.21 0.00 0.48 0.00 0.00 55.95 56.21 2gk3 s SER 16 Cb -0.27 0.19 0.05 0.00 0.10 0.00 0.00 66.02 66.09 2gk3 s SER 16 CO 0.67 -0.46 0.51 -1.66 0.98 0.00 0.00 173.24 173.28 2gk3 s TRP 17 N -2.43 -0.39 -0.19 5.02 -2.14 -0.91 -4.69 118.94 113.21 2gk3 s TRP 17 Ca -0.07 0.27 0.01 0.00 2.66 0.00 0.00 56.10 58.98 2gk3 s TRP 17 Cb -0.02 0.38 0.03 0.00 -3.10 0.00 0.00 33.47 30.75 2gk3 s TRP 17 CO -0.04 -0.71 -0.17 -1.58 -2.66 0.00 0.00 176.95 171.78 2gk3 s HIS 18 N -3.17 2.77 -0.14 1.66 2.46 -1.26 -2.12 115.29 115.50 2gk3 s HIS 18 Ca -0.01 -1.72 -0.16 0.00 0.47 0.00 0.00 55.06 53.64 2gk3 s HIS 18 Cb -0.00 -1.87 -0.04 0.00 -0.13 0.00 0.00 32.58 30.54 2gk3 s HIS 18 CO -0.08 -0.80 0.40 0.42 -2.47 0.00 0.00 174.74 172.21 2gk3 s ILE 19 N 1.29 5.24 0.33 0.89 1.09 0.12 -4.94 121.20 125.21 2gk3 s ILE 19 Ca 0.02 0.78 0.04 0.00 -1.10 0.00 0.00 60.65 60.39 2gk3 s ILE 19 Cb -0.14 -3.74 0.06 0.00 -1.06 0.00 0.00 42.46 37.57 2gk3 s ILE 19 CO -0.11 0.34 0.45 1.57 -0.10 0.00 0.00 174.94 177.09 2gk3 n HIS 20 N 3.70 -2.77 -3.26 3.97 -0.00 -1.26 -0.41 115.22 115.19 2gk3 n HIS 20 Ca -0.09 -1.06 0.03 0.00 0.46 0.00 0.00 57.72 57.07 2gk3 n HIS 20 Cb 0.52 -0.31 -0.03 0.00 -0.12 0.00 0.00 29.99 30.05 2gk3 n HIS 20 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 2gk3 s ILE 22 N -1.05 -0.53 -0.53 3.57 1.01 -1.26 -5.00 121.20 117.40 2gk3 s ILE 22 Ca 0.33 0.00 -0.16 0.00 0.00 0.00 0.00 60.65 60.82 2gk3 s ILE 22 Cb -0.02 -1.00 0.13 0.00 0.01 0.00 0.00 42.46 41.57 2gk3 s ILE 22 CO 0.21 0.00 0.49 -1.00 0.00 0.00 0.00 174.94 174.64 2gk3 s HIS 23 N 2.74 3.25 -0.25 3.97 3.76 0.20 -5.00 115.29 123.97 2gk3 s HIS 23 Ca 0.02 -1.28 -0.23 0.00 -0.15 0.00 0.00 55.06 53.42 2gk3 s HIS 23 Cb -0.10 -3.74 -0.01 0.00 1.11 0.00 0.00 32.58 29.84 2gk3 s HIS 23 CO -0.15 -1.00 0.77 -1.12 -0.85 0.00 0.00 174.74 172.38 2gk3 s SER 24 N 3.50 6.74 -0.57 1.40 0.01 -1.26 -2.28 113.70 121.23 2gk3 s SER 24 Ca 0.03 0.90 0.02 0.00 1.31 0.00 0.00 55.95 58.22 2gk3 s SER 24 Cb -0.29 -2.40 0.14 0.00 0.21 0.00 0.00 66.02 63.68 2gk3 s SER 24 CO 0.03 -0.48 0.34 -0.54 0.41 0.00 0.00 173.24 173.00 2gk3 s LYS 25 N 2.75 2.20 7.39 12.44 1.02 0.21 -4.98 119.74 140.77 2gk3 s LYS 25 Ca 0.32 -2.70 0.00 0.00 0.02 0.00 0.00 55.97 53.61 2gk3 s LYS 25 Cb -0.15 -3.44 0.00 0.00 -0.52 0.00 0.00 37.83 33.71 2gk3 s LYS 25 CO 0.08 -1.15 0.00 0.41 -0.92 0.00 0.00 175.35 173.78 2gk3 n GLY 26 N 3.06 2.50 0.32 -3.33 0.00 -1.26 -2.79 105.19 103.69 2gk3 n GLY 26 Ca 0.08 -0.30 -0.06 0.00 0.00 0.00 0.00 46.02 45.73 2gk3 n GLY 26 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2gk3 h TYR 27 N 0.00 1.11 -2.96 1.61 3.20 -2.02 -3.46 116.97 114.45 2gk3 h TYR 27 Ca 0.00 -0.12 -0.48 0.00 3.14 0.00 0.00 58.73 61.27 2gk3 h TYR 27 Cb 0.00 -0.32 0.01 0.00 1.54 0.00 0.00 36.73 37.96 2gk3 h TYR 27 CO 0.00 0.90 -0.14 -0.51 -1.64 0.00 0.00 178.16 176.77 2gk3 s ASP 28 N -6.48 6.31 0.00 -2.11 1.01 -1.12 -5.10 116.67 109.18 2gk3 s ASP 28 Ca -0.11 0.55 0.00 0.00 0.71 0.00 0.00 52.55 53.69 2gk3 s ASP 28 Cb 0.15 -2.07 -0.00 0.00 1.01 0.00 0.00 42.92 42.00 2gk3 s ASP 28 CO 0.84 -0.32 -0.01 -0.44 0.21 0.00 0.00 175.17 175.44 2gk3 s SER 29 N -3.94 0.08 0.30 0.27 0.01 -1.26 0.67 113.70 109.82 2gk3 s SER 29 Ca 0.41 -0.12 0.11 0.00 1.31 0.00 0.00 55.95 57.66 2gk3 s SER 29 Cb -0.10 0.02 -0.05 0.00 0.21 0.00 0.00 66.02 66.10 2gk3 s SER 29 CO 0.37 -0.06 -0.10 0.72 0.41 0.00 0.00 173.24 174.57 2gk3 s PHE 30 N -0.33 2.45 0.11 2.43 -0.12 -0.97 -4.95 117.98 116.59 2gk3 s PHE 30 Ca -0.03 -0.35 0.10 0.00 -0.05 0.00 0.00 56.93 56.60 2gk3 s PHE 30 Cb -0.02 -1.19 -0.04 0.00 -0.63 0.00 0.00 43.02 41.14 2gk3 s PHE 30 CO -0.00 0.63 -0.26 0.95 -0.05 0.00 0.00 175.22 176.49 2gk3 s THR 31 N -2.48 2.18 0.02 -4.49 -4.23 -1.26 -0.63 115.64 104.75 2gk3 s THR 31 Ca 0.32 -1.66 0.03 0.00 -1.18 0.00 0.00 61.69 59.20 2gk3 s THR 31 Cb -0.03 -1.92 -0.02 0.00 1.34 0.00 0.00 72.50 71.87 2gk3 s THR 31 CO 0.17 0.13 -0.10 -0.94 -0.54 0.00 0.00 174.62 173.35 2gk3 s SER 32 N -1.87 1.11 -0.02 3.99 1.04 -1.26 -5.00 113.70 111.69 2gk3 s SER 32 Ca 0.13 -0.35 0.07 0.00 0.48 0.00 0.00 55.95 56.28 2gk3 s SER 32 Cb -0.10 -0.06 -0.02 0.00 0.10 0.00 0.00 66.02 65.94 2gk3 s SER 32 CO 0.05 -0.01 -0.23 -0.44 0.98 0.00 0.00 173.24 173.59 2gk3 s SER 33 N -0.86 2.70 -0.16 7.02 0.01 -1.26 -4.57 113.70 116.58 2gk3 s SER 33 Ca -0.01 -0.42 -0.05 0.00 1.31 0.00 0.00 55.95 56.78 2gk3 s SER 33 Cb -0.06 -0.39 0.06 0.00 0.21 0.00 0.00 66.02 65.84 2gk3 s SER 33 CO 0.00 0.27 0.09 -0.75 0.41 0.00 0.00 173.24 173.26 2gk3 s LYS 34 N -0.45 0.07 0.21 12.44 2.20 0.45 -4.99 119.74 129.67 2gk3 s LYS 34 Ca 0.06 -0.07 -0.25 0.00 -0.36 0.00 0.00 55.97 55.36 2gk3 s LYS 34 Cb -0.10 -1.76 -0.08 0.00 -1.51 0.00 0.00 37.83 34.38 2gk3 s LYS 34 CO -0.00 -0.65 0.82 -0.47 -0.36 0.00 0.00 175.35 174.69 2gk3 s TYR 35 N 2.13 3.86 0.04 4.03 5.04 -1.26 0.15 117.35 131.34 2gk3 s TYR 35 Ca 0.02 1.66 -0.09 0.00 -2.44 0.00 0.00 57.07 56.22 2gk3 s TYR 35 Cb -0.16 -2.80 0.00 0.00 0.35 0.00 0.00 41.96 39.36 2gk3 s TYR 35 CO -0.09 0.44 0.20 -1.21 -1.34 0.00 0.00 175.55 173.55 2gk3 s GLU 36 N -1.38 0.69 -0.05 4.97 2.02 -0.90 -5.00 118.70 119.04 2gk3 s GLU 36 Ca 0.39 -0.62 0.05 0.00 0.02 0.00 0.00 54.97 54.81 2gk3 s GLU 36 Cb -0.22 0.28 -0.02 0.00 0.10 0.00 0.00 34.13 34.27 2gk3 s GLU 36 CO 0.26 -0.20 -0.19 -1.21 0.02 0.00 0.00 175.26 173.95 2gk3 s GLU 37 N -2.51 2.53 0.02 1.61 2.02 -1.26 -2.13 118.70 118.97 2gk3 s GLU 37 Ca -0.05 -0.79 0.22 0.00 0.02 0.00 0.00 54.97 54.37 2gk3 s GLU 37 Cb -0.01 -2.29 -0.20 0.00 0.10 0.00 0.00 34.13 31.72 2gk3 s GLU 37 CO -0.04 0.52 0.73 0.41 0.02 0.00 0.00 175.26 176.90 2gk3 n GLY 38 N 2.60 -1.09 0.56 -1.39 0.00 0.12 -4.46 105.19 101.52 2gk3 n GLY 38 Ca -0.17 -0.48 0.06 0.00 0.00 0.00 0.00 46.02 45.43 2gk3 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gk3 n ALA 39 N -2.02 3.38 -0.21 4.61 0.00 -1.26 -4.78 120.51 120.23 2gk3 n ALA 39 Ca -0.01 -3.07 0.01 0.00 0.00 0.00 0.00 53.44 50.37 2gk3 n ALA 39 Cb 0.50 -0.43 0.12 0.00 0.00 0.00 0.00 19.45 19.64 2gk3 n ALA 39 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2gk3 h THR 40 N 0.78 0.62 0.37 0.00 2.02 -1.93 -0.74 112.91 114.04 2gk3 h THR 40 Ca 0.03 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 2gk3 h THR 40 Cb 1.11 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 2gk3 h THR 40 CO 0.06 0.05 -0.43 -0.25 0.37 0.00 0.00 175.52 175.32 2gk3 h TRP 41 N 0.26 -1.20 -0.25 3.16 -0.00 -1.96 -1.58 115.95 114.39 2gk3 h TRP 41 Ca 0.33 0.01 0.06 0.00 -0.00 0.00 0.00 58.89 59.29 2gk3 h TRP 41 Cb 0.50 0.47 -0.07 0.00 -0.00 0.00 0.00 29.16 30.07 2gk3 h TRP 41 CO -0.25 -0.58 -0.19 1.25 -0.00 0.00 0.00 178.44 178.66 2gk3 h LEU 42 N -0.84 -0.63 -1.59 0.65 6.46 -1.80 -1.44 115.31 116.12 2gk3 h LEU 42 Ca -0.03 0.13 0.03 0.00 -0.12 0.00 0.00 57.88 57.89 2gk3 h LEU 42 Cb 0.76 0.31 -0.03 0.00 -0.73 0.00 0.00 40.66 40.98 2gk3 h LEU 42 CO -0.10 -0.23 0.32 -0.07 -0.62 0.00 0.00 178.44 177.73 2gk3 h LEU 43 N -0.19 0.46 -0.75 2.25 3.38 -1.03 -0.12 115.31 119.31 2gk3 h LEU 43 Ca 0.14 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 2gk3 h LEU 43 Cb 0.40 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2gk3 h LEU 43 CO -0.36 0.32 -0.03 -0.08 0.09 0.00 0.00 178.44 178.37 2gk3 h GLU 44 N 0.54 0.92 -0.42 1.13 4.57 -0.56 -1.73 114.58 119.02 2gk3 h GLU 44 Ca 0.19 -0.28 -0.13 0.00 -1.18 0.00 0.00 59.36 57.96 2gk3 h GLU 44 Cb 0.10 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 2gk3 h GLU 44 CO -0.05 0.93 -0.26 0.00 -1.18 0.00 0.00 179.01 178.46 2gk3 h LEU 46 N 0.75 0.73 0.12 0.00 3.38 -1.10 -1.25 115.31 117.93 2gk3 h LEU 46 Ca 0.09 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.83 2gk3 h LEU 46 Cb 0.83 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2gk3 h LEU 46 CO 0.07 0.89 -0.13 -0.09 0.09 0.00 0.00 178.44 179.27 2gk3 h ARG 47 N 0.66 -0.28 0.00 1.13 2.43 -1.15 0.32 114.38 117.49 2gk3 h ARG 47 Ca 0.11 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2gk3 h ARG 47 Cb 0.63 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 2gk3 h ARG 47 CO 0.04 -0.18 -0.10 0.87 -1.51 0.00 0.00 179.97 179.08 2gk3 h LYS 48 N -0.29 0.00 -0.58 0.20 1.57 -1.20 -1.74 116.57 114.53 2gk3 h LYS 48 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2gk3 h LYS 48 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2gk3 h LYS 48 CO -0.05 0.10 0.00 0.41 -0.57 0.00 0.00 179.45 179.35 2gk3 n GLY 49 N -0.60 1.78 1.41 3.86 0.00 -0.49 -4.92 105.19 106.23 2gk3 n GLY 49 Ca -0.02 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2gk3 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gk3 n GLY 50 N 1.22 0.64 3.71 -0.02 0.00 -0.65 -5.02 105.19 105.07 2gk3 n GLY 50 Ca 0.19 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2gk3 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gk3 s VAL 51 N -2.00 4.95 -0.73 1.61 1.01 0.06 -4.55 120.40 120.76 2gk3 s VAL 51 Ca 0.00 1.72 -0.27 0.00 0.00 0.00 0.00 61.98 63.44 2gk3 s VAL 51 Cb 0.00 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 32.24 2gk3 s VAL 51 CO 0.00 0.18 1.34 -0.62 0.00 0.00 0.00 175.10 176.01 2gk3 s ASP 52 N 0.93 6.07 -0.18 3.32 2.15 0.03 -4.24 116.67 124.75 2gk3 s ASP 52 Ca 0.44 -0.37 -0.09 0.00 0.43 0.00 0.00 52.55 52.96 2gk3 s ASP 52 Cb -0.19 -2.56 -0.05 0.00 -0.30 0.00 0.00 42.92 39.83 2gk3 s ASP 52 CO 0.21 -1.90 0.13 -0.63 -0.17 0.00 0.00 175.17 172.81 2gk3 s ILE 53 N 6.10 5.40 -0.23 4.11 -1.09 -1.26 -1.13 121.20 133.09 2gk3 s ILE 53 Ca 0.38 0.18 -0.10 0.00 -2.23 0.00 0.00 60.65 58.89 2gk3 s ILE 53 Cb -0.08 -3.44 -0.05 0.00 -1.58 0.00 0.00 42.46 37.31 2gk3 s ILE 53 CO 0.16 0.48 0.14 -1.81 -1.23 0.00 0.00 174.94 172.68 2gk3 s ASP 54 N 0.03 5.94 0.57 3.58 1.01 -0.56 -4.98 116.67 122.25 2gk3 s ASP 54 Ca 0.09 0.07 0.06 0.00 0.71 0.00 0.00 52.55 53.48 2gk3 s ASP 54 Cb -0.11 -2.07 0.10 0.00 1.01 0.00 0.00 42.92 41.85 2gk3 s ASP 54 CO -0.00 0.07 0.76 0.00 0.21 0.00 0.00 175.17 176.20 2gk3 n TYR 55 N 4.28 -2.55 -3.94 4.23 9.36 -1.26 -0.61 117.16 126.67 2gk3 n TYR 55 Ca -0.15 -1.79 -0.09 0.00 3.32 0.00 0.00 57.90 59.19 2gk3 n TYR 55 Cb 0.52 -0.53 -0.09 0.00 -0.63 0.00 0.00 39.34 38.61 2gk3 n TYR 55 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 2gk3 s PRO 57 N -4.46 0.66 0.26 2.98 0.02 -1.26 -4.98 135.00 128.23 2gk3 s PRO 57 Ca 0.55 -0.90 -0.05 0.00 0.02 0.00 0.00 61.00 60.63 2gk3 s PRO 57 Cb -0.04 0.26 0.51 0.00 0.02 0.00 0.00 34.50 35.25 2gk3 s PRO 57 CO 0.36 -0.17 1.62 0.00 -0.33 0.00 0.00 177.00 178.47 2gk3 h ALA 58 N 3.31 0.87 -0.44 -1.55 0.00 -1.84 -1.12 119.26 118.50 2gk3 h ALA 58 Ca -0.33 0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2gk3 h ALA 58 Cb 1.18 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 19.42 2gk3 h ALA 58 CO 0.55 -0.45 0.30 1.12 0.00 0.00 0.00 179.25 180.76 2gk3 h HIS 59 N 0.08 0.30 0.00 0.00 2.07 -1.96 -1.90 115.15 113.74 2gk3 h HIS 59 Ca 0.46 0.01 -0.11 0.00 -2.85 0.00 0.00 60.37 57.88 2gk3 h HIS 59 Cb 0.84 -0.10 -0.02 0.00 2.57 0.00 0.00 27.41 30.71 2gk3 h HIS 59 CO -0.45 0.16 -0.53 1.15 -3.07 0.00 0.00 177.93 175.18 2gk3 h THR 60 N 0.30 1.18 -0.73 6.12 2.02 -1.63 -2.46 112.91 117.71 2gk3 h THR 60 Ca 0.20 -1.96 -0.03 0.00 0.77 0.00 0.00 66.41 65.38 2gk3 h THR 60 Cb 0.39 2.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.89 2gk3 h THR 60 CO -0.04 0.52 0.32 0.58 0.37 0.00 0.00 175.52 177.27 2gk3 h VAL 61 N 0.00 1.24 -0.38 3.16 2.07 -1.29 0.06 116.25 121.12 2gk3 h VAL 61 Ca -0.01 -0.73 0.01 0.00 0.82 0.00 0.00 66.70 66.79 2gk3 h VAL 61 Cb 1.08 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2gk3 h VAL 61 CO 0.07 0.30 0.24 1.56 0.02 0.00 0.00 177.57 179.76 2gk3 h GLN 62 N 1.04 0.47 0.19 1.57 4.20 -1.34 -2.84 115.11 118.40 2gk3 h GLN 62 Ca 0.25 -0.03 -0.32 0.00 0.06 0.00 0.00 58.65 58.61 2gk3 h GLN 62 Cb 0.17 -0.11 0.02 0.00 0.30 0.00 0.00 27.48 27.86 2gk3 h GLN 62 CO -0.03 0.31 -1.47 0.82 -0.67 0.00 0.00 178.83 177.80 2gk3 h ILE 63 N 0.49 1.26 -0.00 2.54 2.04 -1.49 -2.69 117.51 119.66 2gk3 h ILE 63 Ca 0.14 -2.79 -0.15 0.00 1.00 0.00 0.00 64.86 63.06 2gk3 h ILE 63 Cb -0.03 2.92 -0.22 0.00 -0.74 0.00 0.00 36.82 38.75 2gk3 h ILE 63 CO -0.05 0.84 -0.56 0.00 0.00 0.00 0.00 178.15 178.39 2gk3 n ALA 64 N -2.68 3.26 -1.86 1.87 0.00 -0.01 -5.01 120.51 116.09 2gk3 n ALA 64 Ca -0.16 -1.28 -0.42 0.00 0.00 0.00 0.00 53.44 51.58 2gk3 n ALA 64 Cb 1.07 -0.48 -0.02 0.00 0.00 0.00 0.00 19.45 20.01 2gk3 n ALA 64 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2gk3 s PHE 65 N -0.03 2.96 0.04 0.00 5.36 -1.07 -4.84 117.98 120.39 2gk3 s PHE 65 Ca 0.12 0.86 -0.34 0.00 -0.96 0.00 0.00 56.93 56.62 2gk3 s PHE 65 Cb 0.14 -3.91 -0.12 0.00 -0.34 0.00 0.00 43.02 38.79 2gk3 s PHE 65 CO -0.06 -3.10 1.76 -2.30 -1.46 0.00 0.00 175.22 170.05 2gk3 n PRO 66 N 2.69 2.25 0.17 10.12 -0.02 -1.26 -4.91 135.00 144.03 2gk3 n PRO 66 Ca 0.09 0.82 0.04 0.00 -2.02 0.00 0.00 63.50 62.43 2gk3 n PRO 66 Cb 0.39 -2.64 0.20 0.00 -0.02 0.00 0.00 33.50 31.43 2gk3 n PRO 66 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2gk3 h GLU 67 N 7.86 0.00 -5.71 -0.52 5.08 -1.96 -3.46 114.58 115.87 2gk3 h GLU 67 Ca -0.47 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.30 2gk3 h GLU 67 Cb 1.26 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.43 2gk3 h GLU 67 CO 0.92 0.44 -0.23 0.45 -1.00 0.00 0.00 179.01 179.59 2gk3 s SER 68 N -6.43 6.61 0.33 1.42 0.15 -1.26 -4.93 113.70 109.59 2gk3 s SER 68 Ca 0.02 0.73 0.07 0.00 0.70 0.00 0.00 55.95 57.47 2gk3 s SER 68 Cb 0.09 -2.23 0.58 0.00 -1.71 0.00 0.00 66.02 62.75 2gk3 s SER 68 CO 0.71 0.12 1.79 -0.29 1.20 0.00 0.00 173.24 176.77 2gk3 h ILE 69 N 4.45 1.25 -0.28 6.45 6.09 -1.95 -2.78 117.51 130.74 2gk3 h ILE 69 Ca -0.44 -1.21 0.01 0.00 -1.37 0.00 0.00 64.86 61.85 2gk3 h ILE 69 Cb 1.18 1.47 -0.01 0.00 0.47 0.00 0.00 36.82 39.93 2gk3 h ILE 69 CO 0.72 0.37 0.19 0.44 -3.07 0.00 0.00 178.15 176.79 2gk3 h ASP 70 N 0.23 0.30 0.20 2.19 5.19 -1.98 0.73 116.42 123.28 2gk3 h ASP 70 Ca 0.03 -0.01 -0.19 0.00 -0.62 0.00 0.00 57.03 56.25 2gk3 h ASP 70 Cb 0.63 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.06 2gk3 h ASP 70 CO 0.05 0.22 -0.72 -0.08 -3.12 0.00 0.00 179.24 175.58 2gk3 h GLU 71 N 0.35 0.45 -0.04 3.56 4.81 -1.91 -2.97 114.58 118.83 2gk3 h GLU 71 Ca 0.11 -0.36 -0.16 0.00 -0.13 0.00 0.00 59.36 58.82 2gk3 h GLU 71 Cb 0.01 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2gk3 h GLU 71 CO -0.02 1.00 -0.67 -0.07 -0.73 0.00 0.00 179.01 178.51 2gk3 h LEU 72 N 0.31 0.23 -1.49 1.64 3.38 -1.19 -3.30 115.31 114.88 2gk3 h LEU 72 Ca -0.03 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2gk3 h LEU 72 Cb 1.30 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2gk3 h LEU 72 CO 0.13 0.83 0.00 0.78 0.09 0.00 0.00 178.44 180.27 2gk3 h ASN 73 N 0.14 0.00 0.46 -0.43 2.35 -0.72 -1.73 115.58 115.64 2gk3 h ASN 73 Ca -0.01 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.67 2gk3 h ASN 73 Cb 1.20 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 2gk3 h ASN 73 CO 0.10 0.00 -0.32 0.08 -1.65 0.00 0.00 177.43 175.64 2gk3 h ARG 74 N 0.00 0.00 -6.63 0.81 0.11 -1.64 -3.44 114.38 103.58 2gk3 h ARG 74 Ca 0.00 0.00 -0.51 0.00 0.10 0.00 0.00 59.98 59.57 2gk3 h ARG 74 Cb 0.13 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.18 2gk3 h ARG 74 CO 0.00 0.32 0.23 0.71 0.10 0.00 0.00 179.97 181.33 2gk3 s TYR 75 N -4.08 3.87 0.03 4.08 2.02 -0.65 -4.83 117.35 117.78 2gk3 s TYR 75 Ca -0.02 1.69 -0.10 0.00 -0.37 0.00 0.00 57.07 58.27 2gk3 s TYR 75 Cb 0.13 -2.82 -0.32 0.00 -0.40 0.00 0.00 41.96 38.56 2gk3 s TYR 75 CO 0.69 0.44 0.99 -0.44 -1.57 0.00 0.00 175.55 175.66 2gk3 h ASP 76 N 4.01 0.64 -4.45 2.29 3.32 -0.50 -3.45 116.42 118.27 2gk3 h ASP 76 Ca -0.47 -0.73 -0.32 0.00 0.02 0.00 0.00 57.03 55.53 2gk3 h ASP 76 Cb 1.20 -0.21 -0.24 0.00 0.22 0.00 0.00 39.33 40.31 2gk3 h ASP 76 CO 0.66 1.58 -0.75 -0.69 -1.72 0.00 0.00 179.24 178.32 2gk3 s VAL 77 N -2.62 0.63 -0.14 -1.35 1.01 -1.22 -1.42 120.40 115.29 2gk3 s VAL 77 Ca -0.08 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 2gk3 s VAL 77 Cb 0.05 -0.63 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 2gk3 s VAL 77 CO 0.91 -0.18 -0.09 -0.63 0.00 0.00 0.00 175.10 175.11 2gk3 s ILE 78 N -0.95 3.42 -0.18 2.22 1.01 0.10 -1.63 121.20 125.20 2gk3 s ILE 78 Ca -0.05 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 2gk3 s ILE 78 Cb -0.07 -2.46 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 2gk3 s ILE 78 CO 0.00 0.52 -0.03 -0.69 0.00 0.00 0.00 174.94 174.74 2gk3 s VAL 79 N 0.28 3.83 -0.17 2.92 1.01 0.21 -0.74 120.40 127.74 2gk3 s VAL 79 Ca -0.07 -0.37 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2gk3 s VAL 79 Cb -0.15 -2.70 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 2gk3 s VAL 79 CO 0.04 0.47 -0.10 -0.63 0.00 0.00 0.00 175.10 174.88 2gk3 s ILE 80 N 0.68 3.15 -0.10 2.22 1.01 0.11 0.45 121.20 128.72 2gk3 s ILE 80 Ca -0.02 -0.60 -0.05 0.00 0.00 0.00 0.00 60.65 59.99 2gk3 s ILE 80 Cb -0.14 -2.37 0.05 0.00 0.01 0.00 0.00 42.46 40.00 2gk3 s ILE 80 CO 0.02 0.49 0.23 -0.55 0.00 0.00 0.00 174.94 175.12 2gk3 s SER 81 N 0.85 0.07 -1.60 3.58 0.15 -0.50 -1.19 113.70 115.07 2gk3 s SER 81 Ca -0.03 0.49 -0.13 0.00 0.70 0.00 0.00 55.95 56.98 2gk3 s SER 81 Cb -0.15 0.45 0.11 0.00 -1.71 0.00 0.00 66.02 64.72 2gk3 s SER 81 CO 0.01 -0.20 0.74 0.47 1.20 0.00 0.00 173.24 175.46 2gk3 n ASP 82 N 4.70 -2.91 -3.86 5.45 8.00 -1.26 -0.92 116.55 125.76 2gk3 n ASP 82 Ca -0.17 -0.97 -0.22 0.00 0.71 0.00 0.00 54.79 54.14 2gk3 n ASP 82 Cb 0.51 -3.04 -0.17 0.00 -0.02 0.00 0.00 41.12 38.40 2gk3 n ASP 82 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2gk3 s ILE 83 N -3.44 0.58 0.78 0.53 2.07 -1.01 -4.05 121.20 116.65 2gk3 s ILE 83 Ca 0.56 -0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.60 2gk3 s ILE 83 Cb -0.30 -0.64 0.06 0.00 0.13 0.00 0.00 42.46 41.71 2gk3 s ILE 83 CO 0.90 0.26 1.10 -0.83 -1.91 0.00 0.00 174.94 174.46 2gk3 s GLY 84 N 1.33 1.62 0.39 1.50 0.00 -1.07 -4.65 107.32 106.44 2gk3 s GLY 84 Ca -0.04 -0.24 0.08 0.00 0.00 0.00 0.00 44.72 44.52 2gk3 s GLY 84 CO -0.02 0.17 1.96 1.48 0.00 0.00 0.00 173.10 176.69 2gk3 h SER 85 N -0.99 0.35 -0.60 1.64 4.64 -1.59 -2.62 113.55 114.37 2gk3 h SER 85 Ca -0.46 -0.05 0.06 0.00 -0.47 0.00 0.00 61.79 60.87 2gk3 h SER 85 Cb 1.27 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.23 2gk3 h SER 85 CO 0.60 0.39 0.40 0.78 -0.87 0.00 0.00 176.83 178.14 2gk3 h ASN 86 N 0.37 0.51 -0.38 4.97 2.35 -1.86 -1.01 115.58 120.52 2gk3 h ASN 86 Ca 0.09 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 2gk3 h ASN 86 Cb 0.22 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2gk3 h ASN 86 CO 0.00 0.33 0.11 0.74 -1.65 0.00 0.00 177.43 176.97 2gk3 h THR 87 N 0.58 1.22 -0.31 2.81 2.02 -1.79 0.21 112.91 117.64 2gk3 h THR 87 Ca 0.26 -0.72 -0.06 0.00 0.77 0.00 0.00 66.41 66.66 2gk3 h THR 87 Cb 0.29 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 2gk3 h THR 87 CO -0.08 0.25 -0.06 -0.26 0.37 0.00 0.00 175.52 175.75 2gk3 h PHE 88 N 0.48 0.65 -0.03 3.16 -1.00 -1.53 -3.28 116.94 115.38 2gk3 h PHE 88 Ca 0.12 -0.13 -0.19 0.00 2.81 0.00 0.00 57.97 60.58 2gk3 h PHE 88 Cb 0.27 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 2gk3 h PHE 88 CO 0.01 0.76 -0.81 -0.07 -1.61 0.00 0.00 178.31 176.59 2gk3 h LEU 89 N 0.36 0.36 -4.76 1.54 3.38 -1.08 -3.38 115.31 111.72 2gk3 h LEU 89 Ca 0.08 -0.26 -0.60 0.00 0.09 0.00 0.00 57.88 57.19 2gk3 h LEU 89 Cb 0.54 -0.11 -0.41 0.00 0.09 0.00 0.00 40.66 40.77 2gk3 h LEU 89 CO 0.03 1.02 -0.60 0.18 0.09 0.00 0.00 178.44 179.16 2gk3 n LEU 90 N -3.75 4.82 -4.60 1.67 4.77 0.73 -4.96 117.00 115.68 2gk3 n LEU 90 Ca -0.04 -5.33 -0.34 0.00 -0.03 0.00 0.00 56.01 50.27 2gk3 n LEU 90 Cb 0.76 -0.52 0.11 0.00 -2.33 0.00 0.00 43.42 41.44 2gk3 n LEU 90 CO 0.48 2.25 0.49 0.00 -1.33 0.00 0.00 177.39 179.28 2gk3 n GLN 91 N -0.42 0.14 -0.34 3.23 6.02 -1.24 -4.58 117.38 120.20 2gk3 n GLN 91 Ca 0.38 0.11 0.12 0.00 -0.01 0.00 0.00 57.00 57.60 2gk3 n GLN 91 Cb 0.57 -2.23 0.30 0.00 1.02 0.00 0.00 30.24 29.90 2gk3 n GLN 91 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2gk3 h ASN 92 N -0.88 0.71 0.18 1.08 4.21 -1.82 -0.24 115.58 118.82 2gk3 h ASN 92 Ca -0.46 0.10 -0.07 0.00 1.21 0.00 0.00 56.30 57.08 2gk3 h ASN 92 Cb 1.31 -0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 38.47 2gk3 h ASN 92 CO 0.44 0.25 -0.27 -0.33 -1.29 0.00 0.00 177.43 176.22 2gk3 h GLU 93 N 0.71 0.15 0.09 0.81 5.08 -1.91 -0.60 114.58 118.91 2gk3 h GLU 93 Ca 0.56 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.86 2gk3 h GLU 93 Cb 0.87 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2gk3 h GLU 93 CO -0.39 0.42 -0.04 1.15 -1.00 0.00 0.00 179.01 179.14 2gk3 h THR 94 N 0.14 1.09 0.00 1.13 2.02 -1.31 -2.32 112.91 113.66 2gk3 h THR 94 Ca 0.02 -1.37 -0.23 0.00 0.77 0.00 0.00 66.41 65.60 2gk3 h THR 94 Cb 0.55 1.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.81 2gk3 h THR 94 CO 0.04 0.30 -1.20 0.15 0.37 0.00 0.00 175.52 175.18 2gk3 h PHE 95 N -0.83 0.00 0.00 3.16 3.57 -1.13 -3.37 116.94 118.35 2gk3 h PHE 95 Ca -0.01 0.00 -0.27 0.00 3.53 0.00 0.00 57.97 61.22 2gk3 h PHE 95 Cb 0.59 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.28 2gk3 h PHE 95 CO 0.12 0.96 -2.01 0.66 -2.23 0.00 0.00 178.31 175.81 2gk3 n TYR 96 N -3.23 0.00 -0.01 0.41 4.01 -0.24 -4.81 117.16 113.28 2gk3 n TYR 96 Ca -0.05 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.79 2gk3 n TYR 96 Cb 0.96 -0.70 0.22 0.00 -0.31 0.00 0.00 39.34 39.51 2gk3 n TYR 96 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2gk3 n GLN 97 N -2.84 2.50 -1.84 -0.72 6.02 -1.14 -4.98 117.38 114.38 2gk3 n GLN 97 Ca -0.29 -2.26 -0.20 0.00 -0.01 0.00 0.00 57.00 54.24 2gk3 n GLN 97 Cb 0.88 -1.45 -0.06 0.00 1.02 0.00 0.00 30.24 30.63 2gk3 n GLN 97 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2gk3 n LEU 98 N 1.25 -1.60 -4.89 1.08 4.77 -1.15 -4.97 117.00 111.50 2gk3 n LEU 98 Ca 0.18 0.33 -0.31 0.00 -0.03 0.00 0.00 56.01 56.18 2gk3 n LEU 98 Cb 0.54 -2.78 -0.05 0.00 -2.33 0.00 0.00 43.42 38.81 2gk3 n LEU 98 CO 0.14 -0.77 0.14 -0.54 -1.33 0.00 0.00 177.39 175.02 2gk3 s LYS 99 N -4.11 3.69 0.27 3.23 -0.14 -0.89 -5.05 119.74 116.75 2gk3 s LYS 99 Ca 0.00 0.06 -0.16 0.00 -1.36 0.00 0.00 55.97 54.52 2gk3 s LYS 99 Cb 0.00 -2.72 -0.08 0.00 -1.68 0.00 0.00 37.83 33.34 2gk3 s LYS 99 CO 0.00 0.35 0.70 0.42 -0.76 0.00 0.00 175.35 176.06 2gk3 s ILE 100 N -1.82 4.69 -0.13 2.17 1.09 -1.26 -4.41 121.20 121.53 2gk3 s ILE 100 Ca 0.44 0.98 -0.25 0.00 -1.10 0.00 0.00 60.65 60.72 2gk3 s ILE 100 Cb -0.11 -3.69 0.06 0.00 -1.06 0.00 0.00 42.46 37.66 2gk3 s ILE 100 CO 0.25 -0.03 0.62 -0.75 -0.10 0.00 0.00 174.94 174.92 2gk3 s LYS 101 N -2.61 0.88 0.49 2.79 2.47 -1.26 -5.03 119.74 117.47 2gk3 s LYS 101 Ca 0.49 0.47 -0.22 0.00 -1.56 0.00 0.00 55.97 55.16 2gk3 s LYS 101 Cb -0.12 0.42 -0.07 0.00 -1.46 0.00 0.00 37.83 36.60 2gk3 s LYS 101 CO 0.19 -0.21 1.18 -2.14 0.16 0.00 0.00 175.35 174.53 2gk3 s PRO 102 N -0.55 3.56 -0.36 4.03 0.02 -1.26 -4.94 135.00 135.49 2gk3 s PRO 102 Ca -0.07 1.80 -0.29 0.00 0.02 0.00 0.00 61.00 62.47 2gk3 s PRO 102 Cb -0.03 -2.28 0.02 0.00 0.02 0.00 0.00 34.50 32.23 2gk3 s PRO 102 CO 0.05 -0.73 1.14 1.21 -0.33 0.00 0.00 177.00 178.35 2gk3 s ASN 103 N -1.40 6.79 0.41 2.53 3.84 -1.26 -4.92 114.94 120.93 2gk3 s ASN 103 Ca 0.67 0.91 0.10 0.00 0.21 0.00 0.00 52.86 54.75 2gk3 s ASN 103 Cb -0.29 -2.54 0.86 0.00 -0.55 0.00 0.00 41.25 38.73 2gk3 s ASN 103 CO 0.35 -1.03 1.98 0.00 -2.79 0.00 0.00 177.10 175.60 2gk3 h ALA 104 N 8.68 1.62 0.06 1.71 0.00 -1.93 -0.60 119.26 128.80 2gk3 h ALA 104 Ca -0.22 -0.14 -0.24 0.00 0.00 0.00 0.00 54.91 54.31 2gk3 h ALA 104 Cb 1.07 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2gk3 h ALA 104 CO 1.06 0.29 -1.08 -0.07 0.00 0.00 0.00 179.25 179.45 2gk3 h LEU 105 N 0.27 0.37 -0.53 0.00 3.38 -1.91 -1.28 115.31 115.62 2gk3 h LEU 105 Ca 0.06 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.69 2gk3 h LEU 105 Cb 0.22 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2gk3 h LEU 105 CO 0.01 1.23 0.34 -0.33 0.09 0.00 0.00 178.44 179.77 2gk3 h GLU 106 N 0.11 0.66 -0.11 1.13 4.39 -1.72 -0.47 114.58 118.56 2gk3 h GLU 106 Ca -0.09 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.59 2gk3 h GLU 106 Cb 1.77 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 30.25 2gk3 h GLU 106 CO 0.17 0.44 -0.02 0.77 -1.16 0.00 0.00 179.01 179.22 2gk3 h SER 107 N 0.68 -0.08 -0.76 1.42 0.02 -0.95 0.63 113.55 114.51 2gk3 h SER 107 Ca 0.20 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.20 2gk3 h SER 107 Cb -0.04 0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.52 2gk3 h SER 107 CO -0.06 -0.03 0.50 0.40 -1.14 0.00 0.00 176.83 176.50 2gk3 h ILE 108 N 0.01 1.16 0.13 3.27 2.04 -1.16 -0.23 117.51 122.72 2gk3 h ILE 108 Ca 0.05 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.58 2gk3 h ILE 108 Cb 0.08 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.22 2gk3 h ILE 108 CO -0.11 0.18 -0.15 0.50 0.00 0.00 0.00 178.15 178.58 2gk3 h LYS 109 N 0.99 -0.30 -0.89 2.37 3.64 -0.23 -1.27 116.57 120.88 2gk3 h LYS 109 Ca 0.29 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.71 2gk3 h LYS 109 Cb -0.05 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 2gk3 h LYS 109 CO -0.09 -0.20 0.59 0.93 -2.27 0.00 0.00 179.45 178.41 2gk3 h GLU 110 N -0.31 1.14 -0.66 1.90 4.39 -0.61 0.84 114.58 121.26 2gk3 h GLU 110 Ca 0.01 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.66 2gk3 h GLU 110 Cb 0.31 -0.26 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 2gk3 h GLU 110 CO -0.05 0.75 0.42 -0.92 -1.16 0.00 0.00 179.01 178.05 2gk3 h TYR 111 N 1.17 0.79 -0.15 4.33 3.20 -0.82 -1.41 116.97 124.07 2gk3 h TYR 111 Ca 0.33 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.20 2gk3 h TYR 111 Cb -0.09 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 37.92 2gk3 h TYR 111 CO -0.00 0.47 -0.02 0.28 -1.64 0.00 0.00 178.16 177.25 2gk3 h VAL 112 N 0.83 1.27 -1.01 1.81 2.07 -0.48 0.77 116.25 121.51 2gk3 h VAL 112 Ca 0.26 -0.91 0.24 0.00 0.82 0.00 0.00 66.70 67.11 2gk3 h VAL 112 Cb -0.02 1.56 -0.11 0.00 -1.52 0.00 0.00 31.29 31.20 2gk3 h VAL 112 CO -0.09 0.27 0.62 0.11 0.02 0.00 0.00 177.57 178.51 2gk3 h LYS 113 N 0.01 0.54 -0.62 1.57 1.57 -0.56 0.17 116.57 119.25 2gk3 h LYS 113 Ca 0.04 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2gk3 h LYS 113 Cb 0.42 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2gk3 h LYS 113 CO 0.01 0.35 0.00 0.09 -0.57 0.00 0.00 179.45 179.34 2gk3 n ASN 114 N -4.75 3.66 0.00 0.86 5.03 -0.56 -1.45 115.26 118.05 2gk3 n ASN 114 Ca 0.25 -2.33 0.00 0.00 0.87 0.00 0.00 54.58 53.37 2gk3 n ASN 114 Cb 0.75 -0.50 0.00 0.00 -1.02 0.00 0.00 39.78 39.01 2gk3 n ASN 114 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2gk3 n GLY 115 N 0.92 1.16 3.73 7.41 0.00 -0.16 -4.87 105.19 113.37 2gk3 n GLY 115 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 2gk3 n GLY 115 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gk3 s GLY 116 N -1.89 2.43 0.13 -0.02 0.00 0.25 -3.97 107.32 104.24 2gk3 s GLY 116 Ca 0.00 0.90 -0.03 0.00 0.00 0.00 0.00 44.72 45.59 2gk3 s GLY 116 CO 0.00 1.30 0.33 -0.32 0.00 0.00 0.00 173.10 174.41 2gk3 s GLY 117 N -1.96 2.16 -0.06 0.20 0.00 -0.51 -2.95 107.32 104.20 2gk3 s GLY 117 Ca 0.75 -0.68 -0.00 0.00 0.00 0.00 0.00 44.72 44.78 2gk3 s GLY 117 CO 0.43 -0.63 -0.01 -2.27 0.00 0.00 0.00 173.10 170.62 2gk3 s LEU 118 N -2.71 0.93 0.00 0.66 2.96 -0.75 0.03 118.68 119.80 2gk3 s LEU 118 Ca 0.39 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.21 2gk3 s LEU 118 Cb -0.12 -0.41 -0.00 0.00 0.50 0.00 0.00 46.19 46.16 2gk3 s LEU 118 CO 0.26 -0.13 0.00 -0.11 -1.32 0.00 0.00 176.35 175.05 2gk3 n LEU 119 N 4.62 0.00 -3.64 -0.68 7.94 0.09 -1.19 117.00 124.13 2gk3 n LEU 119 Ca -0.16 -0.42 -0.06 0.00 -1.11 0.00 0.00 56.01 54.25 2gk3 n LEU 119 Cb 0.50 0.05 -0.07 0.00 0.53 0.00 0.00 43.42 44.44 2gk3 n LEU 119 CO 0.17 -0.06 0.65 -0.63 -1.11 0.00 0.00 177.39 176.40 2gk3 s ILE 121 N -1.28 0.00 0.84 1.96 1.01 -0.33 -0.71 121.20 122.69 2gk3 s ILE 121 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 60.65 60.55 2gk3 s ILE 121 Cb 0.00 -1.00 0.10 0.00 0.01 0.00 0.00 42.46 41.57 2gk3 s ILE 121 CO 0.00 0.00 1.10 -0.83 0.00 0.00 0.00 174.94 175.21 2gk3 s GLY 122 N 0.85 1.66 0.00 6.18 0.00 0.14 -4.10 107.32 112.06 2gk3 s GLY 122 Ca -0.03 0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.94 2gk3 s GLY 122 CO -0.11 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.26 2gk3 n GLY 123 N -0.82 -2.13 0.18 0.20 0.00 -1.26 -3.65 105.19 97.71 2gk3 n GLY 123 Ca 0.09 -1.26 0.01 0.00 0.00 0.00 0.00 46.02 44.86 2gk3 n GLY 123 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2gk3 h TYR 124 N 0.00 0.05 -0.38 1.61 -1.99 -1.96 -2.85 116.97 111.45 2gk3 h TYR 124 Ca 0.00 -0.01 -0.19 0.00 2.00 0.00 0.00 58.73 60.53 2gk3 h TYR 124 Cb 0.00 -0.01 -0.11 0.00 2.00 0.00 0.00 36.73 38.61 2gk3 h TYR 124 CO 0.00 0.44 -0.03 1.28 -0.00 0.00 0.00 178.16 179.85 2gk3 n LEU 125 N -4.06 4.27 -4.55 3.88 4.32 -1.26 -1.06 117.00 118.54 2gk3 n LEU 125 Ca -0.02 -3.71 -0.24 0.00 -0.02 0.00 0.00 56.01 52.03 2gk3 n LEU 125 Cb 0.44 -0.64 -0.09 0.00 -1.62 0.00 0.00 43.42 41.51 2gk3 n LEU 125 CO 0.40 1.20 -0.40 -0.44 -1.22 0.00 0.00 177.39 176.92 2gk3 s SER 126 N -2.41 4.02 0.00 -1.43 0.01 -1.08 -2.40 113.70 110.41 2gk3 s SER 126 Ca 0.45 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 56.84 2gk3 s SER 126 Cb 0.41 -0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2gk3 s SER 126 CO 0.01 0.00 0.00 0.49 0.41 0.00 0.00 173.24 174.15 2gk3 n PHE 127 N -0.76 0.00 -2.00 2.43 3.72 -1.26 -4.65 117.46 114.94 2gk3 n PHE 127 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 2gk3 n PHE 127 Cb 0.60 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.14 2gk3 n PHE 127 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gk3 n GLY 129 N 0.00 0.07 3.71 1.37 0.00 -1.26 -1.69 105.19 107.39 2gk3 n GLY 129 Ca 0.00 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 2gk3 n GLY 129 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2gk3 s ILE 130 N -2.80 2.54 -1.21 -0.61 2.07 -0.22 -1.14 121.20 119.83 2gk3 s ILE 130 Ca 0.00 0.30 0.00 0.00 -1.41 0.00 0.00 60.65 59.54 2gk3 s ILE 130 Cb 0.00 -3.19 0.00 0.00 0.13 0.00 0.00 42.46 39.40 2gk3 s ILE 130 CO 0.00 0.02 0.00 -0.62 -1.91 0.00 0.00 174.94 172.43 2gk3 n GLU 131 N 4.47 -1.32 -1.98 3.50 1.02 -1.26 -1.92 120.64 123.15 2gk3 n GLU 131 Ca 0.15 0.68 -0.17 0.00 -0.02 0.00 0.00 57.16 57.79 2gk3 n GLU 131 Cb 0.38 -4.92 -0.04 0.00 -0.02 0.00 0.00 31.44 26.85 2gk3 n GLU 131 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gk3 n ALA 132 N 0.15 -0.41 0.06 0.62 0.00 -0.29 -4.73 120.51 115.91 2gk3 n ALA 132 Ca -0.12 0.20 -0.05 0.00 0.00 0.00 0.00 53.44 53.47 2gk3 n ALA 132 Cb 0.40 -1.87 0.14 0.00 0.00 0.00 0.00 19.45 18.12 2gk3 n ALA 132 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2gk3 h LYS 133 N 0.00 0.35 -0.57 0.00 1.57 -1.58 -2.90 116.57 113.44 2gk3 h LYS 133 Ca -0.39 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.16 2gk3 h LYS 133 Cb 1.23 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.53 2gk3 h LYS 133 CO 0.50 0.77 0.24 0.00 -0.57 0.00 0.00 179.45 180.40 2gk3 h ALA 134 N 1.19 1.36 -1.88 3.86 0.00 -1.80 -3.43 119.26 118.57 2gk3 h ALA 134 Ca 0.01 -0.14 -0.39 0.00 0.00 0.00 0.00 54.91 54.39 2gk3 h ALA 134 Cb 0.98 -0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.44 2gk3 h ALA 134 CO 0.08 0.49 -0.41 -1.71 0.00 0.00 0.00 179.25 177.70 2gk3 n ASN 135 N -4.34 -5.23 0.29 0.00 5.15 -1.10 -1.68 115.26 108.35 2gk3 n ASN 135 Ca 0.05 0.30 0.16 0.00 -0.60 0.00 0.00 54.58 54.49 2gk3 n ASN 135 Cb 0.15 -4.54 0.86 0.00 -0.53 0.00 0.00 39.78 35.72 2gk3 n ASN 135 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 2gk3 h TYR 136 N 0.00 0.00 0.00 1.20 -1.99 -1.65 -2.73 116.97 111.79 2gk3 h TYR 136 Ca -0.42 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.24 2gk3 h TYR 136 Cb 1.28 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.00 2gk3 h TYR 136 CO 0.56 0.06 -0.33 -0.22 -0.00 0.00 0.00 178.16 178.23 2gk3 h LYS 137 N 0.00 0.00 -0.78 4.88 3.64 -1.89 -2.50 116.57 119.91 2gk3 h LYS 137 Ca -0.00 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 2gk3 h LYS 137 Cb 0.25 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 31.97 2gk3 h LYS 137 CO 0.01 0.33 0.22 0.09 -2.27 0.00 0.00 179.45 177.83 2gk3 n ASN 138 N -3.97 4.53 -4.43 4.20 3.02 -1.03 -4.74 115.26 112.83 2gk3 n ASN 138 Ca -0.02 -3.02 -0.21 0.00 -0.03 0.00 0.00 54.58 51.30 2gk3 n ASN 138 Cb 0.39 -0.71 -0.10 0.00 -0.61 0.00 0.00 39.78 38.75 2gk3 n ASN 138 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2gk3 s THR 139 N -2.63 1.69 -1.61 3.41 -4.23 -0.94 -5.02 115.64 106.30 2gk3 s THR 139 Ca 0.48 -2.14 0.10 0.00 -1.18 0.00 0.00 61.69 58.95 2gk3 s THR 139 Cb 0.38 -2.44 0.21 0.00 1.34 0.00 0.00 72.50 71.99 2gk3 s THR 139 CO 0.12 -0.31 1.16 1.33 -0.54 0.00 0.00 174.62 176.38 2gk3 n VAL 140 N -0.58 0.52 0.11 2.29 0.24 -1.26 -2.33 118.33 117.31 2gk3 n VAL 140 Ca -0.05 0.13 0.08 0.00 -2.04 0.00 0.00 64.34 62.46 2gk3 n VAL 140 Cb 0.63 -0.97 0.01 0.00 -1.47 0.00 0.00 33.84 32.04 2gk3 n VAL 140 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 2gk3 h LEU 141 N 0.00 0.00 -0.69 1.34 5.85 -1.87 -3.38 115.31 116.56 2gk3 h LEU 141 Ca 0.00 0.00 0.14 0.00 0.84 0.00 0.00 57.88 58.86 2gk3 h LEU 141 Cb 0.06 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 40.99 2gk3 h LEU 141 CO 0.00 0.17 0.16 0.00 -0.34 0.00 0.00 178.44 178.43 2gk3 h ALA 142 N 1.83 0.86 0.00 1.25 0.00 -1.53 -0.92 119.26 120.76 2gk3 h ALA 142 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2gk3 h ALA 142 Cb 1.17 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.17 2gk3 h ALA 142 CO 0.02 -0.32 0.00 0.93 0.00 0.00 0.00 179.25 179.87 2gk3 h GLU 143 N 0.27 0.00 0.00 0.00 4.39 -1.81 -2.41 114.58 115.02 2gk3 h GLU 143 Ca 0.38 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.88 2gk3 h GLU 143 Cb 0.62 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 2gk3 h GLU 143 CO -0.48 0.00 -1.04 0.28 -1.16 0.00 0.00 179.01 176.62 2gk3 h VAL 144 N 0.00 1.35 -3.95 3.13 2.07 -1.40 -3.47 116.25 113.98 2gk3 h VAL 144 Ca 0.00 -3.00 -0.46 0.00 0.82 0.00 0.00 66.70 64.06 2gk3 h VAL 144 Cb 0.20 2.65 -0.02 0.00 -1.52 0.00 0.00 31.29 32.60 2gk3 h VAL 144 CO 0.00 0.77 0.30 -0.76 0.02 0.00 0.00 177.57 177.90 2gk3 s LEU 145 N -6.51 4.08 -0.03 2.57 1.43 -0.91 -4.79 118.68 114.52 2gk3 s LEU 145 Ca 0.00 1.66 0.04 0.00 -1.03 0.00 0.00 54.13 54.80 2gk3 s LEU 145 Cb 0.09 -4.30 0.16 0.00 0.03 0.00 0.00 46.19 42.17 2gk3 s LEU 145 CO 0.81 -0.25 0.90 -0.81 0.23 0.00 0.00 176.35 177.23 2gk3 n PRO 146 N -0.23 1.64 -4.29 1.29 -0.04 -1.26 -4.82 135.00 127.30 2gk3 n PRO 146 Ca 0.05 -0.63 -0.17 0.00 -0.04 0.00 0.00 63.50 62.72 2gk3 n PRO 146 Cb 0.53 -1.45 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 2gk3 n PRO 146 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2gk3 s VAL 147 N -1.54 1.43 0.53 0.52 -7.23 -1.26 -1.44 120.40 111.41 2gk3 s VAL 147 Ca 0.11 -2.06 0.06 0.00 -1.81 0.00 0.00 61.98 58.28 2gk3 s VAL 147 Cb 0.07 -1.87 0.03 0.00 0.56 0.00 0.00 36.38 35.17 2gk3 s VAL 147 CO 0.05 -0.63 0.40 -0.63 -0.31 0.00 0.00 175.10 173.98 2gk3 s ILE 148 N -2.98 1.75 0.42 -0.62 1.01 0.25 -4.80 121.20 116.24 2gk3 s ILE 148 Ca 0.18 -1.48 0.08 0.00 0.00 0.00 0.00 60.65 59.43 2gk3 s ILE 148 Cb -0.00 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 2gk3 s ILE 148 CO 0.03 0.00 0.42 -0.76 0.00 0.00 0.00 174.94 174.64 2gk3 s LEU 150 N -4.27 3.43 0.00 2.97 1.43 -1.26 -1.26 118.68 119.72 2gk3 s LEU 150 Ca 0.36 -0.69 0.26 0.00 -1.03 0.00 0.00 54.13 53.02 2gk3 s LEU 150 Cb -0.02 -2.15 0.62 0.00 0.03 0.00 0.00 46.19 44.67 2gk3 s LEU 150 CO 0.22 -0.70 1.50 0.47 0.23 0.00 0.00 176.35 178.07 2gk3 n ASP 151 N -1.63 0.42 0.00 2.29 8.00 -1.26 -4.94 116.55 119.43 2gk3 n ASP 151 Ca 0.05 -0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.43 2gk3 n ASP 151 Cb 0.61 0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.84 2gk3 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gk3 n GLY 152 N 1.50 5.49 3.65 0.44 0.00 -1.26 -5.06 105.19 109.94 2gk3 n GLY 152 Ca 0.06 -1.38 -0.48 0.00 0.00 0.00 0.00 46.02 44.22 2gk3 n GLY 152 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gk3 n ASP 153 N 0.00 2.73 -0.13 1.61 -0.08 -1.26 -4.65 116.55 114.77 2gk3 n ASP 153 Ca 0.00 1.08 0.02 0.00 -1.51 0.00 0.00 54.79 54.37 2gk3 n ASP 153 Cb 0.00 -1.34 0.04 0.00 2.34 0.00 0.00 41.12 42.15 2gk3 n ASP 153 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2gk3 n ASP 154 N 3.70 2.20 -4.76 1.67 5.75 -1.23 -4.95 116.55 118.94 2gk3 n ASP 154 Ca 0.19 -2.08 -0.41 0.00 -0.01 0.00 0.00 54.79 52.48 2gk3 n ASP 154 Cb 0.25 -0.07 -0.03 0.00 -1.03 0.00 0.00 41.12 40.25 2gk3 n ASP 154 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2gk3 s ARG 155 N -1.13 4.42 -0.28 0.11 0.52 -1.26 0.54 118.95 121.86 2gk3 s ARG 155 Ca 0.06 2.09 -0.02 0.00 -0.52 0.00 0.00 55.73 57.34 2gk3 s ARG 155 Cb 0.04 -3.13 0.04 0.00 0.52 0.00 0.00 34.95 32.41 2gk3 s ARG 155 CO 0.03 -0.14 -0.02 0.08 0.02 0.00 0.00 175.30 175.27 2gk3 s VAL 156 N -0.69 3.00 -0.19 3.52 1.01 0.13 -4.85 120.40 122.33 2gk3 s VAL 156 Ca 0.51 -1.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 2gk3 s VAL 156 Cb -0.37 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 2gk3 s VAL 156 CO 0.46 0.03 0.51 -1.61 0.00 0.00 0.00 175.10 174.48 2gk3 s GLU 157 N 1.30 4.20 -0.57 2.72 0.41 -1.26 -1.51 118.70 123.99 2gk3 s GLU 157 Ca -0.03 0.40 0.06 0.00 -0.41 0.00 0.00 54.97 55.00 2gk3 s GLU 157 Cb -0.18 -3.55 0.24 0.00 -1.78 0.00 0.00 34.13 28.86 2gk3 s GLU 157 CO -0.02 -0.11 0.64 1.63 -0.49 0.00 0.00 175.26 176.91 2gk3 n LYS 158 N 4.66 1.85 -0.07 1.61 4.76 0.27 -4.94 118.16 126.30 2gk3 n LYS 158 Ca -0.05 -4.19 0.25 0.00 -2.87 0.00 0.00 58.31 51.45 2gk3 n LYS 158 Cb 0.51 -1.95 0.72 0.00 -1.84 0.00 0.00 35.03 32.47 2gk3 n LYS 158 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2gk3 h PRO 159 N 4.32 0.00 0.00 1.97 0.13 -1.93 0.29 132.00 136.78 2gk3 h PRO 159 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2gk3 h PRO 159 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2gk3 h PRO 159 CO 0.70 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.40 2gk3 h GLU 160 N 0.00 0.00 0.00 0.86 3.07 -1.93 -3.49 114.58 113.09 2gk3 h GLU 160 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 2gk3 h GLU 160 Cb 1.42 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.33 2gk3 h GLU 160 CO -0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 2gk3 n GLY 161 N 1.09 -1.88 3.00 -3.84 0.00 0.10 -5.07 105.19 98.60 2gk3 n GLY 161 Ca 0.05 -1.31 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 2gk3 n GLY 161 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gk3 s ILE 162 N -2.55 0.09 0.31 -0.61 -5.25 -0.44 -4.92 121.20 107.84 2gk3 s ILE 162 Ca 0.00 -0.75 -0.08 0.00 -0.99 0.00 0.00 60.65 58.83 2gk3 s ILE 162 Cb 0.00 -0.27 -0.06 0.00 2.95 0.00 0.00 42.46 45.08 2gk3 s ILE 162 CO 0.00 -0.41 0.63 0.00 -1.79 0.00 0.00 174.94 173.37 2gk3 s ALA 164 N -2.11 2.55 0.00 0.00 0.00 -0.97 -4.51 121.76 116.71 2gk3 s ALA 164 Ca 0.48 0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.69 2gk3 s ALA 164 Cb -0.11 -3.23 -0.00 0.00 0.00 0.00 0.00 23.12 19.78 2gk3 s ALA 164 CO 0.28 -1.30 -0.03 -1.21 0.00 0.00 0.00 175.76 173.50 2gk3 s GLU 165 N -4.70 0.22 -0.21 0.00 2.02 0.01 -4.78 118.70 111.26 2gk3 s GLU 165 Ca 0.61 -0.16 -0.24 0.00 0.02 0.00 0.00 54.97 55.20 2gk3 s GLU 165 Cb -0.16 -0.18 -0.01 0.00 0.10 0.00 0.00 34.13 33.88 2gk3 s GLU 165 CO 0.50 0.05 0.77 0.00 0.02 0.00 0.00 175.26 176.60 2gk3 s ALA 166 N -0.23 3.57 -0.43 5.21 0.00 -1.26 -0.42 121.76 128.21 2gk3 s ALA 166 Ca -0.01 -0.12 0.20 0.00 0.00 0.00 0.00 51.96 52.03 2gk3 s ALA 166 Cb -0.02 -3.18 -0.27 0.00 0.00 0.00 0.00 23.12 19.65 2gk3 s ALA 166 CO -0.00 -0.73 0.62 1.33 0.00 0.00 0.00 175.76 176.97 2gk3 n VAL 167 N 4.93 0.00 -3.32 0.00 0.24 -0.45 -4.56 118.33 115.17 2gk3 n VAL 167 Ca 0.03 -0.27 -0.25 0.00 -2.04 0.00 0.00 64.34 61.81 2gk3 n VAL 167 Cb 0.49 0.47 -0.08 0.00 -1.47 0.00 0.00 33.84 33.25 2gk3 n VAL 167 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2gk3 n SER 168 N -1.87 1.51 0.00 -1.34 7.64 -0.90 -4.98 113.62 113.68 2gk3 n SER 168 Ca -0.00 -2.95 0.06 0.00 1.01 0.00 0.00 58.87 56.98 2gk3 n SER 168 Cb 0.43 -0.65 0.26 0.00 -1.01 0.00 0.00 64.21 63.24 2gk3 n SER 168 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2gk3 n PRO 169 N 1.35 0.03 0.00 1.43 -0.04 -1.26 -1.54 135.00 134.97 2gk3 n PRO 169 Ca 0.25 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 64.10 2gk3 n PRO 169 Cb 0.48 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.67 2gk3 n PRO 169 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2gk3 n GLU 170 N -1.46 0.52 -1.75 0.54 -0.00 -1.26 -3.61 120.64 113.62 2gk3 n GLU 170 Ca 0.03 -0.35 -0.42 0.00 -0.00 0.00 0.00 57.16 56.43 2gk3 n GLU 170 Cb 0.13 -1.49 -0.02 0.00 -0.00 0.00 0.00 31.44 30.05 2gk3 n GLU 170 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 2gk3 s HIS 171 N -2.71 2.83 0.35 -1.84 2.46 -0.59 -4.70 115.29 111.09 2gk3 s HIS 171 Ca 0.17 0.55 0.16 0.00 0.47 0.00 0.00 55.06 56.42 2gk3 s HIS 171 Cb 0.18 -4.11 1.17 0.00 -0.13 0.00 0.00 32.58 29.70 2gk3 s HIS 171 CO 0.62 -3.98 1.63 -1.35 -2.47 0.00 0.00 174.74 169.20 2gk3 h PRO 172 N 5.89 0.19 -0.56 2.88 0.11 -1.91 0.49 132.00 139.08 2gk3 h PRO 172 Ca -0.45 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 2gk3 h PRO 172 Cb 1.21 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2gk3 h PRO 172 CO 0.88 0.12 0.09 0.28 -0.21 0.00 0.00 178.00 179.16 2gk3 h VAL 173 N 0.19 1.24 -0.01 3.15 2.07 -1.89 -3.28 116.25 117.73 2gk3 h VAL 173 Ca 0.77 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2gk3 h VAL 173 Cb 1.87 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 2gk3 h VAL 173 CO -0.68 0.34 -0.19 1.33 0.02 0.00 0.00 177.57 178.39 2gk3 n VAL 174 N -4.24 0.00 -1.65 2.57 0.24 -0.61 -4.72 118.33 109.91 2gk3 n VAL 174 Ca 0.04 -0.40 -0.51 0.00 -2.04 0.00 0.00 64.34 61.43 2gk3 n VAL 174 Cb 0.26 1.09 -0.05 0.00 -1.47 0.00 0.00 33.84 33.67 2gk3 n VAL 174 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2gk3 n ASN 175 N -0.39 2.57 0.00 -1.34 5.15 0.06 -1.48 115.26 119.83 2gk3 n ASN 175 Ca 0.03 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 55.08 2gk3 n ASN 175 Cb 0.17 -1.29 0.00 0.00 -0.53 0.00 0.00 39.78 38.13 2gk3 n ASN 175 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2gk3 n GLY 176 N 3.47 0.83 3.79 8.20 0.00 -1.26 -5.04 105.19 115.18 2gk3 n GLY 176 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 2gk3 n GLY 176 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gk3 s PHE 177 N -2.28 2.86 0.25 1.61 0.40 -0.55 -5.05 117.98 115.22 2gk3 s PHE 177 Ca 0.00 1.53 -0.15 0.00 -0.60 0.00 0.00 56.93 57.71 2gk3 s PHE 177 Cb 0.00 -3.09 0.00 0.00 0.51 0.00 0.00 43.02 40.44 2gk3 s PHE 177 CO 0.00 -1.26 0.54 -1.54 0.70 0.00 0.00 175.22 173.66 2gk3 s SER 178 N -2.48 -0.14 -1.19 1.36 1.04 -1.26 -4.99 113.70 106.04 2gk3 s SER 178 Ca 0.66 -0.83 -0.11 0.00 0.48 0.00 0.00 55.95 56.15 2gk3 s SER 178 Cb -0.18 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 2gk3 s SER 178 CO 0.34 -1.19 0.75 -0.67 0.98 0.00 0.00 173.24 173.46 2gk3 n ASP 179 N -0.40 -3.93 -4.73 7.02 2.03 -1.26 -4.87 116.55 110.40 2gk3 n ASP 179 Ca -0.03 -0.91 -0.42 0.00 0.52 0.00 0.00 54.79 53.95 2gk3 n ASP 179 Cb 0.61 -3.83 -0.02 0.00 -0.72 0.00 0.00 41.12 37.16 2gk3 n ASP 179 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2gk3 n TYR 180 N -4.07 2.71 -2.06 -0.67 4.02 -1.26 -4.99 117.16 110.84 2gk3 n TYR 180 Ca -0.17 0.32 -0.28 0.00 -0.01 0.00 0.00 57.90 57.76 2gk3 n TYR 180 Cb 0.63 -2.56 0.14 0.00 -0.02 0.00 0.00 39.34 37.53 2gk3 n TYR 180 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2gk3 s PRO 181 N -0.72 1.30 0.16 -0.72 0.04 -1.26 -4.68 135.00 129.13 2gk3 s PRO 181 Ca 0.63 -0.37 -0.12 0.00 0.04 0.00 0.00 61.00 61.18 2gk3 s PRO 181 Cb -0.53 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 31.96 2gk3 s PRO 181 CO 0.51 -1.93 0.53 0.08 0.04 0.00 0.00 177.00 176.23 2gk3 s VAL 182 N -3.62 4.91 0.09 -0.36 1.01 -1.26 -2.30 120.40 118.86 2gk3 s VAL 182 Ca 0.68 0.67 0.08 0.00 0.00 0.00 0.00 61.98 63.41 2gk3 s VAL 182 Cb -0.07 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 2gk3 s VAL 182 CO 0.50 0.16 -0.20 -0.36 0.00 0.00 0.00 175.10 175.20 2gk3 s PHE 183 N -1.56 1.70 -1.73 5.22 0.40 0.66 -4.11 117.98 118.56 2gk3 s PHE 183 Ca 0.40 -0.41 0.21 0.00 -0.60 0.00 0.00 56.93 56.52 2gk3 s PHE 183 Cb -0.14 -0.95 0.64 0.00 0.51 0.00 0.00 43.02 43.09 2gk3 s PHE 183 CO 0.20 0.17 1.54 1.28 0.70 0.00 0.00 175.22 179.10 2gk3 n LEU 184 N 1.24 4.05 0.00 -0.37 4.32 -0.01 -1.33 117.00 124.90 2gk3 n LEU 184 Ca -0.19 -2.09 0.00 0.00 -0.02 0.00 0.00 56.01 53.71 2gk3 n LEU 184 Cb 0.54 -0.49 0.00 0.00 -1.62 0.00 0.00 43.42 41.84 2gk3 n LEU 184 CO 0.22 0.94 0.00 0.61 -1.22 0.00 0.00 177.39 177.94 2gk3 n GLY 185 N 1.47 2.30 3.56 -0.72 0.00 -1.26 -0.57 105.19 109.98 2gk3 n GLY 185 Ca 0.24 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 2gk3 n GLY 185 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2gk3 s TYR 186 N -2.00 -0.31 -0.15 1.61 -0.85 -0.57 -4.58 117.35 110.50 2gk3 s TYR 186 Ca 0.00 0.12 -0.23 0.00 -0.52 0.00 0.00 57.07 56.43 2gk3 s TYR 186 Cb 0.00 0.57 -0.02 0.00 0.38 0.00 0.00 41.96 42.89 2gk3 s TYR 186 CO 0.00 -0.66 0.74 -0.80 -1.52 0.00 0.00 175.55 173.31 2gk3 s ASN 187 N -2.63 6.89 -0.19 -0.18 -0.87 -1.26 0.19 114.94 116.89 2gk3 s ASN 187 Ca 0.06 1.08 -0.26 0.00 -1.57 0.00 0.00 52.86 52.18 2gk3 s ASN 187 Cb -0.01 -2.41 -0.01 0.00 -0.02 0.00 0.00 41.25 38.80 2gk3 s ASN 187 CO -0.06 -0.28 0.89 -1.58 -2.57 0.00 0.00 177.10 173.50 2gk3 s GLN 188 N 1.69 4.28 0.22 -0.60 0.74 0.19 -4.81 119.66 121.36 2gk3 s GLN 188 Ca 0.35 1.11 -0.00 0.00 0.05 0.00 0.00 55.36 56.87 2gk3 s GLN 188 Cb -0.17 -3.60 -0.04 0.00 1.10 0.00 0.00 33.01 30.30 2gk3 s GLN 188 CO 0.14 -0.42 0.12 0.00 -0.55 0.00 0.00 175.29 174.58 2gk3 s ALA 189 N 2.47 1.33 -0.16 1.58 0.00 -1.26 -4.28 121.76 121.43 2gk3 s ALA 189 Ca 0.40 -1.75 -0.02 0.00 0.00 0.00 0.00 51.96 50.59 2gk3 s ALA 189 Cb -0.16 1.30 -0.01 0.00 0.00 0.00 0.00 23.12 24.25 2gk3 s ALA 189 CO 0.11 -0.56 -0.09 0.08 0.00 0.00 0.00 175.76 175.30 2gk3 s VAL 190 N -4.05 3.26 0.33 0.00 1.01 -0.39 -4.44 120.40 116.13 2gk3 s VAL 190 Ca 0.39 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 2gk3 s VAL 190 Cb 0.07 -2.41 -0.11 0.00 0.00 0.00 0.00 36.38 33.93 2gk3 s VAL 190 CO 0.13 0.49 1.48 0.00 0.00 0.00 0.00 175.10 177.20 2gk3 s ALA 191 N 0.66 3.61 0.37 5.51 0.00 -1.26 0.88 121.76 131.53 2gk3 s ALA 191 Ca -0.05 1.49 -0.28 0.00 0.00 0.00 0.00 51.96 53.12 2gk3 s ALA 191 Cb -0.15 -3.59 -0.11 0.00 0.00 0.00 0.00 23.12 19.27 2gk3 s ALA 191 CO 0.02 -0.93 1.51 0.54 0.00 0.00 0.00 175.76 176.91 2gk3 n ARG 192 N 1.19 2.71 0.00 0.00 1.74 -0.52 -4.76 116.66 117.02 2gk3 n ARG 192 Ca 0.03 0.95 0.04 0.00 -0.77 0.00 0.00 57.85 58.11 2gk3 n ARG 192 Cb 0.39 -2.70 0.26 0.00 -1.02 0.00 0.00 32.46 29.40 2gk3 n ARG 192 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2gk3 n ASP 193 N 0.68 0.00 0.00 0.55 3.85 -1.26 -0.51 116.55 119.86 2gk3 n ASP 193 Ca 0.02 -0.85 -0.10 0.00 -0.71 0.00 0.00 54.79 53.16 2gk3 n ASP 193 Cb 0.39 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 40.02 2gk3 n ASP 193 CO 0.00 0.00 0.00 -0.78 -1.01 0.00 0.00 177.20 175.41 2gk3 h ASP 194 N 0.00 0.05 -2.40 -1.12 -0.00 -1.94 -3.49 116.42 107.53 2gk3 h ASP 194 Ca 0.00 -0.09 -0.44 0.00 -0.00 0.00 0.00 57.03 56.50 2gk3 h ASP 194 Cb 0.00 -0.02 0.04 0.00 -0.00 0.00 0.00 39.33 39.35 2gk3 h ASP 194 CO 0.00 1.08 -0.08 0.00 -0.00 0.00 0.00 179.24 180.24 2gk3 s ALA 195 N -2.62 3.96 -0.35 -0.78 0.00 0.33 -4.97 121.76 117.34 2gk3 s ALA 195 Ca -0.05 -1.33 -0.08 0.00 0.00 0.00 0.00 51.96 50.50 2gk3 s ALA 195 Cb 0.08 -2.02 0.03 0.00 0.00 0.00 0.00 23.12 21.21 2gk3 s ALA 195 CO 0.82 -0.61 0.14 -0.51 0.00 0.00 0.00 175.76 175.60 2gk3 s ASP 196 N -4.38 5.46 -0.22 0.00 1.01 0.15 -4.92 116.67 113.77 2gk3 s ASP 196 Ca 0.55 -1.03 -0.26 0.00 0.71 0.00 0.00 52.55 52.53 2gk3 s ASP 196 Cb -0.10 -1.93 -0.00 0.00 1.01 0.00 0.00 42.92 41.89 2gk3 s ASP 196 CO 0.37 -0.33 0.87 -0.69 0.21 0.00 0.00 175.17 175.60 2gk3 s VAL 197 N 1.47 4.82 -0.15 -1.27 1.01 -1.26 -0.82 120.40 124.19 2gk3 s VAL 197 Ca 0.00 1.67 0.05 0.00 0.00 0.00 0.00 61.98 63.70 2gk3 s VAL 197 Cb -0.19 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 31.90 2gk3 s VAL 197 CO 0.04 -0.07 -0.08 0.52 0.00 0.00 0.00 175.10 175.51 2gk3 n VAL 198 N 5.15 0.93 -4.14 2.92 0.31 0.58 -4.39 118.33 119.68 2gk3 n VAL 198 Ca 0.07 -0.43 -0.17 0.00 -0.01 0.00 0.00 64.34 63.80 2gk3 n VAL 198 Cb 0.47 -0.94 -0.12 0.00 -0.91 0.00 0.00 33.84 32.35 2gk3 n VAL 198 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2gk3 s LEU 199 N -5.62 2.27 0.26 7.52 1.43 -1.16 -1.34 118.68 122.04 2gk3 s LEU 199 Ca -0.17 -0.60 0.04 0.00 -1.03 0.00 0.00 54.13 52.37 2gk3 s LEU 199 Cb 0.05 -0.42 -0.06 0.00 0.03 0.00 0.00 46.19 45.79 2gk3 s LEU 199 CO 0.43 -0.11 0.00 0.42 0.23 0.00 0.00 176.35 177.33 2gk3 s THR 200 N -1.30 1.18 -0.13 5.49 -4.23 0.44 0.03 115.64 117.12 2gk3 s THR 200 Ca -0.04 -2.04 -0.05 0.00 -1.18 0.00 0.00 61.69 58.37 2gk3 s THR 200 Cb -0.10 -2.47 0.06 0.00 1.34 0.00 0.00 72.50 71.33 2gk3 s THR 200 CO 0.02 -0.24 0.28 -0.51 -0.54 0.00 0.00 174.62 173.62 2gk3 s ILE 201 N -3.32 -0.30 -1.38 2.99 2.07 0.23 -0.81 121.20 120.67 2gk3 s ILE 201 Ca 0.31 0.23 -0.05 0.00 -1.41 0.00 0.00 60.65 59.72 2gk3 s ILE 201 Cb 0.06 -0.45 0.03 0.00 0.13 0.00 0.00 42.46 42.23 2gk3 s ILE 201 CO 0.11 0.09 0.39 -3.20 -1.91 0.00 0.00 174.94 170.42 2gk3 n ASN 202 N 4.97 -4.81 0.00 4.50 5.15 -1.26 0.34 115.26 124.14 2gk3 n ASN 202 Ca -0.13 -0.20 0.00 0.00 -0.60 0.00 0.00 54.58 53.65 2gk3 n ASN 202 Cb 0.51 -3.96 0.00 0.00 -0.53 0.00 0.00 39.78 35.80 2gk3 n ASN 202 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2gk3 n ASN 203 N -2.25 -1.68 -4.92 1.20 3.02 -1.26 -5.00 115.26 104.37 2gk3 n ASN 203 Ca -0.10 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.19 2gk3 n ASN 203 Cb 0.60 -2.11 -0.02 0.00 -0.61 0.00 0.00 39.78 37.65 2gk3 n ASN 203 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2gk3 s ASP 204 N -2.18 6.34 0.52 6.41 1.01 0.15 -5.05 116.67 123.87 2gk3 s ASP 204 Ca 0.00 0.63 -0.22 0.00 0.71 0.00 0.00 52.55 53.67 2gk3 s ASP 204 Cb 0.00 -2.11 -0.06 0.00 1.01 0.00 0.00 42.92 41.77 2gk3 s ASP 204 CO 0.00 -0.31 1.30 -2.16 0.21 0.00 0.00 175.17 174.21 2gk3 s PRO 205 N -4.12 3.32 0.00 8.23 0.04 -1.26 -0.60 135.00 140.61 2gk3 s PRO 205 Ca 0.43 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.55 2gk3 s PRO 205 Cb -0.10 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.15 2gk3 s PRO 205 CO 0.35 -1.00 0.00 -0.11 0.04 0.00 0.00 177.00 176.29 2gk3 n LEU 206 N -0.88 0.34 -4.15 -3.56 7.94 0.11 -4.59 117.00 112.21 2gk3 n LEU 206 Ca 0.09 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.67 2gk3 n LEU 206 Cb 0.46 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 44.25 2gk3 n LEU 206 CO 0.51 0.04 -0.54 -0.22 -1.11 0.00 0.00 177.39 176.07 2gk3 s LEU 207 N -5.83 2.13 -0.04 -1.96 2.96 -0.81 -4.08 118.68 111.05 2gk3 s LEU 207 Ca 0.00 -0.62 0.01 0.00 -0.22 0.00 0.00 54.13 53.30 2gk3 s LEU 207 Cb 0.00 -1.46 0.02 0.00 0.50 0.00 0.00 46.19 45.25 2gk3 s LEU 207 CO 0.00 0.05 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.34 2gk3 s VAL 208 N 1.02 0.48 -0.06 1.68 1.01 -0.81 -0.31 120.40 123.41 2gk3 s VAL 208 Ca -0.02 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 61.87 2gk3 s VAL 208 Cb -0.14 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 2gk3 s VAL 208 CO -0.07 0.20 -0.13 -0.36 0.00 0.00 0.00 175.10 174.75 2gk3 s PHE 209 N 0.75 2.75 0.00 5.22 0.08 -0.00 -1.17 117.98 125.61 2gk3 s PHE 209 Ca -0.10 -0.16 0.00 0.00 0.12 0.00 0.00 56.93 56.80 2gk3 s PHE 209 Cb -0.13 -1.66 0.00 0.00 -0.57 0.00 0.00 43.02 40.66 2gk3 s PHE 209 CO 0.00 0.19 0.00 0.41 -0.10 0.00 0.00 175.22 175.72 2gk3 n GLY 210 N 2.38 3.75 3.09 4.36 0.00 -0.30 -0.68 105.19 117.80 2gk3 n GLY 210 Ca -0.17 -1.36 -0.10 0.00 0.00 0.00 0.00 46.02 44.39 2gk3 n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gk3 s GLU 211 N -0.94 0.62 -0.28 1.61 2.02 -1.26 -1.33 118.70 119.14 2gk3 s GLU 211 Ca 0.00 -1.04 -0.01 0.00 0.02 0.00 0.00 54.97 53.94 2gk3 s GLU 211 Cb 0.00 -0.09 0.13 0.00 0.10 0.00 0.00 34.13 34.27 2gk3 s GLU 211 CO 0.00 -0.02 0.29 -0.47 0.02 0.00 0.00 175.26 175.08 2gk3 s TYR 212 N -2.75 -0.46 0.00 1.61 5.04 -0.54 -4.89 117.35 115.36 2gk3 s TYR 212 Ca 0.01 -0.08 0.00 0.00 -2.44 0.00 0.00 57.07 54.56 2gk3 s TYR 212 Cb -0.01 -0.43 0.00 0.00 0.35 0.00 0.00 41.96 41.88 2gk3 s TYR 212 CO -0.04 -0.88 0.00 1.04 -1.34 0.00 0.00 175.55 174.33 2gk3 n GLN 213 N 5.31 0.00 0.19 4.97 6.02 -1.26 -1.96 117.38 130.65 2gk3 n GLN 213 Ca -0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.02 2gk3 n GLN 213 Cb 0.47 0.00 0.34 0.00 1.02 0.00 0.00 30.24 32.07 2gk3 n GLN 213 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 2gk3 h GLN 214 N 0.00 0.00 -7.32 -1.09 4.20 -1.42 -3.47 115.11 106.01 2gk3 h GLN 214 Ca 0.00 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.25 2gk3 h GLN 214 Cb 0.00 0.00 0.08 0.00 0.30 0.00 0.00 27.48 27.86 2gk3 h GLN 214 CO 0.00 0.38 0.23 0.20 -0.67 0.00 0.00 178.83 178.98 2gk3 s GLY 215 N -4.35 1.70 0.07 3.46 0.00 -0.13 -4.40 107.32 103.66 2gk3 s GLY 215 Ca -0.00 -0.97 0.07 0.00 0.00 0.00 0.00 44.72 43.81 2gk3 s GLY 215 CO 0.69 -0.54 -0.20 0.54 0.00 0.00 0.00 173.10 173.59 2gk3 s LYS 216 N -5.28 1.19 0.10 2.90 1.02 -1.15 -1.47 119.74 117.04 2gk3 s LYS 216 Ca 0.61 -1.02 0.04 0.00 0.02 0.00 0.00 55.97 55.62 2gk3 s LYS 216 Cb -0.10 -1.35 -0.04 0.00 -0.52 0.00 0.00 37.83 35.82 2gk3 s LYS 216 CO 0.45 0.33 -0.11 0.95 -0.92 0.00 0.00 175.35 176.04 2gk3 s THR 217 N -1.00 1.05 -0.06 2.17 -4.23 -0.44 -1.81 115.64 111.32 2gk3 s THR 217 Ca 0.06 -1.61 -0.17 0.00 -1.18 0.00 0.00 61.69 58.78 2gk3 s THR 217 Cb -0.09 -1.36 0.04 0.00 1.34 0.00 0.00 72.50 72.43 2gk3 s THR 217 CO 0.03 -0.49 0.40 0.00 -0.54 0.00 0.00 174.62 174.02 2gk3 s ALA 218 N -2.23 -1.02 -0.04 3.99 0.00 -0.33 -1.14 121.76 120.99 2gk3 s ALA 218 Ca 0.05 0.74 0.01 0.00 0.00 0.00 0.00 51.96 52.76 2gk3 s ALA 218 Cb -0.04 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.94 2gk3 s ALA 218 CO 0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 175.76 175.47 2gk3 n PHE 220 N 3.97 0.08 0.00 0.00 7.35 -1.26 -1.92 117.46 125.68 2gk3 n PHE 220 Ca -0.25 -2.19 0.00 0.00 -0.76 0.00 0.00 57.45 54.25 2gk3 n PHE 220 Cb 0.51 -0.37 0.00 0.00 0.35 0.00 0.00 39.48 39.98 2gk3 n PHE 220 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2gk3 n SER 222 N -1.61 0.00 -4.92 -2.13 2.88 -1.26 0.28 113.62 106.86 2gk3 n SER 222 Ca -0.09 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.18 2gk3 n SER 222 Cb 0.58 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.02 2gk3 n SER 222 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2gk3 s ASP 223 N 0.00 6.35 0.00 -3.46 -1.08 -1.24 -1.48 116.67 115.75 2gk3 s ASP 223 Ca 0.00 0.63 0.27 0.00 -0.52 0.00 0.00 52.55 52.93 2gk3 s ASP 223 Cb 0.00 -2.11 0.89 0.00 -1.46 0.00 0.00 42.92 40.24 2gk3 s ASP 223 CO 0.00 -0.30 1.65 0.00 0.52 0.00 0.00 175.17 177.04 2gk3 s SER 225 N -2.52 0.20 0.83 0.00 0.01 -1.26 -4.87 113.70 106.10 2gk3 s SER 225 Ca 0.25 -1.24 -0.12 0.00 1.31 0.00 0.00 55.95 56.14 2gk3 s SER 225 Cb 0.19 0.35 0.10 0.00 0.21 0.00 0.00 66.02 66.88 2gk3 s SER 225 CO 0.51 -0.81 1.18 -2.84 0.41 0.00 0.00 173.24 171.70 2gk3 s PRO 226 N -4.09 1.50 0.23 12.44 0.02 -1.02 -0.68 135.00 143.41 2gk3 s PRO 226 Ca 0.30 1.67 0.24 0.00 0.02 0.00 0.00 61.00 63.22 2gk3 s PRO 226 Cb 0.07 -1.77 0.35 0.00 0.02 0.00 0.00 34.50 33.16 2gk3 s PRO 226 CO 0.06 -2.30 1.41 1.12 -0.33 0.00 0.00 177.00 176.97 2gk3 h HIS 227 N -1.17 0.00 -0.24 6.54 2.07 -2.00 -3.44 115.15 116.91 2gk3 h HIS 227 Ca -0.45 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.02 2gk3 h HIS 227 Cb 1.28 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.26 2gk3 h HIS 227 CO 0.48 0.00 -0.04 -1.49 -3.07 0.00 0.00 177.93 173.81 2gk3 h TRP 228 N 0.00 0.50 -3.17 6.12 4.06 -1.88 -3.39 115.95 118.18 2gk3 h TRP 228 Ca 0.00 -0.10 -0.57 0.00 2.06 0.00 0.00 58.89 60.28 2gk3 h TRP 228 Cb 0.87 -0.12 -0.05 0.00 -1.00 0.00 0.00 29.16 28.85 2gk3 h TRP 228 CO 0.00 0.66 0.96 0.20 -3.56 0.00 0.00 178.44 176.70 2gk3 s GLY 229 N -3.23 1.39 0.58 1.49 0.00 0.14 -0.83 107.32 106.86 2gk3 s GLY 229 Ca -0.14 0.07 -0.11 0.00 0.00 0.00 0.00 44.72 44.55 2gk3 s GLY 229 CO 0.75 2.56 0.98 -0.51 0.00 0.00 0.00 173.10 176.88 2gk3 s THR 230 N 4.33 4.72 0.38 0.90 -4.23 -1.26 -2.44 115.64 118.04 2gk3 s THR 230 Ca 0.55 0.81 0.11 0.00 -1.18 0.00 0.00 61.69 61.98 2gk3 s THR 230 Cb -0.16 -3.84 0.33 0.00 1.34 0.00 0.00 72.50 70.17 2gk3 s THR 230 CO 0.23 -1.02 1.88 1.56 -0.54 0.00 0.00 174.62 176.73 2gk3 h GLN 231 N -0.01 0.59 -0.68 3.99 1.08 -1.93 0.17 115.11 118.31 2gk3 h GLN 231 Ca -0.45 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 56.70 2gk3 h GLN 231 Cb 1.19 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 28.46 2gk3 h GLN 231 CO 0.62 0.39 0.38 0.37 -0.95 0.00 0.00 178.83 179.64 2gk3 h GLN 232 N 0.61 0.94 -1.32 1.46 4.15 -1.92 -1.84 115.11 117.18 2gk3 h GLN 232 Ca 0.43 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.75 2gk3 h GLN 232 Cb 0.78 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.28 2gk3 h GLN 232 CO -0.18 0.68 0.00 0.34 -1.93 0.00 0.00 178.83 177.74 2gk3 n PHE 233 N -4.38 0.00 0.00 3.99 7.35 0.59 -1.43 117.46 123.58 2gk3 n PHE 233 Ca 0.07 -0.20 0.00 0.00 -0.76 0.00 0.00 57.45 56.55 2gk3 n PHE 233 Cb 0.09 -0.15 0.00 0.00 0.35 0.00 0.00 39.48 39.77 2gk3 n PHE 233 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2gk3 n SER 235 N 0.66 0.00 -4.73 -2.13 3.41 -0.69 -4.64 113.62 105.50 2gk3 n SER 235 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 2gk3 n SER 235 Cb 0.23 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.15 2gk3 n SER 235 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2gk3 s TRP 236 N 0.00 2.93 0.63 7.33 -0.00 -0.52 -4.89 118.94 124.42 2gk3 s TRP 236 Ca 0.00 0.64 0.33 0.00 -0.00 0.00 0.00 56.10 57.08 2gk3 s TRP 236 Cb 0.00 -4.01 1.84 0.00 -0.00 0.00 0.00 33.47 31.29 2gk3 s TRP 236 CO 0.00 -3.62 2.10 -1.35 -0.00 0.00 0.00 176.95 174.08 2gk3 h PRO 237 N 6.00 0.00 -0.49 5.86 0.11 -1.89 -1.59 132.00 140.00 2gk3 h PRO 237 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2gk3 h PRO 237 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2gk3 h PRO 237 CO 0.87 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.85 2gk3 n PHE 238 N -3.34 0.90 -0.02 0.65 3.72 -1.26 -4.57 117.46 113.54 2gk3 n PHE 238 Ca -0.00 -0.59 -0.09 0.00 -0.05 0.00 0.00 57.45 56.72 2gk3 n PHE 238 Cb 0.30 -0.12 -0.04 0.00 -0.94 0.00 0.00 39.48 38.68 2gk3 n PHE 238 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2gk3 h TYR 239 N 2.95 -0.09 -0.05 1.38 3.20 -1.55 -0.69 116.97 122.13 2gk3 h TYR 239 Ca 0.00 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2gk3 h TYR 239 Cb 1.07 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 39.41 2gk3 h TYR 239 CO 0.46 -0.07 0.00 1.15 -1.64 0.00 0.00 178.16 178.06 2gk3 h THR 240 N -0.01 1.23 -0.55 1.81 2.02 -1.81 -2.89 112.91 112.71 2gk3 h THR 240 Ca 0.07 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 2gk3 h THR 240 Cb 0.12 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 68.10 2gk3 h THR 240 CO -0.16 0.19 0.25 0.44 0.37 0.00 0.00 175.52 176.62 2gk3 h ASP 241 N -0.18 0.70 0.49 4.18 3.32 -1.83 -0.05 116.42 123.06 2gk3 h ASP 241 Ca 0.02 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2gk3 h ASP 241 Cb 0.30 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2gk3 h ASP 241 CO 0.00 0.61 -0.47 0.25 -1.72 0.00 0.00 179.24 177.91 2gk3 h LEU 242 N 0.78 -1.29 -0.49 1.55 5.85 -0.95 0.48 115.31 121.24 2gk3 h LEU 242 Ca 0.19 0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.88 2gk3 h LEU 242 Cb 0.11 0.43 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2gk3 h LEU 242 CO -0.02 -0.64 -0.25 -0.50 -0.34 0.00 0.00 178.44 176.68 2gk3 h TRP 243 N -0.97 1.13 0.03 1.25 4.06 -1.31 -0.86 115.95 119.28 2gk3 h TRP 243 Ca -0.06 -0.29 -0.00 0.00 2.06 0.00 0.00 58.89 60.61 2gk3 h TRP 243 Cb 0.84 -0.26 0.00 0.00 -1.00 0.00 0.00 29.16 28.74 2gk3 h TRP 243 CO -0.24 1.11 -0.01 0.28 -3.56 0.00 0.00 178.44 176.02 2gk3 h VAL 244 N 0.83 1.20 -0.94 1.49 2.07 -0.96 -1.05 116.25 118.89 2gk3 h VAL 244 Ca 0.10 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.95 2gk3 h VAL 244 Cb 0.83 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 32.23 2gk3 h VAL 244 CO 0.07 0.18 0.61 0.78 0.02 0.00 0.00 177.57 179.23 2gk3 h ASN 245 N -0.35 0.99 0.02 0.57 2.35 0.04 -0.65 115.58 118.55 2gk3 h ASN 245 Ca -0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 2gk3 h ASN 245 Cb 0.33 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 2gk3 h ASN 245 CO 0.01 0.66 -0.68 0.71 -1.65 0.00 0.00 177.43 176.48 2gk3 h THR 246 N 1.14 1.32 -0.39 2.81 1.35 -1.06 0.20 112.91 118.29 2gk3 h THR 246 Ca 0.39 -1.96 0.04 0.00 -0.55 0.00 0.00 66.41 64.33 2gk3 h THR 246 Cb 0.07 1.93 -0.04 0.00 -1.73 0.00 0.00 68.15 68.38 2gk3 h THR 246 CO -0.14 0.61 0.16 -0.07 -0.25 0.00 0.00 175.52 175.82 2gk3 h LEU 247 N 0.44 0.19 -0.70 3.87 3.38 -0.93 -2.73 115.31 118.82 2gk3 h LEU 247 Ca -0.02 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2gk3 h LEU 247 Cb 1.26 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2gk3 h LEU 247 CO 0.13 0.15 -0.25 -0.61 0.09 0.00 0.00 178.44 177.95 2gk3 h GLN 248 N 0.33 0.72 -0.86 1.13 5.75 -0.89 -2.03 115.11 119.26 2gk3 h GLN 248 Ca 0.18 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.38 2gk3 h GLN 248 Cb 0.14 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.61 2gk3 h GLN 248 CO -0.16 0.90 0.55 0.35 -2.65 0.00 0.00 178.83 177.82 2gk3 h PHE 249 N 0.63 1.10 -0.03 3.99 3.57 -0.39 -3.15 116.94 122.67 2gk3 h PHE 249 Ca 0.08 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2gk3 h PHE 249 Cb 0.76 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.13 2gk3 h PHE 249 CO 0.04 0.71 -0.07 0.44 -2.23 0.00 0.00 178.31 177.20 2gk3 n ILE 250 N -4.46 0.00 -1.73 1.41 -5.35 -1.05 -5.00 119.36 103.18 2gk3 n ILE 250 Ca 0.09 -0.45 -0.37 0.00 -0.27 0.00 0.00 62.75 61.75 2gk3 n ILE 250 Cb 0.03 1.42 0.07 0.00 -1.74 0.00 0.00 39.64 39.41 2gk3 n ILE 250 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2gk3 n ALA 251 N 1.10 1.18 -1.54 -1.28 0.00 -0.77 -3.89 120.51 115.30 2gk3 n ALA 251 Ca 0.14 0.01 -0.47 0.00 0.00 0.00 0.00 53.44 53.12 2gk3 n ALA 251 Cb 0.57 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.67 2gk3 n ALA 251 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2gk3 n ARG 252 N -1.78 0.94 0.00 0.00 0.63 -0.95 -4.85 116.66 110.64 2gk3 n ARG 252 Ca 0.15 0.33 0.00 0.00 -0.92 0.00 0.00 57.85 57.41 2gk3 n ARG 252 Cb 0.48 -1.67 0.00 0.00 0.45 0.00 0.00 32.46 31.72 2gk3 n ARG 252 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29