#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gk3 s LYS 9 N 0.00 2.75 -0.12 1.96 2.47 -1.26 -0.41 119.74 125.13 2gk3 s LYS 9 Ca 0.00 -1.16 0.02 0.00 -1.56 0.00 0.00 55.97 53.27 2gk3 s LYS 9 Cb 0.00 -3.69 0.02 0.00 -1.46 0.00 0.00 37.83 32.70 2gk3 s LYS 9 CO 0.00 -0.73 -0.16 0.08 0.16 0.00 0.00 175.35 174.70 2gk3 s VAL 10 N 1.51 1.55 -0.34 4.02 1.01 -0.13 -0.34 120.40 127.68 2gk3 s VAL 10 Ca 0.01 -0.66 -0.24 0.00 0.00 0.00 0.00 61.98 61.09 2gk3 s VAL 10 Cb -0.20 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.77 2gk3 s VAL 10 CO 0.05 0.45 0.82 -0.22 0.00 0.00 0.00 175.10 176.21 2gk3 s LEU 11 N 1.06 4.08 -0.24 3.92 0.20 -0.47 -0.90 118.68 126.34 2gk3 s LEU 11 Ca -0.05 0.54 -0.07 0.00 0.69 0.00 0.00 54.13 55.25 2gk3 s LEU 11 Cb -0.15 -3.11 -0.03 0.00 -0.43 0.00 0.00 46.19 42.48 2gk3 s LEU 11 CO -0.03 -0.71 0.06 0.12 -0.29 0.00 0.00 176.35 175.49 2gk3 s PHE 12 N 3.13 3.09 -0.05 5.38 5.36 -0.13 -0.33 117.98 134.42 2gk3 s PHE 12 Ca 0.33 -0.41 0.06 0.00 -0.96 0.00 0.00 56.93 55.96 2gk3 s PHE 12 Cb -0.13 -2.21 -0.01 0.00 -0.34 0.00 0.00 43.02 40.33 2gk3 s PHE 12 CO 0.15 -0.32 -0.25 0.42 -1.46 0.00 0.00 175.22 173.77 2gk3 s ILE 13 N 1.46 2.07 0.00 3.12 1.01 0.34 -4.32 121.20 124.89 2gk3 s ILE 13 Ca 0.06 -1.07 0.00 0.00 0.00 0.00 0.00 60.65 59.64 2gk3 s ILE 13 Cb -0.15 -1.74 0.00 0.00 0.01 0.00 0.00 42.46 40.58 2gk3 s ILE 13 CO 0.03 0.57 0.00 0.61 0.00 0.00 0.00 174.94 176.15 2gk3 n GLY 14 N 2.88 0.56 3.21 6.18 0.00 -1.26 -1.85 105.19 114.91 2gk3 n GLY 14 Ca -0.17 -1.76 -0.21 0.00 0.00 0.00 0.00 46.02 43.88 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 -3.25 -4.04 1.61 -0.58 -0.33 -4.22 120.64 109.83 2gk3 n GLU 15 Ca 0.00 0.49 -0.11 0.00 -0.42 0.00 0.00 57.16 57.12 2gk3 n GLU 15 Cb 0.00 -5.18 -0.11 0.00 -0.57 0.00 0.00 31.44 25.58 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 -2.61 0.61 -0.03 1.62 1.04 -1.26 0.37 113.70 113.43 2gk3 s SER 16 Ca 0.33 -0.58 -0.27 0.00 0.48 0.00 0.00 55.95 55.91 2gk3 s SER 16 Cb -0.18 0.07 0.06 0.00 0.10 0.00 0.00 66.02 66.08 2gk3 s SER 16 CO 0.41 -0.28 0.61 -1.66 0.98 0.00 0.00 173.24 173.30 2gk3 s TRP 17 N -1.70 -0.56 -0.31 5.02 -2.14 -0.86 -4.69 118.94 113.71 2gk3 s TRP 17 Ca -0.10 0.91 -0.06 0.00 2.66 0.00 0.00 56.10 59.51 2gk3 s TRP 17 Cb -0.08 0.36 0.03 0.00 -3.10 0.00 0.00 33.47 30.68 2gk3 s TRP 17 CO -0.01 -0.59 0.08 -1.01 -2.66 0.00 0.00 176.95 172.76 2gk3 s HIS 18 N -1.40 3.20 -0.09 1.66 3.76 -1.26 -0.80 115.29 120.36 2gk3 s HIS 18 Ca -0.11 -1.26 -0.23 0.00 -0.15 0.00 0.00 55.06 53.31 2gk3 s HIS 18 Cb -0.01 -2.25 -0.03 0.00 1.11 0.00 0.00 32.58 31.40 2gk3 s HIS 18 CO 0.07 -0.67 0.69 0.42 -0.85 0.00 0.00 174.74 174.40 2gk3 s ILE 19 N 1.43 5.04 0.49 0.60 1.01 0.16 -4.94 121.20 124.99 2gk3 s ILE 19 Ca 0.00 1.40 0.05 0.00 0.00 0.00 0.00 60.65 62.10 2gk3 s ILE 19 Cb -0.18 -4.02 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 2gk3 s ILE 19 CO 0.02 0.23 0.25 -2.28 0.00 0.00 0.00 174.94 173.16 2gk3 s HIS 20 N 0.97 2.06 -0.30 3.97 5.65 -1.26 -0.52 115.29 125.85 2gk3 s HIS 20 Ca 0.36 -0.76 -0.09 0.00 0.25 0.00 0.00 55.06 54.82 2gk3 s HIS 20 Cb -0.17 -1.88 0.18 0.00 -1.18 0.00 0.00 32.58 29.53 2gk3 s HIS 20 CO 0.17 -0.09 0.93 0.42 -0.65 0.00 0.00 174.74 175.51 2gk3 s ILE 22 N -2.72 -0.49 -0.47 0.89 1.01 -1.26 -5.00 121.20 113.16 2gk3 s ILE 22 Ca 0.31 0.00 -0.19 0.00 0.00 0.00 0.00 60.65 60.78 2gk3 s ILE 22 Cb 0.01 -0.88 0.04 0.00 0.01 0.00 0.00 42.46 41.64 2gk3 s ILE 22 CO 0.18 0.00 0.56 -1.00 0.00 0.00 0.00 174.94 174.68 2gk3 s HIS 23 N 2.93 3.10 -0.28 3.97 3.76 0.15 -4.98 115.29 123.94 2gk3 s HIS 23 Ca 0.08 -0.41 -0.12 0.00 -0.15 0.00 0.00 55.06 54.47 2gk3 s HIS 23 Cb -0.10 -3.29 -0.05 0.00 1.11 0.00 0.00 32.58 30.26 2gk3 s HIS 23 CO -0.16 -0.89 0.22 -1.12 -0.85 0.00 0.00 174.74 171.94 2gk3 s SER 24 N 2.28 6.06 -0.38 1.40 0.01 -1.26 -1.73 113.70 120.07 2gk3 s SER 24 Ca 0.15 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.44 2gk3 s SER 24 Cb -0.18 -2.14 0.11 0.00 0.21 0.00 0.00 66.02 64.02 2gk3 s SER 24 CO 0.14 -0.08 0.14 -0.54 0.41 0.00 0.00 173.24 173.31 2gk3 s LYS 25 N 1.81 1.77 6.94 12.44 1.02 0.16 -4.97 119.74 138.91 2gk3 s LYS 25 Ca 0.08 -1.87 0.00 0.00 0.02 0.00 0.00 55.97 54.20 2gk3 s LYS 25 Cb -0.16 -3.41 0.00 0.00 -0.52 0.00 0.00 37.83 33.74 2gk3 s LYS 25 CO 0.11 -1.01 0.00 0.41 -0.92 0.00 0.00 175.35 173.93 2gk3 n GLY 26 N 4.40 2.75 0.27 -3.33 0.00 -1.26 -2.51 105.19 105.51 2gk3 n GLY 26 Ca 0.01 -0.31 0.02 0.00 0.00 0.00 0.00 46.02 45.74 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 0.42 -2.63 1.61 3.20 -2.02 -3.45 116.97 114.11 2gk3 h TYR 27 Ca 0.00 -0.03 -0.47 0.00 3.14 0.00 0.00 58.73 61.38 2gk3 h TYR 27 Cb 0.00 -0.13 0.01 0.00 1.54 0.00 0.00 36.73 38.15 2gk3 h TYR 27 CO 0.00 0.40 -0.23 -0.51 -1.64 0.00 0.00 178.16 176.18 2gk3 s ASP 28 N -6.78 6.23 -0.02 -2.11 1.01 -1.04 -5.11 116.67 108.85 2gk3 s ASP 28 Ca -0.07 0.33 -0.09 0.00 0.71 0.00 0.00 52.55 53.42 2gk3 s ASP 28 Cb 0.16 -1.90 0.01 0.00 1.01 0.00 0.00 42.92 42.20 2gk3 s ASP 28 CO 0.74 -0.31 0.20 -0.94 0.21 0.00 0.00 175.17 175.07 2gk3 s SER 29 N -4.06 -0.07 0.31 0.27 1.04 -1.26 0.40 113.70 110.33 2gk3 s SER 29 Ca 0.40 -0.02 0.07 0.00 0.48 0.00 0.00 55.95 56.88 2gk3 s SER 29 Cb -0.10 0.27 -0.06 0.00 0.10 0.00 0.00 66.02 66.24 2gk3 s SER 29 CO 0.35 -0.34 -0.06 0.72 0.98 0.00 0.00 173.24 174.89 2gk3 s PHE 30 N -1.12 2.11 0.07 5.02 -0.12 -0.70 -4.95 117.98 118.28 2gk3 s PHE 30 Ca -0.12 -0.66 0.08 0.00 -0.05 0.00 0.00 56.93 56.19 2gk3 s PHE 30 Cb -0.06 -1.23 -0.03 0.00 -0.63 0.00 0.00 43.02 41.07 2gk3 s PHE 30 CO 0.02 0.36 -0.23 0.95 -0.05 0.00 0.00 175.22 176.27 2gk3 s THR 31 N -2.90 1.84 -0.02 -4.49 -4.23 -1.26 -0.67 115.64 103.91 2gk3 s THR 31 Ca 0.31 -1.40 0.02 0.00 -1.18 0.00 0.00 61.69 59.43 2gk3 s THR 31 Cb 0.04 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.27 2gk3 s THR 31 CO 0.14 0.14 -0.05 -0.94 -0.54 0.00 0.00 174.62 173.37 2gk3 s SER 32 N -1.51 0.73 0.11 3.99 1.04 -1.26 -5.00 113.70 111.80 2gk3 s SER 32 Ca 0.09 -0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.50 2gk3 s SER 32 Cb -0.09 -0.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 2gk3 s SER 32 CO 0.03 0.03 -0.23 -0.44 0.98 0.00 0.00 173.24 173.62 2gk3 s SER 33 N 0.19 2.76 -0.21 7.02 0.01 -1.26 -4.54 113.70 117.68 2gk3 s SER 33 Ca -0.02 -0.71 -0.22 0.00 1.31 0.00 0.00 55.95 56.32 2gk3 s SER 33 Cb -0.06 -0.16 0.06 0.00 0.21 0.00 0.00 66.02 66.07 2gk3 s SER 33 CO -0.00 0.09 0.60 -1.59 0.41 0.00 0.00 173.24 172.75 2gk3 s LYS 34 N -1.97 0.73 0.13 12.44 -2.85 0.32 -5.00 119.74 123.53 2gk3 s LYS 34 Ca 0.09 0.78 -0.19 0.00 -1.00 0.00 0.00 55.97 55.64 2gk3 s LYS 34 Cb -0.10 0.35 -0.07 0.00 -2.06 0.00 0.00 37.83 35.95 2gk3 s LYS 34 CO 0.05 -0.10 0.63 -0.47 0.10 0.00 0.00 175.35 175.55 2gk3 s TYR 35 N 0.18 3.75 0.05 1.78 5.04 -1.26 0.37 117.35 127.25 2gk3 s TYR 35 Ca -0.01 1.30 -0.01 0.00 -2.44 0.00 0.00 57.07 55.91 2gk3 s TYR 35 Cb -0.04 -2.53 -0.04 0.00 0.35 0.00 0.00 41.96 39.70 2gk3 s TYR 35 CO 0.02 0.49 -0.02 -1.21 -1.34 0.00 0.00 175.55 173.49 2gk3 s GLU 36 N -1.47 0.61 -0.06 4.97 2.02 0.02 -4.96 118.70 119.83 2gk3 s GLU 36 Ca 0.35 -1.19 0.05 0.00 0.02 0.00 0.00 54.97 54.20 2gk3 s GLU 36 Cb -0.18 0.21 -0.01 0.00 0.10 0.00 0.00 34.13 34.25 2gk3 s GLU 36 CO 0.20 -0.11 -0.23 -1.21 0.02 0.00 0.00 175.26 173.93 2gk3 s GLU 37 N -3.82 2.39 0.00 1.61 2.02 -1.26 -2.02 118.70 117.63 2gk3 s GLU 37 Ca 0.06 -0.82 0.22 0.00 0.02 0.00 0.00 54.97 54.45 2gk3 s GLU 37 Cb 0.07 -2.01 -0.07 0.00 0.10 0.00 0.00 34.13 32.22 2gk3 s GLU 37 CO -0.10 0.32 1.01 0.41 0.02 0.00 0.00 175.26 176.92 2gk3 n GLY 38 N 3.08 -1.05 0.56 -1.39 0.00 0.16 -4.43 105.19 102.11 2gk3 n GLY 38 Ca -0.18 -0.55 0.07 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.49 3.24 -0.26 4.61 0.00 -1.26 -4.74 120.51 120.62 2gk3 n ALA 39 Ca 0.04 -3.04 -0.02 0.00 0.00 0.00 0.00 53.44 50.42 2gk3 n ALA 39 Cb 0.33 -0.39 0.09 0.00 0.00 0.00 0.00 19.45 19.49 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 1.38 1.05 0.65 0.00 2.02 -1.93 0.32 112.91 116.40 2gk3 h THR 40 Ca -0.02 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 2gk3 h THR 40 Cb 1.08 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 2gk3 h THR 40 CO 0.01 0.15 -0.49 -0.25 0.37 0.00 0.00 175.52 175.31 2gk3 h TRP 41 N 0.83 -1.33 -0.54 3.16 2.91 -1.95 -1.67 115.95 117.37 2gk3 h TRP 41 Ca 0.30 -0.00 0.11 0.00 1.13 0.00 0.00 58.89 60.43 2gk3 h TRP 41 Cb 0.09 0.49 -0.10 0.00 -0.51 0.00 0.00 29.16 29.13 2gk3 h TRP 41 CO -0.05 -0.69 -0.13 1.25 -1.03 0.00 0.00 178.44 177.79 2gk3 h LEU 42 N -1.09 -0.50 -0.90 0.65 5.85 -1.82 0.12 115.31 117.62 2gk3 h LEU 42 Ca -0.08 0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.87 2gk3 h LEU 42 Cb 0.90 0.33 -0.07 0.00 0.37 0.00 0.00 40.66 42.20 2gk3 h LEU 42 CO 0.03 -0.18 0.56 -0.07 -0.34 0.00 0.00 178.44 178.44 2gk3 h LEU 43 N -0.00 0.87 -0.32 2.25 3.38 -0.93 0.20 115.31 120.76 2gk3 h LEU 43 Ca 0.26 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.17 2gk3 h LEU 43 Cb 0.39 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2gk3 h LEU 43 CO -0.55 0.54 -0.13 -0.08 0.09 0.00 0.00 178.44 178.30 2gk3 h GLU 44 N 0.99 0.66 -0.44 1.13 4.57 -0.29 -0.79 114.58 120.41 2gk3 h GLU 44 Ca 0.40 -0.28 0.05 0.00 -1.18 0.00 0.00 59.36 58.36 2gk3 h GLU 44 Cb 0.23 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.75 2gk3 h GLU 44 CO -0.19 0.86 0.17 0.00 -1.18 0.00 0.00 179.01 178.67 2gk3 h LEU 46 N 0.35 0.87 0.38 0.00 3.38 -0.55 -0.76 115.31 118.97 2gk3 h LEU 46 Ca 0.20 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2gk3 h LEU 46 Cb 0.17 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2gk3 h LEU 46 CO -0.19 0.96 -0.18 0.03 0.09 0.00 0.00 178.44 179.15 2gk3 h ARG 47 N 0.81 -0.49 0.00 1.13 -0.00 -0.78 -0.33 114.38 114.72 2gk3 h ARG 47 Ca 0.14 0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.66 2gk3 h ARG 47 Cb 0.55 0.11 0.00 0.00 0.00 0.00 0.00 29.97 30.63 2gk3 h ARG 47 CO 0.03 -0.26 0.00 0.87 0.00 0.00 0.00 179.97 180.62 2gk3 h LYS 48 N -0.63 0.00 -0.65 0.04 6.56 -0.98 -1.90 116.57 119.01 2gk3 h LYS 48 Ca -0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 2gk3 h LYS 48 Cb 0.46 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.12 2gk3 h LYS 48 CO 0.09 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.89 2gk3 n GLY 49 N -1.01 2.47 0.91 3.86 0.00 -0.30 -4.93 105.19 106.19 2gk3 n GLY 49 Ca -0.02 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 1.10 0.78 3.77 -0.02 0.00 -0.71 -5.02 105.19 105.09 2gk3 n GLY 50 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.15 5.14 -0.49 1.61 1.01 -0.16 -4.27 120.40 121.10 2gk3 s VAL 51 Ca 0.00 0.83 -0.16 0.00 0.00 0.00 0.00 61.98 62.65 2gk3 s VAL 51 Cb 0.00 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.73 2gk3 s VAL 51 CO 0.00 0.45 0.44 -0.62 0.00 0.00 0.00 175.10 175.37 2gk3 s ASP 52 N -0.14 6.16 -0.20 3.32 2.15 0.45 -4.07 116.67 124.35 2gk3 s ASP 52 Ca 0.23 -1.37 -0.09 0.00 0.43 0.00 0.00 52.55 51.75 2gk3 s ASP 52 Cb -0.15 -2.20 -0.05 0.00 -0.30 0.00 0.00 42.92 40.22 2gk3 s ASP 52 CO 0.10 -0.72 0.12 -0.63 -0.17 0.00 0.00 175.17 173.87 2gk3 s ILE 53 N 1.76 5.24 -0.42 4.11 -1.09 -1.26 -0.95 121.20 128.58 2gk3 s ILE 53 Ca 0.05 0.13 -0.16 0.00 -2.23 0.00 0.00 60.65 58.44 2gk3 s ILE 53 Cb -0.25 -3.40 0.03 0.00 -1.58 0.00 0.00 42.46 37.26 2gk3 s ILE 53 CO 0.07 0.43 0.37 -1.81 -1.23 0.00 0.00 174.94 172.76 2gk3 s ASP 54 N 0.50 6.15 0.73 3.58 1.01 -0.08 -4.98 116.67 123.58 2gk3 s ASP 54 Ca 0.07 -0.84 0.00 0.00 0.71 0.00 0.00 52.55 52.49 2gk3 s ASP 54 Cb -0.12 -2.19 0.14 0.00 1.01 0.00 0.00 42.92 41.76 2gk3 s ASP 54 CO -0.00 -0.53 1.00 -0.47 0.21 0.00 0.00 175.17 175.38 2gk3 s TYR 55 N 1.88 1.36 0.09 4.23 5.04 -1.26 -0.95 117.35 127.74 2gk3 s TYR 55 Ca 0.08 -0.38 -0.05 0.00 -2.44 0.00 0.00 57.07 54.28 2gk3 s TYR 55 Cb -0.19 -2.92 -0.02 0.00 0.35 0.00 0.00 41.96 39.18 2gk3 s TYR 55 CO 0.11 -1.76 0.10 -1.25 -1.34 0.00 0.00 175.55 171.41 2gk3 s PRO 57 N -5.14 0.80 0.23 4.97 0.04 -1.26 -4.98 135.00 129.66 2gk3 s PRO 57 Ca 0.67 -1.15 -0.06 0.00 0.04 0.00 0.00 61.00 60.50 2gk3 s PRO 57 Cb -0.05 0.28 0.39 0.00 0.04 0.00 0.00 34.50 35.16 2gk3 s PRO 57 CO 0.44 -0.22 1.75 0.00 0.04 0.00 0.00 177.00 179.01 2gk3 h ALA 58 N 2.90 1.00 0.00 8.56 0.00 -1.84 -1.81 119.26 128.07 2gk3 h ALA 58 Ca -0.34 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2gk3 h ALA 58 Cb 1.18 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2gk3 h ALA 58 CO 0.60 -0.14 -0.18 1.12 0.00 0.00 0.00 179.25 180.65 2gk3 h HIS 59 N 0.50 0.00 -0.35 0.00 2.07 -1.97 -1.08 115.15 114.33 2gk3 h HIS 59 Ca 0.38 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.76 2gk3 h HIS 59 Cb 0.50 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.47 2gk3 h HIS 59 CO -0.14 0.18 -0.34 1.15 -3.07 0.00 0.00 177.93 175.70 2gk3 h THR 60 N 0.00 1.28 -0.42 6.12 2.02 -1.75 -2.56 112.91 117.59 2gk3 h THR 60 Ca -0.00 -1.50 0.08 0.00 0.77 0.00 0.00 66.41 65.76 2gk3 h THR 60 Cb 0.42 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2gk3 h THR 60 CO 0.02 0.49 0.29 0.58 0.37 0.00 0.00 175.52 177.28 2gk3 h VAL 61 N 0.66 0.90 0.00 3.16 2.07 -1.04 0.76 116.25 122.75 2gk3 h VAL 61 Ca 0.07 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.39 2gk3 h VAL 61 Cb 0.89 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2gk3 h VAL 61 CO 0.08 0.04 -0.57 1.56 0.02 0.00 0.00 177.57 178.70 2gk3 h GLN 62 N 0.23 0.00 0.00 1.57 4.20 -1.33 -3.33 115.11 116.45 2gk3 h GLN 62 Ca 0.19 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.57 2gk3 h GLN 62 Cb 0.47 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.19 2gk3 h GLN 62 CO -0.04 0.57 -2.23 -0.89 -0.67 0.00 0.00 178.83 175.57 2gk3 n ILE 63 N -3.78 1.23 -2.84 2.54 5.41 -0.67 -1.22 119.36 120.03 2gk3 n ILE 63 Ca -0.01 -0.43 -0.13 0.00 1.00 0.00 0.00 62.75 63.18 2gk3 n ILE 63 Cb 0.59 -1.40 0.01 0.00 -0.71 0.00 0.00 39.64 38.13 2gk3 n ILE 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2gk3 n ALA 64 N -3.36 3.02 -2.65 -1.39 0.00 0.26 -5.00 120.51 111.38 2gk3 n ALA 64 Ca -0.40 -3.31 -0.38 0.00 0.00 0.00 0.00 53.44 49.35 2gk3 n ALA 64 Cb 0.88 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 19.36 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 -2.90 3.58 -0.40 0.00 5.36 -1.25 -4.79 117.98 117.58 2gk3 s PHE 65 Ca 0.33 1.03 -0.39 0.00 -0.96 0.00 0.00 56.93 56.93 2gk3 s PHE 65 Cb 0.42 -2.59 -0.15 0.00 -0.34 0.00 0.00 43.02 40.36 2gk3 s PHE 65 CO -0.01 0.23 2.09 -2.30 -1.46 0.00 0.00 175.22 173.76 2gk3 n PRO 66 N 3.36 0.68 0.19 10.12 -0.02 -1.26 -4.82 135.00 143.24 2gk3 n PRO 66 Ca -0.06 0.20 0.04 0.00 -2.02 0.00 0.00 63.50 61.66 2gk3 n PRO 66 Cb 0.51 -2.05 0.38 0.00 -0.02 0.00 0.00 33.50 32.33 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 10.24 0.00 -5.34 -0.52 5.08 -1.96 -3.44 114.58 118.64 2gk3 h GLU 67 Ca -0.24 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.51 2gk3 h GLU 67 Cb 1.36 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.48 2gk3 h GLU 67 CO 1.03 0.37 -0.27 0.45 -1.00 0.00 0.00 179.01 179.59 2gk3 s SER 68 N -6.71 6.36 0.59 1.42 0.15 -1.26 -4.87 113.70 109.38 2gk3 s SER 68 Ca -0.02 0.42 0.29 0.00 0.70 0.00 0.00 55.95 57.34 2gk3 s SER 68 Cb 0.13 -2.20 1.65 0.00 -1.71 0.00 0.00 66.02 63.90 2gk3 s SER 68 CO 0.70 -0.04 2.08 -0.29 1.20 0.00 0.00 173.24 176.89 2gk3 h ILE 69 N 5.03 0.44 0.00 6.45 6.09 -1.96 0.55 117.51 134.12 2gk3 h ILE 69 Ca -0.36 0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 63.04 2gk3 h ILE 69 Cb 1.16 0.82 -0.01 0.00 0.47 0.00 0.00 36.82 39.26 2gk3 h ILE 69 CO 0.70 0.00 -0.40 0.44 -3.07 0.00 0.00 178.15 175.82 2gk3 h ASP 70 N 0.00 0.00 -0.49 2.19 3.32 -1.98 -2.44 116.42 117.02 2gk3 h ASP 70 Ca 0.09 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.02 2gk3 h ASP 70 Cb 0.54 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 2gk3 h ASP 70 CO -0.00 0.40 -0.19 -0.33 -1.72 0.00 0.00 179.24 177.41 2gk3 h GLU 71 N 0.00 0.99 -0.07 3.56 5.08 -1.28 -3.07 114.58 119.79 2gk3 h GLU 71 Ca -0.00 -0.41 -0.14 0.00 -1.00 0.00 0.00 59.36 57.80 2gk3 h GLU 71 Cb 0.85 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2gk3 h GLU 71 CO 0.05 1.09 -0.59 -0.07 -1.00 0.00 0.00 179.01 178.49 2gk3 h LEU 72 N 0.85 0.28 -2.85 1.33 3.38 -1.50 -3.19 115.31 113.61 2gk3 h LEU 72 Ca 0.12 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2gk3 h LEU 72 Cb 0.76 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2gk3 h LEU 72 CO 0.06 0.81 -0.00 0.78 0.09 0.00 0.00 178.44 180.18 2gk3 h ASN 73 N 0.18 0.00 0.49 -0.43 2.35 -1.33 0.17 115.58 117.01 2gk3 h ASN 73 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 2gk3 h ASN 73 Cb 1.09 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.46 2gk3 h ASN 73 CO 0.09 0.00 -0.07 0.08 -1.65 0.00 0.00 177.43 175.89 2gk3 h ARG 74 N 0.00 0.00 -6.30 0.81 0.11 -1.60 -3.43 114.38 103.96 2gk3 h ARG 74 Ca -0.00 0.00 -0.56 0.00 0.10 0.00 0.00 59.98 59.52 2gk3 h ARG 74 Cb 0.02 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.06 2gk3 h ARG 74 CO 0.00 0.07 0.04 0.71 0.10 0.00 0.00 179.97 180.89 2gk3 s TYR 75 N -4.01 3.82 0.07 4.08 2.02 0.04 -4.91 117.35 118.45 2gk3 s TYR 75 Ca -0.02 1.38 -0.04 0.00 -0.37 0.00 0.00 57.07 58.02 2gk3 s TYR 75 Cb 0.12 -2.61 -0.28 0.00 -0.40 0.00 0.00 41.96 38.78 2gk3 s TYR 75 CO 0.54 0.52 1.12 -0.44 -1.57 0.00 0.00 175.55 175.71 2gk3 h ASP 76 N 4.70 0.42 -3.93 2.29 3.32 -0.97 -3.45 116.42 118.80 2gk3 h ASP 76 Ca -0.48 -0.46 -0.21 0.00 0.02 0.00 0.00 57.03 55.90 2gk3 h ASP 76 Cb 1.21 -0.14 -0.27 0.00 0.22 0.00 0.00 39.33 40.36 2gk3 h ASP 76 CO 0.65 1.36 -0.66 -0.69 -1.72 0.00 0.00 179.24 178.19 2gk3 s VAL 77 N -2.65 0.02 -0.12 -1.35 1.01 -1.12 -1.25 120.40 114.94 2gk3 s VAL 77 Ca -0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 2gk3 s VAL 77 Cb 0.07 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.31 2gk3 s VAL 77 CO 0.88 -0.07 -0.07 -0.63 0.00 0.00 0.00 175.10 175.22 2gk3 s ILE 78 N -0.20 3.68 -0.13 2.22 1.01 0.55 -1.37 121.20 126.96 2gk3 s ILE 78 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.17 2gk3 s ILE 78 Cb -0.02 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 39.88 2gk3 s ILE 78 CO 0.00 0.54 -0.14 -0.69 0.00 0.00 0.00 174.94 174.65 2gk3 s VAL 79 N -0.11 2.94 -0.16 2.92 1.01 0.55 -1.07 120.40 126.47 2gk3 s VAL 79 Ca 0.01 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2gk3 s VAL 79 Cb -0.13 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.04 2gk3 s VAL 79 CO 0.03 0.53 -0.20 -0.63 0.00 0.00 0.00 175.10 174.83 2gk3 s ILE 80 N 0.36 2.17 -0.16 2.22 1.01 0.38 -0.50 121.20 126.68 2gk3 s ILE 80 Ca -0.12 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.53 2gk3 s ILE 80 Cb -0.16 -1.89 0.06 0.00 0.01 0.00 0.00 42.46 40.47 2gk3 s ILE 80 CO 0.06 0.54 0.38 -0.55 0.00 0.00 0.00 174.94 175.37 2gk3 s SER 81 N 1.06 -0.46 -1.67 3.58 0.15 -0.77 -1.12 113.70 114.46 2gk3 s SER 81 Ca -0.01 0.82 -0.15 0.00 0.70 0.00 0.00 55.95 57.31 2gk3 s SER 81 Cb -0.14 0.71 0.14 0.00 -1.71 0.00 0.00 66.02 65.01 2gk3 s SER 81 CO -0.07 -0.19 0.65 0.47 1.20 0.00 0.00 173.24 175.31 2gk3 n ASP 82 N 4.27 -2.37 -3.78 5.45 8.00 -1.26 -1.19 116.55 125.68 2gk3 n ASP 82 Ca -0.24 -1.06 -0.17 0.00 0.71 0.00 0.00 54.79 54.04 2gk3 n ASP 82 Cb 0.55 -2.57 -0.16 0.00 -0.02 0.00 0.00 41.12 38.91 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 -3.46 0.05 0.47 0.53 2.07 -1.02 -4.15 121.20 115.69 2gk3 s ILE 83 Ca 0.59 0.19 -0.07 0.00 -1.41 0.00 0.00 60.65 59.96 2gk3 s ILE 83 Cb -0.33 -0.19 -0.04 0.00 0.13 0.00 0.00 42.46 42.03 2gk3 s ILE 83 CO 0.94 0.13 0.79 -0.83 -1.91 0.00 0.00 174.94 174.06 2gk3 s GLY 84 N 1.24 1.61 0.40 1.50 0.00 -1.06 -4.59 107.32 106.43 2gk3 s GLY 84 Ca -0.07 -0.42 0.16 0.00 0.00 0.00 0.00 44.72 44.39 2gk3 s GLY 84 CO -0.03 -0.24 1.85 1.48 0.00 0.00 0.00 173.10 176.16 2gk3 h SER 85 N 0.46 0.47 -0.69 1.64 4.64 -1.63 -1.74 113.55 116.69 2gk3 h SER 85 Ca -0.47 0.05 0.08 0.00 -0.47 0.00 0.00 61.79 60.98 2gk3 h SER 85 Cb 1.20 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 63.21 2gk3 h SER 85 CO 0.62 0.19 0.46 0.78 -0.87 0.00 0.00 176.83 178.01 2gk3 h ASN 86 N 0.47 0.55 -0.42 4.97 2.35 -1.87 -0.51 115.58 121.12 2gk3 h ASN 86 Ca 0.48 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 56.18 2gk3 h ASN 86 Cb 1.10 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.35 2gk3 h ASN 86 CO -0.20 0.34 0.01 0.74 -1.65 0.00 0.00 177.43 176.67 2gk3 h THR 87 N 0.62 1.26 -0.43 2.81 2.02 -1.64 0.20 112.91 117.74 2gk3 h THR 87 Ca 0.31 -1.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.41 2gk3 h THR 87 Cb 0.41 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 2gk3 h THR 87 CO -0.10 0.34 -0.06 -0.26 0.37 0.00 0.00 175.52 175.81 2gk3 h PHE 88 N 0.57 0.89 0.00 3.16 -1.00 -1.55 -3.28 116.94 115.74 2gk3 h PHE 88 Ca 0.12 -0.18 -0.15 0.00 2.81 0.00 0.00 57.97 60.57 2gk3 h PHE 88 Cb 0.47 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.78 2gk3 h PHE 88 CO 0.04 0.89 -0.74 -0.07 -1.61 0.00 0.00 178.31 176.83 2gk3 h LEU 89 N 0.64 0.00 -5.19 1.54 3.38 -0.99 -3.39 115.31 111.30 2gk3 h LEU 89 Ca 0.12 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.51 2gk3 h LEU 89 Cb 0.58 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 40.91 2gk3 h LEU 89 CO 0.03 0.74 -0.72 0.18 0.09 0.00 0.00 178.44 178.76 2gk3 n LEU 90 N -3.55 4.16 -4.63 1.67 4.77 0.68 -4.97 117.00 115.13 2gk3 n LEU 90 Ca -0.00 -5.49 -0.30 0.00 -0.03 0.00 0.00 56.01 50.19 2gk3 n LEU 90 Cb 0.74 -0.41 0.18 0.00 -2.33 0.00 0.00 43.42 41.60 2gk3 n LEU 90 CO 0.43 2.31 0.63 -1.10 -1.33 0.00 0.00 177.39 178.33 2gk3 s GLN 91 N -3.40 0.56 0.24 3.23 -0.21 -1.25 -4.56 119.66 114.27 2gk3 s GLN 91 Ca 0.48 1.18 -0.05 0.00 0.02 0.00 0.00 55.36 56.99 2gk3 s GLN 91 Cb 0.31 -1.70 0.41 0.00 1.00 0.00 0.00 33.01 33.03 2gk3 s GLN 91 CO -0.14 -2.83 1.77 -0.91 -2.12 0.00 0.00 175.29 171.06 2gk3 h ASN 92 N -1.99 0.47 0.66 5.90 2.35 -1.50 -0.50 115.58 120.96 2gk3 h ASN 92 Ca -0.50 0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.28 2gk3 h ASN 92 Cb 1.29 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.65 2gk3 h ASN 92 CO 0.47 0.24 -0.22 -0.33 -1.65 0.00 0.00 177.43 175.95 2gk3 h GLU 93 N 0.61 0.00 0.34 0.81 5.08 -1.85 0.23 114.58 119.79 2gk3 h GLU 93 Ca 0.39 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.73 2gk3 h GLU 93 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2gk3 h GLU 93 CO -0.31 0.22 -0.16 1.15 -1.00 0.00 0.00 179.01 178.91 2gk3 h THR 94 N 0.00 0.20 -0.11 1.13 2.02 -1.51 -1.01 112.91 113.63 2gk3 h THR 94 Ca -0.00 -0.73 -0.21 0.00 0.77 0.00 0.00 66.41 66.24 2gk3 h THR 94 Cb 0.61 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2gk3 h THR 94 CO 0.03 0.05 -0.77 0.15 0.37 0.00 0.00 175.52 175.34 2gk3 h PHE 95 N -1.07 0.83 0.00 3.16 3.57 -0.75 -3.40 116.94 119.27 2gk3 h PHE 95 Ca -0.05 -0.37 -0.27 0.00 3.53 0.00 0.00 57.97 60.81 2gk3 h PHE 95 Cb 0.43 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.01 2gk3 h PHE 95 CO 0.02 1.17 -1.88 0.66 -2.23 0.00 0.00 178.31 176.05 2gk3 n TYR 96 N -3.88 0.00 -1.90 0.41 4.01 0.77 -4.93 117.16 111.64 2gk3 n TYR 96 Ca -0.06 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.38 2gk3 n TYR 96 Cb 0.74 -0.57 0.06 0.00 -0.31 0.00 0.00 39.34 39.25 2gk3 n TYR 96 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2gk3 s GLN 97 N -2.30 2.62 -0.61 -0.72 -0.21 -1.11 -4.98 119.66 112.35 2gk3 s GLN 97 Ca -0.22 0.36 0.04 0.00 0.02 0.00 0.00 55.36 55.56 2gk3 s GLN 97 Cb 0.09 -2.01 0.35 0.00 1.00 0.00 0.00 33.01 32.44 2gk3 s GLN 97 CO 0.28 -1.18 1.06 1.28 -2.12 0.00 0.00 175.29 174.62 2gk3 n LEU 98 N -3.08 4.83 -4.74 2.90 4.77 -1.24 -4.22 117.00 116.21 2gk3 n LEU 98 Ca 0.07 -5.60 -0.31 0.00 -0.03 0.00 0.00 56.01 50.14 2gk3 n LEU 98 Cb 0.58 -0.61 -0.07 0.00 -2.33 0.00 0.00 43.42 40.99 2gk3 n LEU 98 CO 0.57 2.31 -0.29 -0.54 -1.33 0.00 0.00 177.39 178.12 2gk3 s LYS 99 N -3.57 2.82 0.03 3.23 1.02 -0.38 -5.04 119.74 117.84 2gk3 s LYS 99 Ca 0.48 -0.68 -0.28 0.00 0.02 0.00 0.00 55.97 55.52 2gk3 s LYS 99 Cb 0.29 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 2gk3 s LYS 99 CO -0.15 0.58 0.88 0.42 -0.92 0.00 0.00 175.35 176.16 2gk3 s ILE 100 N -1.29 4.78 0.13 2.17 1.01 -1.26 -4.15 121.20 122.58 2gk3 s ILE 100 Ca 0.26 1.86 0.04 0.00 0.00 0.00 0.00 60.65 62.81 2gk3 s ILE 100 Cb -0.12 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.09 2gk3 s ILE 100 CO 0.18 0.26 -0.10 -0.54 0.00 0.00 0.00 174.94 174.74 2gk3 s LYS 101 N 0.47 0.97 0.40 2.79 1.02 -1.26 -5.03 119.74 119.10 2gk3 s LYS 101 Ca 0.45 -1.34 -0.26 0.00 0.02 0.00 0.00 55.97 54.84 2gk3 s LYS 101 Cb -0.21 -0.57 -0.09 0.00 -0.52 0.00 0.00 37.83 36.44 2gk3 s LYS 101 CO 0.26 0.07 1.30 -1.25 -0.92 0.00 0.00 175.35 174.81 2gk3 s PRO 102 N -3.39 4.02 -0.35 -1.68 0.04 -1.26 -4.95 135.00 127.43 2gk3 s PRO 102 Ca 0.12 2.15 -0.29 0.00 0.04 0.00 0.00 61.00 63.02 2gk3 s PRO 102 Cb 0.01 -2.79 0.00 0.00 0.04 0.00 0.00 34.50 31.76 2gk3 s PRO 102 CO 0.00 -0.44 1.37 1.21 0.04 0.00 0.00 177.00 179.18 2gk3 s ASN 103 N -0.72 6.49 0.31 6.66 3.84 -1.26 -4.91 114.94 125.34 2gk3 s ASN 103 Ca 0.56 1.05 0.02 0.00 0.21 0.00 0.00 52.86 54.70 2gk3 s ASN 103 Cb -0.38 -2.54 0.59 0.00 -0.55 0.00 0.00 41.25 38.37 2gk3 s ASN 103 CO 0.49 -1.26 1.89 0.00 -2.79 0.00 0.00 177.10 175.43 2gk3 h ALA 104 N 10.06 1.57 -0.22 1.71 0.00 -1.93 -0.28 119.26 130.17 2gk3 h ALA 104 Ca -0.27 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.43 2gk3 h ALA 104 Cb 1.10 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2gk3 h ALA 104 CO 1.06 0.26 -0.62 -0.07 0.00 0.00 0.00 179.25 179.88 2gk3 h LEU 105 N 0.96 0.93 -0.47 0.00 3.38 -1.91 0.38 115.31 118.58 2gk3 h LEU 105 Ca 0.41 -0.58 0.06 0.00 0.09 0.00 0.00 57.88 57.86 2gk3 h LEU 105 Cb 0.33 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 2gk3 h LEU 105 CO -0.17 1.34 0.19 -0.33 0.09 0.00 0.00 178.44 179.56 2gk3 h GLU 106 N 0.56 0.37 0.20 1.13 4.39 -1.83 0.19 114.58 119.59 2gk3 h GLU 106 Ca -0.01 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.68 2gk3 h GLU 106 Cb 1.24 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.77 2gk3 h GLU 106 CO 0.13 0.24 -0.40 0.77 -1.16 0.00 0.00 179.01 178.59 2gk3 h SER 107 N 0.38 -1.16 -0.66 1.42 0.02 -0.70 0.14 113.55 112.99 2gk3 h SER 107 Ca 0.22 0.12 0.11 0.00 -0.84 0.00 0.00 61.79 61.41 2gk3 h SER 107 Cb 0.20 0.42 -0.08 0.00 0.14 0.00 0.00 62.40 63.08 2gk3 h SER 107 CO -0.21 -0.50 0.24 0.40 -1.14 0.00 0.00 176.83 175.62 2gk3 h ILE 108 N -0.69 0.71 0.24 3.27 2.04 -0.68 0.33 117.51 122.73 2gk3 h ILE 108 Ca 0.01 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2gk3 h ILE 108 Cb 0.68 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 2gk3 h ILE 108 CO -0.19 0.07 -0.19 0.50 0.00 0.00 0.00 178.15 178.35 2gk3 h LYS 109 N 0.40 -0.42 -0.27 2.37 3.64 -0.13 -1.57 116.57 120.59 2gk3 h LYS 109 Ca 0.35 0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.82 2gk3 h LYS 109 Cb 0.48 0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.33 2gk3 h LYS 109 CO -0.36 -0.28 -0.18 1.49 -2.27 0.00 0.00 179.45 177.85 2gk3 h GLU 110 N -0.44 -0.16 -0.76 1.90 4.57 -0.20 0.53 114.58 120.01 2gk3 h GLU 110 Ca -0.01 0.01 0.14 0.00 -1.18 0.00 0.00 59.36 58.32 2gk3 h GLU 110 Cb 0.39 0.04 -0.14 0.00 -0.16 0.00 0.00 28.75 28.87 2gk3 h GLU 110 CO -0.01 -0.11 -0.25 -0.92 -1.18 0.00 0.00 179.01 176.55 2gk3 h TYR 111 N -0.16 -0.60 -0.12 0.92 3.20 -0.20 -1.18 116.97 118.82 2gk3 h TYR 111 Ca 0.15 0.07 -0.08 0.00 3.14 0.00 0.00 58.73 62.01 2gk3 h TYR 111 Cb 0.39 0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.04 2gk3 h TYR 111 CO -0.36 -0.36 -0.23 0.28 -1.64 0.00 0.00 178.16 175.85 2gk3 h VAL 112 N -0.04 1.37 -1.08 1.81 2.07 -0.94 -1.33 116.25 118.11 2gk3 h VAL 112 Ca 0.34 -1.50 0.32 0.00 0.82 0.00 0.00 66.70 66.69 2gk3 h VAL 112 Cb 0.57 2.04 -0.13 0.00 -1.52 0.00 0.00 31.29 32.26 2gk3 h VAL 112 CO -0.80 0.44 0.66 0.50 0.02 0.00 0.00 177.57 178.39 2gk3 h LYS 113 N -0.03 0.31 -0.64 1.57 3.11 -0.50 -0.23 116.57 120.15 2gk3 h LYS 113 Ca 0.01 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 2gk3 h LYS 113 Cb 0.82 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.98 2gk3 h LYS 113 CO 0.05 0.20 0.00 0.09 -2.81 0.00 0.00 179.45 176.99 2gk3 n ASN 114 N -4.85 4.43 0.00 4.20 3.02 -0.48 -2.59 115.26 119.00 2gk3 n ASN 114 Ca 0.31 -2.54 0.00 0.00 -0.03 0.00 0.00 54.58 52.32 2gk3 n ASN 114 Cb 1.03 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 2gk3 n ASN 114 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gk3 n GLY 115 N 0.81 1.57 3.76 7.41 0.00 -0.21 -4.86 105.19 113.67 2gk3 n GLY 115 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.07 2.43 0.18 -0.02 0.00 -0.51 -4.03 107.32 103.30 2gk3 s GLY 116 Ca 0.00 0.75 -0.11 0.00 0.00 0.00 0.00 44.72 45.36 2gk3 s GLY 116 CO 0.00 1.11 0.52 -0.32 0.00 0.00 0.00 173.10 174.41 2gk3 s GLY 117 N -2.09 2.34 -0.06 0.20 0.00 -0.38 -3.53 107.32 103.79 2gk3 s GLY 117 Ca 0.71 -0.27 -0.02 0.00 0.00 0.00 0.00 44.72 45.15 2gk3 s GLY 117 CO 0.35 -0.08 0.03 -2.27 0.00 0.00 0.00 173.10 171.13 2gk3 s LEU 118 N -2.45 0.43 0.00 0.66 2.96 -0.68 -0.33 118.68 119.27 2gk3 s LEU 118 Ca 0.42 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 54.29 2gk3 s LEU 118 Cb -0.13 -0.33 0.01 0.00 0.50 0.00 0.00 46.19 46.24 2gk3 s LEU 118 CO 0.20 -0.22 0.07 -0.11 -1.32 0.00 0.00 176.35 174.97 2gk3 n LEU 119 N 5.20 0.00 -3.64 -0.68 7.94 -0.23 -0.47 117.00 125.12 2gk3 n LEU 119 Ca -0.06 -1.07 -0.08 0.00 -1.11 0.00 0.00 56.01 53.70 2gk3 n LEU 119 Cb 0.50 0.06 -0.07 0.00 0.53 0.00 0.00 43.42 44.44 2gk3 n LEU 119 CO 0.09 -0.26 0.77 -0.63 -1.11 0.00 0.00 177.39 176.24 2gk3 s ILE 121 N -1.30 0.00 0.77 1.96 1.01 -0.27 -0.47 121.20 122.90 2gk3 s ILE 121 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 60.65 60.59 2gk3 s ILE 121 Cb -0.00 -1.00 0.05 0.00 0.01 0.00 0.00 42.46 41.52 2gk3 s ILE 121 CO 0.03 0.00 1.08 -0.83 0.00 0.00 0.00 174.94 175.23 2gk3 s GLY 122 N 0.32 1.65 0.00 6.18 0.00 0.93 -4.18 107.32 112.22 2gk3 s GLY 122 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.76 2gk3 s GLY 122 CO -0.08 0.39 0.00 0.61 0.00 0.00 0.00 173.10 174.02 2gk3 n GLY 123 N -1.74 -0.84 0.21 0.20 0.00 -1.26 -3.75 105.19 98.01 2gk3 n GLY 123 Ca 0.08 -1.25 0.08 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 -0.31 1.61 -1.99 -1.96 -2.95 116.97 111.38 2gk3 h TYR 124 Ca 0.00 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.53 2gk3 h TYR 124 Cb 0.00 0.00 -0.14 0.00 2.00 0.00 0.00 36.73 38.59 2gk3 h TYR 124 CO 0.00 0.29 -0.40 1.28 -0.00 0.00 0.00 178.16 179.33 2gk3 n LEU 125 N -3.49 3.82 -4.48 3.88 4.77 -1.26 -1.03 117.00 119.21 2gk3 n LEU 125 Ca -0.00 -4.08 -0.24 0.00 -0.03 0.00 0.00 56.01 51.66 2gk3 n LEU 125 Cb 0.45 -0.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.90 2gk3 n LEU 125 CO 0.35 1.53 -0.42 -0.44 -1.33 0.00 0.00 177.39 177.08 2gk3 s SER 126 N -3.07 3.38 0.00 -1.43 0.01 -1.11 -2.42 113.70 109.07 2gk3 s SER 126 Ca 0.44 -1.13 0.00 0.00 1.31 0.00 0.00 55.95 56.57 2gk3 s SER 126 Cb 0.40 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.35 2gk3 s SER 126 CO -0.02 -0.15 0.00 0.49 0.41 0.00 0.00 173.24 173.96 2gk3 n PHE 127 N -0.66 0.00 -2.35 2.43 3.72 -1.26 -4.69 117.46 114.66 2gk3 n PHE 127 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2gk3 n PHE 127 Cb 0.62 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 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 -0.33 3.70 1.37 0.00 -1.26 -1.86 105.19 106.81 2gk3 n GLY 129 Ca 0.00 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.65 2.35 -1.16 -0.61 1.10 -0.19 -1.06 121.20 118.98 2gk3 s ILE 130 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.14 2gk3 s ILE 130 Cb 0.00 -3.00 0.00 0.00 0.15 0.00 0.00 42.46 39.61 2gk3 s ILE 130 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 174.94 172.21 2gk3 n GLU 131 N 5.23 -1.85 -1.64 3.50 1.02 -1.26 -1.07 120.64 124.57 2gk3 n GLU 131 Ca 0.17 0.65 -0.19 0.00 -0.02 0.00 0.00 57.16 57.78 2gk3 n GLU 131 Cb 0.37 -5.10 -0.07 0.00 -0.02 0.00 0.00 31.44 26.62 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 -1.18 -0.32 -0.15 0.62 0.00 -0.23 -4.76 120.51 114.49 2gk3 n ALA 132 Ca -0.14 0.29 -0.03 0.00 0.00 0.00 0.00 53.44 53.56 2gk3 n ALA 132 Cb 0.53 -1.92 0.17 0.00 0.00 0.00 0.00 19.45 18.23 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 0.88 -0.90 0.00 1.57 -1.28 -2.62 116.57 114.23 2gk3 h LYS 133 Ca -0.39 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.20 2gk3 h LYS 133 Cb 1.24 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 2gk3 h LYS 133 CO 0.56 0.79 0.53 0.00 -0.57 0.00 0.00 179.45 180.76 2gk3 h ALA 134 N 1.31 1.25 -1.57 3.86 0.00 -1.80 -3.44 119.26 118.87 2gk3 h ALA 134 Ca 0.19 -0.10 -0.31 0.00 0.00 0.00 0.00 54.91 54.68 2gk3 h ALA 134 Cb 0.30 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 2gk3 h ALA 134 CO -0.00 0.64 -0.35 -1.71 0.00 0.00 0.00 179.25 177.83 2gk3 n ASN 135 N -4.36 -4.70 0.24 0.00 5.15 -0.99 -1.76 115.26 108.84 2gk3 n ASN 135 Ca 0.10 0.15 0.11 0.00 -0.60 0.00 0.00 54.58 54.34 2gk3 n ASN 135 Cb 0.07 -3.72 0.61 0.00 -0.53 0.00 0.00 39.78 36.21 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 -0.13 1.20 -1.99 -1.68 -2.72 116.97 111.64 2gk3 h TYR 136 Ca -0.34 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.33 2gk3 h TYR 136 Cb 1.15 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.87 2gk3 h TYR 136 CO 0.42 0.17 -0.17 -0.22 -0.00 0.00 0.00 178.16 178.36 2gk3 h LYS 137 N 0.00 0.22 -0.85 4.88 3.64 -1.89 -2.27 116.57 120.29 2gk3 h LYS 137 Ca -0.00 -0.05 -0.23 0.00 -1.27 0.00 0.00 60.65 59.09 2gk3 h LYS 137 Cb 0.52 -0.03 -0.14 0.00 -0.41 0.00 0.00 32.23 32.17 2gk3 h LYS 137 CO 0.02 0.39 0.30 0.09 -2.27 0.00 0.00 179.45 177.98 2gk3 n ASN 138 N -4.25 4.20 -4.48 4.20 3.02 -1.03 -4.77 115.26 112.15 2gk3 n ASN 138 Ca -0.01 -3.07 -0.23 0.00 -0.03 0.00 0.00 54.58 51.24 2gk3 n ASN 138 Cb 0.29 -0.72 -0.10 0.00 -0.61 0.00 0.00 39.78 38.63 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 -2.59 1.79 -0.15 3.41 -4.23 -0.85 -5.03 115.64 108.00 2gk3 s THR 139 Ca 0.46 -2.12 0.24 0.00 -1.18 0.00 0.00 61.69 59.08 2gk3 s THR 139 Cb 0.37 -2.58 0.24 0.00 1.34 0.00 0.00 72.50 71.86 2gk3 s THR 139 CO 0.11 -0.22 1.72 -0.37 -0.54 0.00 0.00 174.62 175.32 2gk3 h VAL 140 N 2.15 0.00 0.00 2.29 -1.51 -1.91 -2.41 116.25 114.86 2gk3 h VAL 140 Ca -0.41 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 2gk3 h VAL 140 Cb 1.24 0.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 2gk3 h VAL 140 CO 0.69 0.00 -0.11 0.25 -1.23 0.00 0.00 177.57 177.17 2gk3 h LEU 141 N 0.00 0.00 -1.00 4.19 5.85 -1.85 -3.37 115.31 119.12 2gk3 h LEU 141 Ca 0.00 -0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.81 2gk3 h LEU 141 Cb 0.02 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 40.97 2gk3 h LEU 141 CO 0.00 0.01 0.63 0.00 -0.34 0.00 0.00 178.44 178.74 2gk3 h ALA 142 N 2.25 1.49 0.00 1.25 0.00 -1.54 -2.06 119.26 120.64 2gk3 h ALA 142 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2gk3 h ALA 142 Cb 0.88 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2gk3 h ALA 142 CO 0.00 0.27 0.00 1.05 0.00 0.00 0.00 179.25 180.57 2gk3 h GLU 143 N 1.03 0.00 0.04 0.00 4.11 -1.81 -2.74 114.58 115.21 2gk3 h GLU 143 Ca 0.49 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.67 2gk3 h GLU 143 Cb 0.43 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.69 2gk3 h GLU 143 CO -0.25 0.00 -1.05 0.28 0.07 0.00 0.00 179.01 178.06 2gk3 h VAL 144 N 0.00 1.40 -3.86 -1.06 2.07 -1.64 -3.47 116.25 109.70 2gk3 h VAL 144 Ca 0.00 -2.57 -0.51 0.00 0.82 0.00 0.00 66.70 64.44 2gk3 h VAL 144 Cb 0.48 2.56 0.04 0.00 -1.52 0.00 0.00 31.29 32.85 2gk3 h VAL 144 CO 0.00 0.76 0.54 -0.76 0.02 0.00 0.00 177.57 178.13 2gk3 s LEU 145 N -7.64 4.44 0.00 2.57 1.43 -1.04 -4.74 118.68 113.71 2gk3 s LEU 145 Ca -0.06 2.42 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 2gk3 s LEU 145 Cb 0.08 -3.71 0.00 0.00 0.03 0.00 0.00 46.19 42.59 2gk3 s LEU 145 CO 0.88 -0.37 0.78 -0.81 0.23 0.00 0.00 176.35 177.06 2gk3 n PRO 146 N 0.85 0.78 -4.42 1.29 -0.04 -1.26 -4.81 135.00 127.39 2gk3 n PRO 146 Ca 0.00 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.25 2gk3 n PRO 146 Cb 0.44 -1.01 -0.10 0.00 -0.04 0.00 0.00 33.50 32.79 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 -1.98 1.98 0.48 0.52 -7.23 -1.26 -1.69 120.40 111.21 2gk3 s VAL 147 Ca 0.00 -2.25 0.07 0.00 -1.81 0.00 0.00 61.98 57.99 2gk3 s VAL 147 Cb 0.00 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.69 2gk3 s VAL 147 CO 0.00 -0.44 0.37 -0.63 -0.31 0.00 0.00 175.10 174.09 2gk3 s ILE 148 N -2.82 2.09 0.49 -0.62 1.01 0.48 -4.81 121.20 117.03 2gk3 s ILE 148 Ca 0.27 -1.47 0.07 0.00 0.00 0.00 0.00 60.65 59.53 2gk3 s ILE 148 Cb -0.01 -2.56 0.02 0.00 0.01 0.00 0.00 42.46 39.93 2gk3 s ILE 148 CO 0.11 0.00 0.47 -0.76 0.00 0.00 0.00 174.94 174.76 2gk3 s LEU 150 N -4.18 3.12 0.10 2.97 1.43 -1.26 -0.14 118.68 120.71 2gk3 s LEU 150 Ca 0.40 -0.92 0.23 0.00 -1.03 0.00 0.00 54.13 52.82 2gk3 s LEU 150 Cb -0.02 -1.71 0.16 0.00 0.03 0.00 0.00 46.19 44.66 2gk3 s LEU 150 CO 0.24 -0.94 1.14 0.47 0.23 0.00 0.00 176.35 177.49 2gk3 n ASP 151 N -1.76 0.66 0.00 2.29 8.00 -1.26 -4.95 116.55 119.53 2gk3 n ASP 151 Ca 0.04 -0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.54 2gk3 n ASP 151 Cb 0.62 0.51 0.00 0.00 -0.02 0.00 0.00 41.12 42.23 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 1.33 5.86 3.71 0.44 0.00 -1.26 -5.04 105.19 110.23 2gk3 n GLY 152 Ca 0.02 -1.55 -0.63 0.00 0.00 0.00 0.00 46.02 43.86 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 1.49 -0.80 1.61 -0.08 -1.26 -4.64 116.55 112.87 2gk3 n ASP 153 Ca 0.00 1.15 0.08 0.00 -1.51 0.00 0.00 54.79 54.51 2gk3 n ASP 153 Cb 0.00 -0.98 0.16 0.00 2.34 0.00 0.00 41.12 42.64 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 4.15 2.91 -4.77 1.67 5.68 -1.25 -4.96 116.55 119.99 2gk3 n ASP 154 Ca 0.28 -1.86 -0.40 0.00 -0.50 0.00 0.00 54.79 52.31 2gk3 n ASP 154 Cb 0.02 -0.19 -0.01 0.00 -1.14 0.00 0.00 41.12 39.80 2gk3 n ASP 154 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2gk3 s ARG 155 N -1.14 4.02 -0.24 0.11 0.52 -1.26 0.56 118.95 121.51 2gk3 s ARG 155 Ca 0.27 2.20 0.00 0.00 -0.52 0.00 0.00 55.73 57.69 2gk3 s ARG 155 Cb 0.16 -2.81 0.04 0.00 0.52 0.00 0.00 34.95 32.85 2gk3 s ARG 155 CO 0.22 -0.46 -0.10 0.08 0.02 0.00 0.00 175.30 175.05 2gk3 s VAL 156 N -1.23 2.47 -0.14 3.52 1.01 -0.00 -4.82 120.40 121.21 2gk3 s VAL 156 Ca 0.56 -1.24 -0.20 0.00 0.00 0.00 0.00 61.98 61.09 2gk3 s VAL 156 Cb -0.39 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2gk3 s VAL 156 CO 0.51 0.17 0.56 -1.61 0.00 0.00 0.00 175.10 174.72 2gk3 s GLU 157 N 1.24 4.31 -0.51 2.72 0.41 -1.26 -2.15 118.70 123.45 2gk3 s GLU 157 Ca -0.02 0.56 0.07 0.00 -0.41 0.00 0.00 54.97 55.17 2gk3 s GLU 157 Cb -0.17 -3.49 0.27 0.00 -1.78 0.00 0.00 34.13 28.96 2gk3 s GLU 157 CO -0.06 0.01 0.68 1.63 -0.49 0.00 0.00 175.26 177.03 2gk3 n LYS 158 N 4.14 1.75 0.29 1.61 4.76 -0.27 -4.95 118.16 125.49 2gk3 n LYS 158 Ca -0.04 -4.01 0.19 0.00 -2.87 0.00 0.00 58.31 51.57 2gk3 n LYS 158 Cb 0.51 -1.80 0.97 0.00 -1.84 0.00 0.00 35.03 32.87 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 3.89 0.00 -0.00 1.97 0.13 -1.91 0.41 132.00 136.49 2gk3 h PRO 159 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2gk3 h PRO 159 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2gk3 h PRO 159 CO 0.66 0.00 -0.24 -0.85 -0.23 0.00 0.00 178.00 177.34 2gk3 n GLU 160 N -3.33 0.16 0.00 0.86 0.00 -1.26 -5.01 120.64 112.06 2gk3 n GLU 160 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 57.16 57.09 2gk3 n GLU 160 Cb 0.24 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.18 2gk3 n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2gk3 n GLY 161 N 1.45 -0.03 3.29 -1.84 0.00 0.13 -5.10 105.19 103.10 2gk3 n GLY 161 Ca 0.08 -1.53 -0.11 0.00 0.00 0.00 0.00 46.02 44.46 2gk3 n GLY 161 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2gk3 s ILE 162 N -2.69 -0.02 0.42 -0.61 1.10 -0.16 -4.92 121.20 114.32 2gk3 s ILE 162 Ca 0.00 0.06 -0.19 0.00 -0.51 0.00 0.00 60.65 60.01 2gk3 s ILE 162 Cb 0.00 -0.61 -0.10 0.00 0.15 0.00 0.00 42.46 41.90 2gk3 s ILE 162 CO 0.00 0.03 0.92 0.00 -2.11 0.00 0.00 174.94 173.77 2gk3 s ALA 164 N -2.22 2.89 -0.00 0.00 0.00 -0.83 -4.44 121.76 117.16 2gk3 s ALA 164 Ca 0.60 0.39 0.03 0.00 0.00 0.00 0.00 51.96 52.98 2gk3 s ALA 164 Cb -0.09 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 2gk3 s ALA 164 CO 0.17 -0.43 -0.10 -1.21 0.00 0.00 0.00 175.76 174.18 2gk3 s GLU 165 N -3.77 0.80 -0.12 0.00 2.02 0.31 -4.78 118.70 113.16 2gk3 s GLU 165 Ca 0.63 -0.40 -0.19 0.00 0.02 0.00 0.00 54.97 55.03 2gk3 s GLU 165 Cb -0.14 -0.77 -0.04 0.00 0.10 0.00 0.00 34.13 33.29 2gk3 s GLU 165 CO 0.29 0.21 0.52 0.00 0.02 0.00 0.00 175.26 176.30 2gk3 s ALA 166 N -0.31 3.46 -0.01 5.21 0.00 -1.26 0.21 121.76 129.05 2gk3 s ALA 166 Ca 0.03 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 51.92 2gk3 s ALA 166 Cb -0.04 -2.72 -0.12 0.00 0.00 0.00 0.00 23.12 20.23 2gk3 s ALA 166 CO -0.00 -0.07 0.17 1.33 0.00 0.00 0.00 175.76 177.18 2gk3 n VAL 167 N 3.80 0.03 -3.57 0.00 0.24 -0.10 -4.66 118.33 114.06 2gk3 n VAL 167 Ca -0.06 -0.19 -0.27 0.00 -2.04 0.00 0.00 64.34 61.78 2gk3 n VAL 167 Cb 0.51 0.25 -0.10 0.00 -1.47 0.00 0.00 33.84 33.04 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 -1.81 2.46 0.30 -1.34 7.64 -1.03 -4.96 113.62 114.88 2gk3 n SER 168 Ca -0.02 -3.12 0.20 0.00 1.01 0.00 0.00 58.87 56.94 2gk3 n SER 168 Cb 0.24 -0.68 0.95 0.00 -1.01 0.00 0.00 64.21 63.70 2gk3 n SER 168 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2gk3 h PRO 169 N 4.81 0.00 -0.01 1.43 0.11 -1.83 -2.17 132.00 134.34 2gk3 h PRO 169 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2gk3 h PRO 169 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2gk3 h PRO 169 CO 0.68 0.00 -0.16 -0.85 -0.21 0.00 0.00 178.00 177.46 2gk3 n GLU 170 N -3.00 1.26 -1.81 1.05 0.00 -1.26 -3.48 120.64 113.40 2gk3 n GLU 170 Ca -0.01 -0.79 -0.41 0.00 0.00 0.00 0.00 57.16 55.94 2gk3 n GLU 170 Cb 0.17 -1.48 -0.01 0.00 0.00 0.00 0.00 31.44 30.11 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 -2.28 2.77 0.50 -1.84 2.46 -0.82 -4.73 115.29 111.35 2gk3 s HIS 171 Ca 0.29 0.86 0.30 0.00 0.47 0.00 0.00 55.06 56.99 2gk3 s HIS 171 Cb 0.20 -4.03 1.41 0.00 -0.13 0.00 0.00 32.58 30.03 2gk3 s HIS 171 CO 0.44 -3.39 1.82 -1.00 -2.47 0.00 0.00 174.74 170.14 2gk3 h PRO 172 N 4.64 0.11 -0.29 2.88 0.13 -1.91 0.22 132.00 137.78 2gk3 h PRO 172 Ca -0.47 -0.01 -0.16 0.00 -0.87 0.00 0.00 66.00 64.49 2gk3 h PRO 172 Cb 1.22 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2gk3 h PRO 172 CO 0.77 0.07 -0.44 0.28 -0.23 0.00 0.00 178.00 178.46 2gk3 h VAL 173 N 0.11 1.29 -0.01 1.56 2.07 -1.90 -3.33 116.25 116.05 2gk3 h VAL 173 Ca 0.54 -1.62 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2gk3 h VAL 173 Cb 1.92 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.30 2gk3 h VAL 173 CO -0.09 0.53 -0.31 1.33 0.02 0.00 0.00 177.57 179.05 2gk3 n VAL 174 N -4.11 0.00 -1.70 2.57 0.24 -0.87 -4.72 118.33 109.74 2gk3 n VAL 174 Ca -0.04 -0.34 -0.54 0.00 -2.04 0.00 0.00 64.34 61.38 2gk3 n VAL 174 Cb 0.57 1.09 -0.06 0.00 -1.47 0.00 0.00 33.84 33.96 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 -0.55 2.81 0.00 -1.34 5.15 0.73 -0.49 115.26 121.57 2gk3 n ASN 175 Ca 0.04 1.02 0.00 0.00 -0.60 0.00 0.00 54.58 55.04 2gk3 n ASN 175 Cb 0.21 -1.23 0.00 0.00 -0.53 0.00 0.00 39.78 38.23 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 4.35 3.31 3.76 8.20 0.00 -1.26 -5.02 105.19 118.53 2gk3 n GLY 176 Ca 0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.86 2.47 0.35 1.61 0.08 0.36 -5.05 117.98 114.94 2gk3 s PHE 177 Ca 0.00 1.54 -0.08 0.00 0.12 0.00 0.00 56.93 58.51 2gk3 s PHE 177 Cb 0.00 -3.36 0.02 0.00 -0.57 0.00 0.00 43.02 39.11 2gk3 s PHE 177 CO 0.00 -1.98 0.60 -1.54 -0.10 0.00 0.00 175.22 172.19 2gk3 s SER 178 N -1.92 0.50 -1.15 1.36 1.04 -1.26 -5.01 113.70 107.27 2gk3 s SER 178 Ca 0.73 -1.31 -0.22 0.00 0.48 0.00 0.00 55.95 55.63 2gk3 s SER 178 Cb -0.26 0.73 -0.00 0.00 0.10 0.00 0.00 66.02 66.59 2gk3 s SER 178 CO 0.35 -1.44 0.78 -0.67 0.98 0.00 0.00 173.24 173.24 2gk3 n ASP 179 N -1.34 -5.19 -4.75 7.02 2.03 -1.26 -4.85 116.55 108.21 2gk3 n ASP 179 Ca -0.03 -1.04 -0.41 0.00 0.52 0.00 0.00 54.79 53.83 2gk3 n ASP 179 Cb 0.61 -3.24 -0.02 0.00 -0.72 0.00 0.00 41.12 37.76 2gk3 n ASP 179 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2gk3 s TYR 180 N -3.47 2.78 1.02 -0.67 1.51 -1.26 -4.98 117.35 112.28 2gk3 s TYR 180 Ca 0.48 0.80 -0.17 0.00 -1.01 0.00 0.00 57.07 57.16 2gk3 s TYR 180 Cb -0.18 -4.05 0.23 0.00 -0.11 0.00 0.00 41.96 37.86 2gk3 s TYR 180 CO 0.87 -3.51 1.30 -1.25 -1.11 0.00 0.00 175.55 171.85 2gk3 s PRO 181 N -0.47 0.16 -0.07 -1.71 0.04 -1.26 -4.62 135.00 127.08 2gk3 s PRO 181 Ca 0.63 -0.42 -0.07 0.00 0.04 0.00 0.00 61.00 61.17 2gk3 s PRO 181 Cb -0.47 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2gk3 s PRO 181 CO 0.47 -2.74 0.20 0.08 0.04 0.00 0.00 177.00 175.06 2gk3 s VAL 182 N -3.78 5.40 0.11 -0.36 1.01 -1.26 -1.96 120.40 119.55 2gk3 s VAL 182 Ca 0.75 0.25 0.10 0.00 0.00 0.00 0.00 61.98 63.07 2gk3 s VAL 182 Cb -0.04 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2gk3 s VAL 182 CO 0.54 0.53 -0.24 -0.36 0.00 0.00 0.00 175.10 175.57 2gk3 s PHE 183 N -1.12 2.39 -2.24 5.22 0.40 0.17 -4.10 117.98 118.71 2gk3 s PHE 183 Ca 0.20 -0.34 0.22 0.00 -0.60 0.00 0.00 56.93 56.41 2gk3 s PHE 183 Cb -0.13 -1.31 0.54 0.00 0.51 0.00 0.00 43.02 42.63 2gk3 s PHE 183 CO 0.09 0.32 1.46 1.28 0.70 0.00 0.00 175.22 179.08 2gk3 n LEU 184 N 1.03 3.48 0.00 -0.37 4.32 0.35 -0.99 117.00 124.82 2gk3 n LEU 184 Ca -0.17 -1.62 0.00 0.00 -0.02 0.00 0.00 56.01 54.20 2gk3 n LEU 184 Cb 0.53 -0.35 0.00 0.00 -1.62 0.00 0.00 43.42 41.98 2gk3 n LEU 184 CO 0.25 0.81 0.00 0.61 -1.22 0.00 0.00 177.39 177.84 2gk3 n GLY 185 N 1.53 -0.09 3.49 -0.72 0.00 -1.26 -1.11 105.19 107.03 2gk3 n GLY 185 Ca 0.21 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.39 0.13 1.61 -0.85 -0.92 -4.58 117.35 110.36 2gk3 s TYR 186 Ca 0.00 0.23 -0.30 0.00 -0.52 0.00 0.00 57.07 56.48 2gk3 s TYR 186 Cb 0.00 0.54 -0.06 0.00 0.38 0.00 0.00 41.96 42.82 2gk3 s TYR 186 CO 0.00 -0.61 1.08 -0.80 -1.52 0.00 0.00 175.55 173.70 2gk3 s ASN 187 N -2.54 7.28 -0.14 -0.18 -0.87 -1.26 -0.82 114.94 116.41 2gk3 s ASN 187 Ca 0.04 1.98 -0.20 0.00 -1.57 0.00 0.00 52.86 53.11 2gk3 s ASN 187 Cb -0.01 -2.59 -0.03 0.00 -0.02 0.00 0.00 41.25 38.59 2gk3 s ASN 187 CO -0.10 -0.24 0.57 -1.58 -2.57 0.00 0.00 177.10 173.18 2gk3 s GLN 188 N 0.11 4.31 0.30 -0.60 0.74 0.19 -4.83 119.66 119.87 2gk3 s GLN 188 Ca 0.51 0.59 -0.01 0.00 0.05 0.00 0.00 55.36 56.49 2gk3 s GLN 188 Cb -0.27 -3.50 -0.01 0.00 1.10 0.00 0.00 33.01 30.32 2gk3 s GLN 188 CO 0.32 -0.02 0.36 0.00 -0.55 0.00 0.00 175.29 175.40 2gk3 s ALA 189 N 1.16 0.95 -0.12 1.58 0.00 -1.26 -4.18 121.76 119.90 2gk3 s ALA 189 Ca 0.29 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.69 2gk3 s ALA 189 Cb -0.16 1.27 0.01 0.00 0.00 0.00 0.00 23.12 24.23 2gk3 s ALA 189 CO 0.12 -0.73 -0.22 0.08 0.00 0.00 0.00 175.76 175.01 2gk3 s VAL 190 N -3.52 1.98 0.28 0.00 1.01 0.80 -4.46 120.40 116.49 2gk3 s VAL 190 Ca 0.33 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 2gk3 s VAL 190 Cb 0.02 -1.74 -0.11 0.00 0.00 0.00 0.00 36.38 34.55 2gk3 s VAL 190 CO 0.19 0.54 1.53 0.00 0.00 0.00 0.00 175.10 177.35 2gk3 s ALA 191 N 0.61 3.69 0.54 5.51 0.00 -1.26 0.18 121.76 131.03 2gk3 s ALA 191 Ca -0.13 1.48 -0.21 0.00 0.00 0.00 0.00 51.96 53.10 2gk3 s ALA 191 Cb -0.17 -3.61 -0.05 0.00 0.00 0.00 0.00 23.12 19.29 2gk3 s ALA 191 CO 0.03 -0.90 1.26 1.03 0.00 0.00 0.00 175.76 177.19 2gk3 s ARG 192 N -0.56 3.21 0.36 0.00 0.52 -0.68 -4.79 118.95 117.01 2gk3 s ARG 192 Ca 0.61 1.99 0.10 0.00 -0.52 0.00 0.00 55.73 57.92 2gk3 s ARG 192 Cb -0.45 -2.17 0.86 0.00 0.52 0.00 0.00 34.95 33.70 2gk3 s ARG 192 CO 0.47 -1.06 1.86 -0.44 0.02 0.00 0.00 175.30 176.14 2gk3 h ASP 193 N 1.39 0.62 1.57 0.23 3.32 -1.94 -1.47 116.42 120.13 2gk3 h ASP 193 Ca -0.50 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.57 2gk3 h ASP 193 Cb 1.29 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.76 2gk3 h ASP 193 CO 0.57 0.29 -0.13 -0.78 -1.72 0.00 0.00 179.24 177.47 2gk3 h ASP 194 N 0.64 0.00 -4.22 6.45 1.82 -1.96 -3.47 116.42 115.69 2gk3 h ASP 194 Ca 0.47 0.00 -0.50 0.00 -0.39 0.00 0.00 57.03 56.60 2gk3 h ASP 194 Cb 0.83 0.00 0.05 0.00 0.68 0.00 0.00 39.33 40.89 2gk3 h ASP 194 CO -0.22 0.13 0.37 0.00 -1.61 0.00 0.00 179.24 177.90 2gk3 s ALA 195 N -3.31 3.15 -0.23 -0.78 0.00 -0.55 -4.99 121.76 115.05 2gk3 s ALA 195 Ca 0.04 -0.13 -0.06 0.00 0.00 0.00 0.00 51.96 51.81 2gk3 s ALA 195 Cb 0.07 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.16 2gk3 s ALA 195 CO 0.66 -0.59 0.04 -0.51 0.00 0.00 0.00 175.76 175.35 2gk3 s ASP 196 N -4.07 5.03 -0.32 0.00 1.01 -0.08 -4.88 116.67 113.37 2gk3 s ASP 196 Ca 0.54 -0.19 -0.13 0.00 0.71 0.00 0.00 52.55 53.48 2gk3 s ASP 196 Cb -0.11 -1.88 -0.03 0.00 1.01 0.00 0.00 42.92 41.91 2gk3 s ASP 196 CO 0.51 0.02 0.28 -0.69 0.21 0.00 0.00 175.17 175.49 2gk3 s VAL 197 N 1.31 5.25 -0.21 -1.27 1.01 -1.26 -0.73 120.40 124.49 2gk3 s VAL 197 Ca 0.04 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 2gk3 s VAL 197 Cb -0.15 -3.69 -0.12 0.00 0.00 0.00 0.00 36.38 32.42 2gk3 s VAL 197 CO 0.02 0.05 -0.21 0.52 0.00 0.00 0.00 175.10 175.49 2gk3 n VAL 198 N 5.13 1.19 -4.61 2.92 0.31 0.73 -4.41 118.33 119.58 2gk3 n VAL 198 Ca -0.12 -0.41 -0.29 0.00 -0.01 0.00 0.00 64.34 63.51 2gk3 n VAL 198 Cb 0.50 -1.39 -0.14 0.00 -0.91 0.00 0.00 33.84 31.90 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 -6.49 2.25 0.22 7.52 1.43 -1.14 -0.93 118.68 121.54 2gk3 s LEU 199 Ca -0.29 -0.67 0.11 0.00 -1.03 0.00 0.00 54.13 52.25 2gk3 s LEU 199 Cb 0.08 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 2gk3 s LEU 199 CO 0.45 0.21 -0.20 0.42 0.23 0.00 0.00 176.35 177.45 2gk3 s THR 200 N -0.95 2.21 -0.04 5.49 -4.23 0.13 -0.67 115.64 117.58 2gk3 s THR 200 Ca 0.12 -2.15 -0.01 0.00 -1.18 0.00 0.00 61.69 58.48 2gk3 s THR 200 Cb -0.10 -2.11 0.03 0.00 1.34 0.00 0.00 72.50 71.66 2gk3 s THR 200 CO 0.04 -0.30 0.01 -0.51 -0.54 0.00 0.00 174.62 173.32 2gk3 s ILE 201 N -2.16 0.17 -1.56 2.99 2.07 0.95 -0.53 121.20 123.14 2gk3 s ILE 201 Ca 0.23 0.17 0.00 0.00 -1.41 0.00 0.00 60.65 59.64 2gk3 s ILE 201 Cb -0.06 -0.33 0.00 0.00 0.13 0.00 0.00 42.46 42.21 2gk3 s ILE 201 CO 0.10 0.19 0.00 -3.20 -1.91 0.00 0.00 174.94 170.12 2gk3 n ASN 202 N 4.71 -4.53 0.00 4.50 5.15 -1.26 -0.32 115.26 123.51 2gk3 n ASN 202 Ca -0.15 0.26 0.00 0.00 -0.60 0.00 0.00 54.58 54.08 2gk3 n ASN 202 Cb 0.50 -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 -1.35 -1.45 -4.91 1.20 5.03 -1.26 -5.03 115.26 107.49 2gk3 n ASN 203 Ca -0.18 0.00 -0.22 0.00 0.87 0.00 0.00 54.58 55.05 2gk3 n ASN 203 Cb 0.59 -0.24 -0.03 0.00 -1.02 0.00 0.00 39.78 39.07 2gk3 n ASN 203 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2gk3 s ASP 204 N -2.51 6.00 0.34 6.41 1.01 0.56 -5.08 116.67 123.41 2gk3 s ASP 204 Ca 0.00 -0.03 -0.29 0.00 0.71 0.00 0.00 52.55 52.94 2gk3 s ASP 204 Cb 0.00 -1.69 -0.11 0.00 1.01 0.00 0.00 42.92 42.14 2gk3 s ASP 204 CO 0.00 -0.03 1.41 -2.84 0.21 0.00 0.00 175.17 173.92 2gk3 s PRO 205 N -3.75 4.22 -0.04 8.23 0.02 -1.26 -0.03 135.00 142.38 2gk3 s PRO 205 Ca 0.33 2.41 -0.00 0.00 0.02 0.00 0.00 61.00 63.76 2gk3 s PRO 205 Cb -0.09 -3.02 -0.03 0.00 0.02 0.00 0.00 34.50 31.38 2gk3 s PRO 205 CO 0.27 -0.39 -0.04 -0.11 -0.33 0.00 0.00 177.00 176.40 2gk3 n LEU 206 N 0.82 2.47 -3.95 -5.54 7.94 0.15 -4.54 117.00 114.34 2gk3 n LEU 206 Ca 0.01 -0.01 -0.28 0.00 -1.11 0.00 0.00 56.01 54.62 2gk3 n LEU 206 Cb 0.40 -0.15 -0.17 0.00 0.53 0.00 0.00 43.42 44.04 2gk3 n LEU 206 CO 0.62 0.48 -0.46 -0.22 -1.11 0.00 0.00 177.39 176.69 2gk3 s LEU 207 N -5.45 1.42 -0.01 -1.96 2.96 -0.81 -4.17 118.68 110.66 2gk3 s LEU 207 Ca -0.06 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.49 2gk3 s LEU 207 Cb 0.02 -0.99 -0.01 0.00 0.50 0.00 0.00 46.19 45.71 2gk3 s LEU 207 CO 0.10 -0.09 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.23 2gk3 s VAL 208 N 1.61 0.87 -0.02 1.68 1.01 -0.57 -0.20 120.40 124.80 2gk3 s VAL 208 Ca 0.05 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.62 2gk3 s VAL 208 Cb -0.13 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 2gk3 s VAL 208 CO -0.09 0.25 -0.19 -0.36 0.00 0.00 0.00 175.10 174.71 2gk3 s PHE 209 N -0.20 1.72 0.00 5.22 0.08 0.09 -0.63 117.98 124.25 2gk3 s PHE 209 Ca 0.03 -0.33 0.00 0.00 0.12 0.00 0.00 56.93 56.76 2gk3 s PHE 209 Cb -0.05 -1.11 0.00 0.00 -0.57 0.00 0.00 43.02 41.30 2gk3 s PHE 209 CO -0.00 -0.03 0.00 0.41 -0.10 0.00 0.00 175.22 175.50 2gk3 n GLY 210 N 2.61 3.54 3.19 4.36 0.00 0.79 -0.90 105.19 118.79 2gk3 n GLY 210 Ca -0.15 -1.43 -0.16 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.65 0.87 -0.20 1.61 2.02 -1.26 -1.45 118.70 118.64 2gk3 s GLU 211 Ca 0.00 -1.12 -0.04 0.00 0.02 0.00 0.00 54.97 53.83 2gk3 s GLU 211 Cb 0.00 -0.67 0.07 0.00 0.10 0.00 0.00 34.13 33.63 2gk3 s GLU 211 CO 0.00 0.12 0.08 -0.47 0.02 0.00 0.00 175.26 175.01 2gk3 s TYR 212 N -2.08 0.51 0.00 1.61 5.04 0.22 -4.86 117.35 117.80 2gk3 s TYR 212 Ca 0.04 -0.59 0.00 0.00 -2.44 0.00 0.00 57.07 54.08 2gk3 s TYR 212 Cb -0.05 -0.85 0.00 0.00 0.35 0.00 0.00 41.96 41.40 2gk3 s TYR 212 CO 0.01 -0.59 0.00 1.04 -1.34 0.00 0.00 175.55 174.67 2gk3 n GLN 213 N 5.19 0.00 0.10 4.97 1.13 -1.26 -1.31 117.38 126.20 2gk3 n GLN 213 Ca -0.07 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 54.95 2gk3 n GLN 213 Cb 0.47 0.00 0.11 0.00 0.11 0.00 0.00 30.24 30.93 2gk3 n GLN 213 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 2gk3 h GLN 214 N 0.00 0.13 -7.18 -1.09 4.20 -1.70 -3.47 115.11 105.99 2gk3 h GLN 214 Ca 0.00 -0.10 -0.49 0.00 0.06 0.00 0.00 58.65 58.12 2gk3 h GLN 214 Cb 0.00 0.02 0.06 0.00 0.30 0.00 0.00 27.48 27.86 2gk3 h GLN 214 CO 0.00 0.75 0.24 0.20 -0.67 0.00 0.00 178.83 179.35 2gk3 s GLY 215 N -4.43 1.59 0.06 3.46 0.00 -0.43 -4.51 107.32 103.07 2gk3 s GLY 215 Ca -0.03 -0.51 0.06 0.00 0.00 0.00 0.00 44.72 44.25 2gk3 s GLY 215 CO 0.79 -0.24 -0.11 0.54 0.00 0.00 0.00 173.10 174.09 2gk3 s LYS 216 N -5.04 2.23 0.02 2.90 1.02 -1.23 -0.61 119.74 119.03 2gk3 s LYS 216 Ca 0.54 -0.93 0.06 0.00 0.02 0.00 0.00 55.97 55.65 2gk3 s LYS 216 Cb -0.11 -2.33 -0.02 0.00 -0.52 0.00 0.00 37.83 34.85 2gk3 s LYS 216 CO 0.48 0.54 -0.17 0.95 -0.92 0.00 0.00 175.35 176.23 2gk3 s THR 217 N -1.09 1.34 0.07 2.17 -4.23 -0.53 -1.68 115.64 111.69 2gk3 s THR 217 Ca 0.19 -0.91 0.07 0.00 -1.18 0.00 0.00 61.69 59.85 2gk3 s THR 217 Cb -0.11 -1.16 -0.03 0.00 1.34 0.00 0.00 72.50 72.55 2gk3 s THR 217 CO 0.10 0.23 -0.18 0.00 -0.54 0.00 0.00 174.62 174.23 2gk3 s ALA 218 N -0.62 1.54 -0.06 3.99 0.00 0.38 -0.14 121.76 126.84 2gk3 s ALA 218 Ca 0.05 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.94 2gk3 s ALA 218 Cb -0.07 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.85 2gk3 s ALA 218 CO 0.01 0.29 -0.08 0.00 0.00 0.00 0.00 175.76 175.98 2gk3 n PHE 220 N 4.03 0.07 0.00 0.00 7.35 -1.26 -1.50 117.46 126.15 2gk3 n PHE 220 Ca -0.23 -2.27 0.00 0.00 -0.76 0.00 0.00 57.45 54.19 2gk3 n PHE 220 Cb 0.51 -0.38 0.00 0.00 0.35 0.00 0.00 39.48 39.96 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 -1.62 0.00 -4.89 -2.13 2.88 -1.26 -0.05 113.62 106.55 2gk3 n SER 222 Ca -0.09 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.14 2gk3 n SER 222 Cb 0.60 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 64.01 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 6.54 0.19 -3.46 -1.08 -1.25 -1.26 116.67 116.35 2gk3 s ASP 223 Ca 0.00 0.73 0.26 0.00 -0.52 0.00 0.00 52.55 53.01 2gk3 s ASP 223 Cb 0.00 -2.15 0.88 0.00 -1.46 0.00 0.00 42.92 40.20 2gk3 s ASP 223 CO 0.00 -0.02 1.77 0.00 0.52 0.00 0.00 175.17 177.44 2gk3 s SER 225 N -4.29 1.26 0.71 0.00 0.01 -1.26 -4.87 113.70 105.26 2gk3 s SER 225 Ca 0.10 -1.45 -0.16 0.00 1.31 0.00 0.00 55.95 55.75 2gk3 s SER 225 Cb 0.12 0.27 0.03 0.00 0.21 0.00 0.00 66.02 66.65 2gk3 s SER 225 CO 0.55 -0.80 1.21 -2.84 0.41 0.00 0.00 173.24 171.76 2gk3 s PRO 226 N -3.96 2.28 0.07 12.44 0.02 -1.18 -1.09 135.00 143.58 2gk3 s PRO 226 Ca 0.37 1.77 0.23 0.00 0.02 0.00 0.00 61.00 63.39 2gk3 s PRO 226 Cb 0.07 -1.85 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 2gk3 s PRO 226 CO 0.15 -1.73 0.96 -2.39 -0.33 0.00 0.00 177.00 173.66 2gk3 n HIS 227 N -2.54 0.36 -0.18 6.54 1.44 -1.26 -4.78 115.22 114.80 2gk3 n HIS 227 Ca 0.13 0.10 -0.08 0.00 -2.01 0.00 0.00 57.72 55.87 2gk3 n HIS 227 Cb 0.50 -0.54 0.02 0.00 0.12 0.00 0.00 29.99 30.09 2gk3 n HIS 227 CO 0.00 0.00 0.00 -1.49 -2.81 0.00 0.00 176.34 172.04 2gk3 h TRP 228 N 0.00 0.73 -3.01 -1.40 6.55 -1.88 -3.37 115.95 113.58 2gk3 h TRP 228 Ca 0.00 -0.03 -0.57 0.00 0.95 0.00 0.00 58.89 59.24 2gk3 h TRP 228 Cb 0.81 -0.23 -0.09 0.00 -0.86 0.00 0.00 29.16 28.79 2gk3 h TRP 228 CO 0.00 0.57 0.86 0.20 -1.05 0.00 0.00 178.44 179.02 2gk3 s GLY 229 N -2.93 1.17 0.98 1.49 0.00 -0.25 -0.50 107.32 107.29 2gk3 s GLY 229 Ca -0.13 -1.10 -0.11 0.00 0.00 0.00 0.00 44.72 43.38 2gk3 s GLY 229 CO 0.76 2.39 1.09 -0.51 0.00 0.00 0.00 173.10 176.83 2gk3 s THR 230 N 4.78 2.34 0.44 0.90 -4.23 -1.26 -3.08 115.64 115.53 2gk3 s THR 230 Ca 0.37 0.11 0.17 0.00 -1.18 0.00 0.00 61.69 61.16 2gk3 s THR 230 Cb -0.09 -2.36 0.37 0.00 1.34 0.00 0.00 72.50 71.75 2gk3 s THR 230 CO 0.21 -0.14 1.92 1.56 -0.54 0.00 0.00 174.62 177.62 2gk3 h GLN 231 N -1.94 0.36 -0.29 3.99 1.08 -1.92 -2.69 115.11 113.69 2gk3 h GLN 231 Ca -0.51 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 56.63 2gk3 h GLN 231 Cb 1.29 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 2gk3 h GLN 231 CO 0.50 0.24 0.04 0.37 -0.95 0.00 0.00 178.83 179.03 2gk3 h GLN 232 N 0.37 0.49 -0.55 1.46 4.15 -1.91 -2.53 115.11 116.59 2gk3 h GLN 232 Ca 0.37 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.66 2gk3 h GLN 232 Cb 0.92 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.56 2gk3 h GLN 232 CO -0.11 0.60 0.00 0.34 -1.93 0.00 0.00 178.83 177.73 2gk3 n PHE 233 N -4.63 0.00 0.00 3.99 7.35 -1.01 -1.43 117.46 121.72 2gk3 n PHE 233 Ca -0.03 -0.02 0.00 0.00 -0.76 0.00 0.00 57.45 56.65 2gk3 n PHE 233 Cb 0.22 -0.04 0.00 0.00 0.35 0.00 0.00 39.48 40.01 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 0.53 0.00 -4.74 -2.13 3.41 -0.95 -4.62 113.62 105.12 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 0.05 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.98 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 2.86 0.49 7.33 -0.00 -0.51 -4.91 118.94 124.20 2gk3 s TRP 236 Ca 0.00 0.63 0.28 0.00 -0.00 0.00 0.00 56.10 57.01 2gk3 s TRP 236 Cb 0.00 -4.06 1.37 0.00 -0.00 0.00 0.00 33.47 30.78 2gk3 s TRP 236 CO 0.00 -3.77 1.84 -1.35 -0.00 0.00 0.00 176.95 173.67 2gk3 h PRO 237 N 5.76 0.13 -0.38 5.86 0.11 -1.90 -0.50 132.00 141.08 2gk3 h PRO 237 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2gk3 h PRO 237 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2gk3 h PRO 237 CO 0.86 0.09 0.00 1.19 -0.21 0.00 0.00 178.00 179.93 2gk3 n PHE 238 N -4.35 0.49 0.07 0.65 3.72 -1.26 -4.45 117.46 112.34 2gk3 n PHE 238 Ca 0.22 -0.25 -0.11 0.00 -0.05 0.00 0.00 57.45 57.25 2gk3 n PHE 238 Cb 0.98 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.47 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 3.67 -0.50 -0.27 1.38 3.20 -1.34 0.25 116.97 123.35 2gk3 h TYR 239 Ca 0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2gk3 h TYR 239 Cb 0.81 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 2gk3 h TYR 239 CO 0.25 -0.28 0.08 1.15 -1.64 0.00 0.00 178.16 177.72 2gk3 h THR 240 N -0.33 1.20 -0.72 1.81 2.02 -1.80 -3.06 112.91 112.03 2gk3 h THR 240 Ca 0.05 -0.65 0.07 0.00 0.77 0.00 0.00 66.41 66.64 2gk3 h THR 240 Cb 0.38 1.12 -0.06 0.00 -1.74 0.00 0.00 68.15 67.85 2gk3 h THR 240 CO -0.15 0.21 0.41 0.44 0.37 0.00 0.00 175.52 176.80 2gk3 h ASP 241 N 0.27 0.62 -0.02 4.18 3.32 -1.74 0.37 116.42 123.42 2gk3 h ASP 241 Ca 0.09 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.20 2gk3 h ASP 241 Cb 0.25 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 2gk3 h ASP 241 CO -0.00 0.39 -0.40 0.25 -1.72 0.00 0.00 179.24 177.75 2gk3 h LEU 242 N 0.75 -1.23 -0.18 1.55 5.85 -0.42 0.42 115.31 122.05 2gk3 h LEU 242 Ca 0.33 0.15 -0.12 0.00 0.84 0.00 0.00 57.88 59.08 2gk3 h LEU 242 Cb 0.21 0.49 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2gk3 h LEU 242 CO -0.19 -0.44 -0.35 -0.50 -0.34 0.00 0.00 178.44 176.62 2gk3 h TRP 243 N -0.55 0.69 0.20 1.25 4.06 -1.37 -1.69 115.95 118.53 2gk3 h TRP 243 Ca 0.05 -0.25 -0.00 0.00 2.06 0.00 0.00 58.89 60.75 2gk3 h TRP 243 Cb 0.64 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.66 2gk3 h TRP 243 CO -0.42 0.98 -0.14 0.28 -3.56 0.00 0.00 178.44 175.58 2gk3 h VAL 244 N 0.21 0.70 -0.67 1.49 2.07 -0.19 -1.10 116.25 118.76 2gk3 h VAL 244 Ca 0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.64 2gk3 h VAL 244 Cb 0.94 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.33 2gk3 h VAL 244 CO 0.08 0.00 0.26 0.78 0.02 0.00 0.00 177.57 178.70 2gk3 h ASN 245 N -0.34 0.25 -0.41 0.57 2.35 -0.21 -1.79 115.58 116.01 2gk3 h ASN 245 Ca -0.01 0.09 -0.15 0.00 -0.55 0.00 0.00 56.30 55.67 2gk3 h ASN 245 Cb 0.29 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 2gk3 h ASN 245 CO 0.00 0.13 -0.34 0.71 -1.65 0.00 0.00 177.43 176.28 2gk3 h THR 246 N 0.43 1.27 -0.51 2.81 1.35 -1.14 -0.54 112.91 116.58 2gk3 h THR 246 Ca 0.35 -1.52 0.04 0.00 -0.55 0.00 0.00 66.41 64.73 2gk3 h THR 246 Cb 0.46 1.31 -0.04 0.00 -1.73 0.00 0.00 68.15 68.15 2gk3 h THR 246 CO -0.34 0.51 0.26 -0.07 -0.25 0.00 0.00 175.52 175.64 2gk3 h LEU 247 N 0.79 0.39 -0.31 3.87 3.38 -0.93 -2.43 115.31 120.08 2gk3 h LEU 247 Ca 0.07 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2gk3 h LEU 247 Cb 0.94 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2gk3 h LEU 247 CO 0.09 0.27 0.15 1.56 0.09 0.00 0.00 178.44 180.59 2gk3 h GLN 248 N 0.52 0.44 -0.59 1.13 1.08 -1.16 -1.26 115.11 115.27 2gk3 h GLN 248 Ca 0.22 -0.06 0.05 0.00 -1.45 0.00 0.00 58.65 57.40 2gk3 h GLN 248 Cb 0.12 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 2gk3 h GLN 248 CO -0.15 0.41 0.39 0.35 -0.95 0.00 0.00 178.83 178.88 2gk3 h PHE 249 N 0.36 0.62 -0.02 2.96 3.57 -0.78 -2.79 116.94 120.87 2gk3 h PHE 249 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.62 2gk3 h PHE 249 Cb 0.11 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.65 2gk3 h PHE 249 CO -0.02 0.35 -0.27 0.44 -2.23 0.00 0.00 178.31 176.58 2gk3 n ILE 250 N -4.47 0.00 -1.78 1.41 -5.35 -0.94 -5.00 119.36 103.23 2gk3 n ILE 250 Ca 0.08 -0.36 -0.39 0.00 -0.27 0.00 0.00 62.75 61.80 2gk3 n ILE 250 Cb 0.18 1.30 0.03 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 s ALA 251 N -2.05 3.10 0.11 -1.28 0.00 -0.49 -3.85 121.76 117.30 2gk3 s ALA 251 Ca 0.19 1.43 -0.35 0.00 0.00 0.00 0.00 51.96 53.23 2gk3 s ALA 251 Cb 0.16 -3.59 -0.14 0.00 0.00 0.00 0.00 23.12 19.56 2gk3 s ALA 251 CO 0.41 -1.27 1.58 -2.13 0.00 0.00 0.00 175.76 174.36 2gk3 n ARG 252 N -0.48 1.96 -0.07 0.00 0.63 -1.02 -4.88 116.66 112.79 2gk3 n ARG 252 Ca 0.07 0.71 0.00 0.00 -0.92 0.00 0.00 57.85 57.71 2gk3 n ARG 252 Cb 0.43 -2.46 0.00 0.00 0.45 0.00 0.00 32.46 30.87 2gk3 n ARG 252 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48