#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gc3 s MET 1 N 0.00 3.84 -0.10 0.03 -2.45 -1.26 -5.04 119.30 114.32 2gc3 s MET 1 Ca 0.00 0.35 0.03 0.00 -1.25 0.00 0.00 55.69 54.82 2gc3 s MET 1 Cb 0.00 -3.76 -0.01 0.00 1.25 0.00 0.00 34.83 32.31 2gc3 s MET 1 CO 0.00 -0.71 -0.19 0.71 1.05 0.00 0.00 175.02 175.87 2gc3 s TYR 2 N 2.87 2.65 0.52 4.11 1.51 -1.26 -5.13 117.35 122.62 2gc3 s TYR 2 Ca 0.29 -0.79 -0.20 0.00 -1.01 0.00 0.00 57.07 55.37 2gc3 s TYR 2 Cb -0.14 -1.74 -0.07 0.00 -0.11 0.00 0.00 41.96 39.90 2gc3 s TYR 2 CO 0.14 -0.27 1.07 0.15 -1.11 0.00 0.00 175.55 175.53 2gc3 s LYS 3 N 0.20 3.59 -0.08 -0.62 1.02 -1.26 -5.01 119.74 117.57 2gc3 s LYS 3 Ca -0.12 1.44 -0.26 0.00 0.02 0.00 0.00 55.97 57.05 2gc3 s LYS 3 Cb -0.16 -2.06 -0.03 0.00 -0.52 0.00 0.00 37.83 35.07 2gc3 s LYS 3 CO 0.06 -0.62 0.85 -2.00 -0.92 0.00 0.00 175.35 172.72 2gc3 s GLU 4 N -3.33 4.43 0.68 1.68 2.56 -1.26 -5.04 118.70 118.43 2gc3 s GLU 4 Ca 0.69 1.12 -0.17 0.00 0.00 0.00 0.00 54.97 56.61 2gc3 s GLU 4 Cb -0.19 -3.49 0.01 0.00 2.00 0.00 0.00 34.13 32.46 2gc3 s GLU 4 CO 0.24 -0.11 1.25 -2.14 -0.56 0.00 0.00 175.26 173.94 2gc3 s PRO 5 N 1.34 2.38 0.09 4.30 0.02 -1.26 -5.05 135.00 136.82 2gc3 s PRO 5 Ca 0.43 1.93 -0.10 0.00 0.02 0.00 0.00 61.00 63.29 2gc3 s PRO 5 Cb -0.18 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.50 2gc3 s PRO 5 CO 0.19 -1.69 0.21 -0.59 -0.33 0.00 0.00 177.00 174.80 2gc3 s PHE 6 N -1.64 0.10 0.08 6.54 -0.71 -1.26 -5.16 117.98 115.93 2gc3 s PHE 6 Ca 0.79 -0.50 0.09 0.00 -1.04 0.00 0.00 56.93 56.28 2gc3 s PHE 6 Cb -0.34 -0.02 -0.03 0.00 -1.21 0.00 0.00 43.02 41.42 2gc3 s PHE 6 CO 0.42 -0.55 -0.25 0.20 -1.34 0.00 0.00 175.22 173.70 2gc3 s GLY 7 N -2.77 1.40 0.00 1.99 0.00 -1.26 -5.15 107.32 101.53 2gc3 s GLY 7 Ca 0.04 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 43.46 2gc3 s GLY 7 CO -0.10 -1.24 -0.03 -1.34 0.00 0.00 0.00 173.10 170.38 2gc3 s VAL 8 N -0.93 0.24 -0.09 1.40 -7.23 -1.26 -5.13 120.40 107.39 2gc3 s VAL 8 Ca 0.11 -0.28 -0.28 0.00 -1.81 0.00 0.00 61.98 59.73 2gc3 s VAL 8 Cb -0.10 -0.24 -0.02 0.00 0.56 0.00 0.00 36.38 36.58 2gc3 s VAL 8 CO 0.04 -0.03 0.91 -0.54 -0.31 0.00 0.00 175.10 175.17 2gc3 s LYS 9 N -0.32 4.42 -0.19 4.82 1.02 -1.26 -5.04 119.74 123.18 2gc3 s LYS 9 Ca -0.01 1.22 -0.04 0.00 0.02 0.00 0.00 55.97 57.16 2gc3 s LYS 9 Cb -0.03 -3.52 -0.02 0.00 -0.52 0.00 0.00 37.83 33.75 2gc3 s LYS 9 CO -0.00 -0.21 -0.04 0.08 -0.92 0.00 0.00 175.35 174.26 2gc3 s VAL 10 N 1.65 3.61 -0.51 3.17 1.01 -1.26 -4.34 120.40 123.73 2gc3 s VAL 10 Ca 0.45 -0.43 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 2gc3 s VAL 10 Cb -0.18 -2.61 0.03 0.00 0.00 0.00 0.00 36.38 33.62 2gc3 s VAL 10 CO 0.19 0.45 0.98 -0.62 0.00 0.00 0.00 175.10 176.10 2gc3 s ASP 11 N 0.99 6.45 0.62 3.32 -1.08 -1.19 -4.90 116.67 120.88 2gc3 s ASP 11 Ca 0.00 -0.01 0.41 0.00 -0.52 0.00 0.00 52.55 52.44 2gc3 s ASP 11 Cb -0.15 -2.47 2.07 0.00 -1.46 0.00 0.00 42.92 40.91 2gc3 s ASP 11 CO 0.01 -1.18 2.23 -0.26 0.52 0.00 0.00 175.17 176.48 2gc3 h PHE 12 N 9.23 0.00 0.00 -5.34 -1.00 -1.96 1.19 116.94 119.07 2gc3 h PHE 12 Ca -0.25 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.44 2gc3 h PHE 12 Cb 1.07 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.62 2gc3 h PHE 12 CO 0.91 0.00 -0.82 0.93 -1.61 0.00 0.00 178.31 177.73 2gc3 h GLU 13 N 0.00 0.00 0.00 1.51 4.39 -1.93 -3.39 114.58 115.16 2gc3 h GLU 13 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2gc3 h GLU 13 Cb 0.16 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2gc3 h GLU 13 CO 0.00 0.28 -1.11 0.25 -1.16 0.00 0.00 179.01 177.27 2gc3 n THR 14 N -3.00 0.07 -0.95 1.13 -2.24 -0.85 -5.01 114.28 103.42 2gc3 n THR 14 Ca -0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2gc3 n THR 14 Cb 0.71 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 2gc3 n THR 14 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gc3 n GLY 15 N 2.66 0.55 3.70 3.38 0.00 0.41 -4.89 105.19 111.00 2gc3 n GLY 15 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2gc3 n GLY 15 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gc3 s ILE 16 N -2.41 3.84 -0.30 -0.61 1.01 -1.25 -4.75 121.20 116.72 2gc3 s ILE 16 Ca 0.00 1.29 -0.08 0.00 0.00 0.00 0.00 60.65 61.86 2gc3 s ILE 16 Cb 0.00 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.65 2gc3 s ILE 16 CO 0.00 0.06 0.10 -0.63 0.00 0.00 0.00 174.94 174.47 2gc3 s ILE 17 N 1.54 4.12 0.08 2.92 1.01 -1.26 -3.14 121.20 126.46 2gc3 s ILE 17 Ca 0.61 -0.66 -0.31 0.00 0.00 0.00 0.00 60.65 60.28 2gc3 s ILE 17 Cb -0.31 -3.14 -0.07 0.00 0.01 0.00 0.00 42.46 38.95 2gc3 s ILE 17 CO 0.28 0.05 1.44 -1.61 0.00 0.00 0.00 174.94 175.10 2gc3 s GLU 18 N 1.52 4.28 0.00 2.79 2.02 -1.26 -2.94 118.70 125.12 2gc3 s GLU 18 Ca 0.03 2.10 0.00 0.00 0.02 0.00 0.00 54.97 57.12 2gc3 s GLU 18 Cb -0.17 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.66 2gc3 s GLU 18 CO 0.03 -0.53 0.00 0.41 0.02 0.00 0.00 175.26 175.19 2gc3 n GLY 19 N 3.63 0.69 3.82 -1.39 0.00 -1.26 -4.96 105.19 105.72 2gc3 n GLY 19 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2gc3 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gc3 s ALA 20 N -2.34 2.35 -0.45 4.61 0.00 -1.15 -5.00 121.76 119.79 2gc3 s ALA 20 Ca 0.00 -0.22 -0.29 0.00 0.00 0.00 0.00 51.96 51.45 2gc3 s ALA 20 Cb 0.00 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 20.04 2gc3 s ALA 20 CO 0.00 -1.63 1.29 0.21 0.00 0.00 0.00 175.76 175.62 2gc3 s LYS 21 N -5.18 3.64 -0.19 0.00 2.20 -0.34 -4.82 119.74 115.05 2gc3 s LYS 21 Ca 0.60 0.75 -0.21 0.00 -0.36 0.00 0.00 55.97 56.75 2gc3 s LYS 21 Cb -0.14 -3.97 -0.03 0.00 -1.51 0.00 0.00 37.83 32.18 2gc3 s LYS 21 CO 0.54 -1.49 0.63 0.21 -0.36 0.00 0.00 175.35 174.88 2gc3 s LYS 22 N 4.73 4.23 -0.08 4.03 2.20 -1.26 -1.64 119.74 131.96 2gc3 s LYS 22 Ca 0.55 0.64 0.01 0.00 -0.36 0.00 0.00 55.97 56.81 2gc3 s LYS 22 Cb -0.10 -3.56 -0.03 0.00 -1.51 0.00 0.00 37.83 32.63 2gc3 s LYS 22 CO 0.32 -0.21 -0.09 -1.12 -0.36 0.00 0.00 175.35 173.89 2gc3 s SER 23 N 1.15 4.41 -0.10 1.43 0.01 -0.16 -4.97 113.70 115.47 2gc3 s SER 23 Ca 0.29 -0.11 0.03 0.00 1.31 0.00 0.00 55.95 57.48 2gc3 s SER 23 Cb -0.16 -1.16 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 2gc3 s SER 23 CO 0.11 0.32 -0.20 -0.69 0.41 0.00 0.00 173.24 173.19 2gc3 s VAL 24 N -0.58 2.42 -0.22 3.43 1.01 -1.26 -0.72 120.40 124.48 2gc3 s VAL 24 Ca 0.09 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.18 2gc3 s VAL 24 Cb -0.12 -1.94 0.04 0.00 0.00 0.00 0.00 36.38 34.36 2gc3 s VAL 24 CO 0.02 0.55 -0.14 -0.13 0.00 0.00 0.00 175.10 175.40 2gc3 s ARG 25 N 0.16 2.51 0.40 2.72 1.81 -0.11 -5.02 118.95 121.41 2gc3 s ARG 25 Ca -0.11 -1.08 -0.01 0.00 -1.72 0.00 0.00 55.73 52.81 2gc3 s ARG 25 Cb -0.16 -2.70 -0.03 0.00 -0.45 0.00 0.00 34.95 31.61 2gc3 s ARG 25 CO 0.06 -0.41 0.63 1.03 -0.68 0.00 0.00 175.30 175.93 2gc3 s ARG 26 N 1.21 3.39 0.44 3.54 0.52 -1.26 -0.63 118.95 126.16 2gc3 s ARG 26 Ca -0.03 -0.26 0.20 0.00 -0.52 0.00 0.00 55.73 55.13 2gc3 s ARG 26 Cb -0.17 -2.57 1.16 0.00 0.52 0.00 0.00 34.95 33.89 2gc3 s ARG 26 CO -0.09 -0.04 1.86 1.25 0.02 0.00 0.00 175.30 178.31 2gc3 h LEU 27 N 0.55 0.33 -2.05 2.53 5.85 -1.39 0.57 115.31 121.70 2gc3 h LEU 27 Ca -0.48 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 2gc3 h LEU 27 Cb 1.22 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 2gc3 h LEU 27 CO 0.60 0.13 -0.02 0.77 -0.34 0.00 0.00 178.44 179.58 2gc3 h SER 28 N 0.33 0.00 -0.02 1.25 4.64 -1.89 -1.19 113.55 116.67 2gc3 h SER 28 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 2gc3 h SER 28 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2gc3 h SER 28 CO -0.15 0.02 0.00 0.47 -0.87 0.00 0.00 176.83 176.30 2gc3 n ASP 29 N -3.14 0.43 -1.76 4.97 8.00 0.19 -4.04 116.55 121.21 2gc3 n ASP 29 Ca -0.01 -1.25 -0.12 0.00 0.71 0.00 0.00 54.79 54.12 2gc3 n ASP 29 Cb 0.22 -0.01 0.07 0.00 -0.02 0.00 0.00 41.12 41.38 2gc3 n ASP 29 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2gc3 n MET 30 N -0.61 2.68 -1.91 -1.24 2.81 -0.45 -5.00 117.12 113.41 2gc3 n MET 30 Ca 0.20 -3.75 -0.41 0.00 -1.81 0.00 0.00 57.70 51.92 2gc3 n MET 30 Cb 0.17 -1.90 -0.02 0.00 -0.71 0.00 0.00 33.22 30.75 2gc3 n MET 30 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2gc3 s GLU 31 N -3.34 4.20 0.00 0.03 2.12 -1.26 -2.79 118.70 117.66 2gc3 s GLU 31 Ca 0.44 2.42 0.00 0.00 0.36 0.00 0.00 54.97 58.19 2gc3 s GLU 31 Cb 0.39 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.71 2gc3 s GLU 31 CO -0.01 -0.50 0.00 0.41 -0.54 0.00 0.00 175.26 174.62 2gc3 n GLY 32 N 2.06 0.56 0.08 -1.50 0.00 -1.26 -4.91 105.19 100.22 2gc3 n GLY 32 Ca 0.07 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 2gc3 n GLY 32 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2gc3 n TYR 33 N -2.85 0.00 -3.97 1.61 4.02 -1.12 -4.81 117.16 110.03 2gc3 n TYR 33 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.55 2gc3 n TYR 33 Cb 0.00 -0.83 -0.06 0.00 -0.02 0.00 0.00 39.34 38.43 2gc3 n TYR 33 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2gc3 s PHE 34 N -2.41 3.47 0.17 -0.72 0.40 -1.26 -5.01 117.98 112.62 2gc3 s PHE 34 Ca -0.09 0.35 -0.14 0.00 -0.60 0.00 0.00 56.93 56.44 2gc3 s PHE 34 Cb 0.05 -1.83 0.06 0.00 0.51 0.00 0.00 43.02 41.81 2gc3 s PHE 34 CO 0.68 0.63 1.83 0.28 0.70 0.00 0.00 175.22 179.34 2gc3 h VAL 35 N 3.27 1.14 -2.26 -0.44 2.07 -1.94 -3.36 116.25 114.73 2gc3 h VAL 35 Ca -0.50 -0.28 -0.70 0.00 0.82 0.00 0.00 66.70 66.04 2gc3 h VAL 35 Cb 1.20 0.39 -0.17 0.00 -1.52 0.00 0.00 31.29 31.19 2gc3 h VAL 35 CO 0.64 0.14 1.04 -0.62 0.02 0.00 0.00 177.57 178.79 2gc3 s ASP 36 N -5.69 6.77 0.29 0.57 -1.08 -1.26 -4.87 116.67 111.40 2gc3 s ASP 36 Ca -0.13 -2.33 -0.01 0.00 -0.52 0.00 0.00 52.55 49.55 2gc3 s ASP 36 Cb 0.12 -2.41 0.42 0.00 -1.46 0.00 0.00 42.92 39.59 2gc3 s ASP 36 CO 0.74 -0.98 1.88 -0.08 0.52 0.00 0.00 175.17 177.25 2gc3 h GLU 37 N 8.31 0.91 -0.36 4.34 4.57 -1.98 -0.12 114.58 130.25 2gc3 h GLU 37 Ca 0.21 -0.14 -0.10 0.00 -1.18 0.00 0.00 59.36 58.15 2gc3 h GLU 37 Cb 0.97 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.39 2gc3 h GLU 37 CO 1.17 0.73 -0.18 0.00 -1.18 0.00 0.00 179.01 179.55 2gc3 h ARG 38 N 0.90 0.75 -0.18 1.92 3.08 -1.95 -1.60 114.38 117.30 2gc3 h ARG 38 Ca 0.22 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.86 2gc3 h ARG 38 Cb 0.15 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2gc3 h ARG 38 CO -0.02 0.95 -0.20 0.00 -1.07 0.00 0.00 179.97 179.62 2gc3 h ALA 39 N 0.79 1.32 0.28 0.04 0.00 -1.83 -0.98 119.26 118.87 2gc3 h ALA 39 Ca 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2gc3 h ALA 39 Cb 0.73 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2gc3 h ALA 39 CO 0.05 0.46 -0.13 2.35 0.00 0.00 0.00 179.25 181.98 2gc3 h TRP 40 N 0.29 -0.34 -1.00 0.00 7.01 -0.94 -2.15 115.95 118.82 2gc3 h TRP 40 Ca 0.05 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.10 2gc3 h TRP 40 Cb 0.53 0.11 -0.06 0.00 -2.10 0.00 0.00 29.16 27.64 2gc3 h TRP 40 CO 0.01 -0.07 0.65 -0.22 -2.79 0.00 0.00 178.44 176.02 2gc3 h LYS 41 N -0.58 1.17 -0.36 2.65 1.63 -1.14 -0.49 116.57 119.44 2gc3 h LYS 41 Ca -0.04 -0.07 -0.06 0.00 -0.85 0.00 0.00 60.65 59.63 2gc3 h LYS 41 Cb 0.42 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 2gc3 h LYS 41 CO 0.06 0.77 -0.02 1.49 -3.45 0.00 0.00 179.45 178.30 2gc3 h GLU 42 N 1.20 0.65 -0.27 1.90 4.81 -1.18 -1.99 114.58 119.70 2gc3 h GLU 42 Ca 0.42 -0.22 -0.12 0.00 -0.13 0.00 0.00 59.36 59.31 2gc3 h GLU 42 Cb 0.12 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2gc3 h GLU 42 CO -0.16 0.78 -0.34 1.25 -0.73 0.00 0.00 179.01 179.81 2gc3 h LEU 43 N 0.46 0.61 -0.13 1.64 5.85 -0.97 -0.33 115.31 122.44 2gc3 h LEU 43 Ca 0.10 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2gc3 h LEU 43 Cb 0.49 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2gc3 h LEU 43 CO 0.02 0.90 0.08 0.58 -0.34 0.00 0.00 178.44 179.69 2gc3 h VAL 44 N 0.50 1.03 -0.66 1.05 2.07 -1.07 0.26 116.25 119.42 2gc3 h VAL 44 Ca 0.05 -0.06 -0.09 0.00 0.82 0.00 0.00 66.70 67.43 2gc3 h VAL 44 Cb 0.83 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 2gc3 h VAL 44 CO 0.07 0.03 0.08 -0.33 0.02 0.00 0.00 177.57 177.44 2gc3 h GLU 45 N 0.17 1.11 0.10 1.57 5.08 -1.16 -2.58 114.58 118.87 2gc3 h GLU 45 Ca 0.05 -0.31 -0.26 0.00 -1.00 0.00 0.00 59.36 57.83 2gc3 h GLU 45 Cb -0.02 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.11 2gc3 h GLU 45 CO -0.01 1.03 -1.18 -0.22 -1.00 0.00 0.00 179.01 177.63 2gc3 h LYS 46 N 1.03 0.29 0.00 2.33 3.64 -1.02 -3.44 116.57 119.39 2gc3 h LYS 46 Ca 0.20 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 2gc3 h LYS 46 Cb 0.48 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 2gc3 h LYS 46 CO 0.02 1.19 0.00 -1.91 -2.27 0.00 0.00 179.45 176.48 2gc3 n GLU 47 N -3.57 0.00 -3.59 1.90 2.13 -0.06 -5.07 120.64 112.38 2gc3 n GLU 47 Ca -0.08 0.00 -0.23 0.00 0.66 0.00 0.00 57.16 57.51 2gc3 n GLU 47 Cb 0.99 -0.24 0.02 0.00 0.27 0.00 0.00 31.44 32.48 2gc3 n GLU 47 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2gc3 n ASP 48 N -1.90 -5.72 -4.76 4.31 2.03 0.71 -4.93 116.55 106.27 2gc3 n ASP 48 Ca 0.00 -0.81 -0.30 0.00 0.52 0.00 0.00 54.79 54.20 2gc3 n ASP 48 Cb 0.00 -3.30 0.10 0.00 -0.72 0.00 0.00 41.12 37.20 2gc3 n ASP 48 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2gc3 s PRO 49 N -5.10 1.93 -0.08 -0.67 0.04 -1.26 -4.56 135.00 125.29 2gc3 s PRO 49 Ca 0.25 0.89 -0.30 0.00 0.04 0.00 0.00 61.00 61.88 2gc3 s PRO 49 Cb -0.09 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2gc3 s PRO 49 CO 0.85 -1.79 1.44 0.08 0.04 0.00 0.00 177.00 177.62 2gc3 s VAL 50 N -2.99 3.89 -0.16 -0.36 1.01 -1.26 -1.17 120.40 119.35 2gc3 s VAL 50 Ca 0.61 1.13 -0.26 0.00 0.00 0.00 0.00 61.98 63.46 2gc3 s VAL 50 Cb -0.16 -3.73 -0.23 0.00 0.00 0.00 0.00 36.38 32.26 2gc3 s VAL 50 CO 0.56 -0.08 0.59 0.58 0.00 0.00 0.00 175.10 176.75 2gc3 h VAL 51 N 5.38 1.50 -3.46 2.92 2.07 -1.17 -3.43 116.25 120.06 2gc3 h VAL 51 Ca -0.34 -2.26 -0.08 0.00 0.82 0.00 0.00 66.70 64.84 2gc3 h VAL 51 Cb 1.15 2.96 -0.15 0.00 -1.52 0.00 0.00 31.29 33.73 2gc3 h VAL 51 CO 0.95 0.51 -0.24 -0.72 0.02 0.00 0.00 177.57 178.09 2gc3 s TYR 52 N -2.24 -0.06 -0.03 1.57 -0.85 -1.10 -0.64 117.35 113.99 2gc3 s TYR 52 Ca -0.21 -0.20 0.05 0.00 -0.52 0.00 0.00 57.07 56.18 2gc3 s TYR 52 Cb -0.00 0.09 -0.01 0.00 0.38 0.00 0.00 41.96 42.42 2gc3 s TYR 52 CO 0.64 -0.56 -0.17 -1.21 -1.52 0.00 0.00 175.55 172.73 2gc3 s GLU 53 N -3.22 1.60 -0.08 -3.49 2.02 -0.59 -0.94 118.70 114.01 2gc3 s GLU 53 Ca -0.00 -0.61 0.02 0.00 0.02 0.00 0.00 54.97 54.40 2gc3 s GLU 53 Cb 0.01 -1.46 -0.02 0.00 0.10 0.00 0.00 34.13 32.76 2gc3 s GLU 53 CO -0.08 0.30 -0.14 0.08 0.02 0.00 0.00 175.26 175.45 2gc3 s VAL 54 N -0.17 3.01 -0.37 2.63 1.01 0.11 -0.93 120.40 125.68 2gc3 s VAL 54 Ca 0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 2gc3 s VAL 54 Cb -0.09 -2.21 0.09 0.00 0.00 0.00 0.00 36.38 34.17 2gc3 s VAL 54 CO 0.01 0.57 0.12 -0.31 0.00 0.00 0.00 175.10 175.49 2gc3 s TYR 55 N -0.32 3.53 -0.13 5.22 1.51 -0.24 -0.99 117.35 125.93 2gc3 s TYR 55 Ca 0.03 -2.37 -0.04 0.00 -1.01 0.00 0.00 57.07 53.68 2gc3 s TYR 55 Cb -0.13 -2.88 -0.03 0.00 -0.11 0.00 0.00 41.96 38.81 2gc3 s TYR 55 CO 0.03 -0.92 0.02 0.00 -1.11 0.00 0.00 175.55 173.56 2gc3 s ALA 56 N 1.13 3.28 -0.35 3.71 0.00 -0.65 -1.37 121.76 127.51 2gc3 s ALA 56 Ca 0.05 -0.78 -0.00 0.00 0.00 0.00 0.00 51.96 51.22 2gc3 s ALA 56 Cb -0.21 -1.65 0.08 0.00 0.00 0.00 0.00 23.12 21.35 2gc3 s ALA 56 CO -0.04 0.39 0.08 0.08 0.00 0.00 0.00 175.76 176.27 2gc3 s VAL 57 N -0.24 2.88 -0.02 0.00 1.01 0.12 -1.20 120.40 122.96 2gc3 s VAL 57 Ca 0.06 -1.88 0.08 0.00 0.00 0.00 0.00 61.98 60.24 2gc3 s VAL 57 Cb -0.12 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 2gc3 s VAL 57 CO 0.02 -0.43 -0.24 -1.61 0.00 0.00 0.00 175.10 172.83 2gc3 s GLU 58 N 1.12 2.13 0.50 2.72 2.02 -1.26 -2.03 118.70 123.90 2gc3 s GLU 58 Ca 0.03 -0.92 0.06 0.00 0.02 0.00 0.00 54.97 54.16 2gc3 s GLU 58 Cb -0.21 -2.08 0.09 0.00 0.10 0.00 0.00 34.13 32.03 2gc3 s GLU 58 CO -0.04 0.56 0.70 1.04 0.02 0.00 0.00 175.26 177.54 2gc3 n GLN 59 N 2.33 0.50 -1.69 1.61 1.13 -1.26 -5.07 117.38 114.93 2gc3 n GLN 59 Ca -0.16 -2.45 -0.34 0.00 -1.94 0.00 0.00 57.00 52.12 2gc3 n GLN 59 Cb 0.51 -0.29 0.06 0.00 0.11 0.00 0.00 30.24 30.63 2gc3 n GLN 59 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2gc3 s GLU 60 N -4.26 2.63 -1.17 -1.09 2.56 -1.26 -4.89 118.70 111.23 2gc3 s GLU 60 Ca 0.51 1.53 -0.21 0.00 0.00 0.00 0.00 54.97 56.79 2gc3 s GLU 60 Cb -0.04 -1.92 -0.01 0.00 2.00 0.00 0.00 34.13 34.17 2gc3 s GLU 60 CO 0.33 -1.41 1.81 -1.21 -0.56 0.00 0.00 175.26 174.22 2gc3 s GLU 61 N -3.97 3.16 -0.03 4.30 2.02 -1.26 -4.73 118.70 118.19 2gc3 s GLU 61 Ca 0.70 -1.34 0.05 0.00 0.02 0.00 0.00 54.97 54.40 2gc3 s GLU 61 Cb -0.24 -5.34 -0.01 0.00 0.10 0.00 0.00 34.13 28.65 2gc3 s GLU 61 CO 0.41 -3.08 -0.19 0.21 0.02 0.00 0.00 175.26 172.63 2gc3 s LYS 62 N 5.57 1.78 0.14 1.61 2.47 -1.26 -4.77 119.74 125.27 2gc3 s LYS 62 Ca 0.61 -0.69 -0.34 0.00 -1.56 0.00 0.00 55.97 53.98 2gc3 s LYS 62 Cb 0.00 -1.62 -0.14 0.00 -1.46 0.00 0.00 37.83 34.61 2gc3 s LYS 62 CO 0.07 0.35 1.56 -1.91 0.16 0.00 0.00 175.35 175.58 2gc3 n GLU 63 N 2.83 2.01 0.00 4.03 2.13 -1.26 -2.54 120.64 127.84 2gc3 n GLU 63 Ca -0.16 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.38 2gc3 n GLU 63 Cb 0.53 -2.48 0.00 0.00 0.27 0.00 0.00 31.44 29.76 2gc3 n GLU 63 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gc3 n GLY 64 N 3.35 2.04 3.96 8.31 0.00 -1.26 -5.04 105.19 116.56 2gc3 n GLY 64 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2gc3 n GLY 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gc3 s ASP 65 N -2.04 5.20 -0.00 1.61 -1.08 -1.05 -5.00 116.67 114.31 2gc3 s ASP 65 Ca 0.00 0.10 0.01 0.00 -0.52 0.00 0.00 52.55 52.14 2gc3 s ASP 65 Cb 0.00 -0.95 -0.00 0.00 -1.46 0.00 0.00 42.92 40.51 2gc3 s ASP 65 CO 0.00 -1.22 -0.04 -0.76 0.52 0.00 0.00 175.17 173.67 2gc3 s LEU 66 N -4.85 1.99 0.21 -1.34 1.43 -1.26 -1.79 118.68 113.06 2gc3 s LEU 66 Ca 0.58 -0.08 0.05 0.00 -1.03 0.00 0.00 54.13 53.65 2gc3 s LEU 66 Cb -0.10 -0.23 -0.03 0.00 0.03 0.00 0.00 46.19 45.86 2gc3 s LEU 66 CO 0.40 0.05 0.25 0.20 0.23 0.00 0.00 176.35 177.47 2gc3 s ASN 67 N -0.07 5.89 0.03 2.29 0.01 0.53 -4.52 114.94 119.11 2gc3 s ASN 67 Ca 0.01 -0.06 -0.04 0.00 -0.71 0.00 0.00 52.86 52.06 2gc3 s ASN 67 Cb -0.02 -1.63 -0.02 0.00 0.41 0.00 0.00 41.25 39.99 2gc3 s ASN 67 CO -0.00 -0.01 0.05 0.72 -1.51 0.00 0.00 177.10 176.35 2gc3 s PHE 68 N -1.95 0.24 -0.20 2.20 -0.12 -0.86 -1.11 117.98 116.18 2gc3 s PHE 68 Ca 0.33 -0.55 -0.20 0.00 -0.05 0.00 0.00 56.93 56.46 2gc3 s PHE 68 Cb -0.09 -0.18 0.05 0.00 -0.63 0.00 0.00 43.02 42.17 2gc3 s PHE 68 CO 0.26 -0.31 0.57 0.00 -0.05 0.00 0.00 175.22 175.69 2gc3 s ALA 69 N -2.37 -1.40 0.27 1.99 0.00 0.21 0.16 121.76 120.61 2gc3 s ALA 69 Ca -0.07 1.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.39 2gc3 s ALA 69 Cb -0.03 -0.85 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 2gc3 s ALA 69 CO -0.04 -0.27 0.52 0.95 0.00 0.00 0.00 175.76 176.92 2gc3 s THR 70 N 0.17 5.06 -0.02 0.00 -4.23 -0.47 0.30 115.64 116.44 2gc3 s THR 70 Ca -0.01 -0.02 0.03 0.00 -1.18 0.00 0.00 61.69 60.52 2gc3 s THR 70 Cb -0.04 -3.73 -0.00 0.00 1.34 0.00 0.00 72.50 70.07 2gc3 s THR 70 CO 0.01 -0.29 -0.10 -0.89 -0.54 0.00 0.00 174.62 172.81 2gc3 s THR 71 N -2.04 0.85 -0.35 3.99 2.01 -0.02 -1.08 115.64 119.00 2gc3 s THR 71 Ca 0.43 -0.43 -0.05 0.00 0.31 0.00 0.00 61.69 61.94 2gc3 s THR 71 Cb -0.11 -0.73 0.06 0.00 0.01 0.00 0.00 72.50 71.73 2gc3 s THR 71 CO 0.30 0.25 0.12 -0.69 -0.69 0.00 0.00 174.62 173.91 2gc3 s VAL 72 N -0.05 3.61 -0.37 3.82 1.01 -0.11 -2.15 120.40 126.15 2gc3 s VAL 72 Ca 0.01 -1.36 -0.13 0.00 0.00 0.00 0.00 61.98 60.49 2gc3 s VAL 72 Cb -0.06 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.18 2gc3 s VAL 72 CO 0.00 -0.29 0.25 -0.22 0.00 0.00 0.00 175.10 174.84 2gc3 s LEU 73 N 1.34 4.75 0.48 3.92 0.20 0.38 -1.54 118.68 128.20 2gc3 s LEU 73 Ca -0.00 -0.74 -0.21 0.00 0.69 0.00 0.00 54.13 53.87 2gc3 s LEU 73 Cb -0.21 -2.11 -0.08 0.00 -0.43 0.00 0.00 46.19 43.37 2gc3 s LEU 73 CO 0.01 -0.35 1.08 -0.31 -0.29 0.00 0.00 176.35 176.49 2gc3 s TYR 74 N 1.66 2.96 0.42 5.38 2.02 0.19 -0.54 117.35 129.44 2gc3 s TYR 74 Ca 0.05 1.58 -0.24 0.00 -0.37 0.00 0.00 57.07 58.09 2gc3 s TYR 74 Cb -0.18 -3.17 -0.08 0.00 -0.40 0.00 0.00 41.96 38.12 2gc3 s TYR 74 CO 0.09 -1.04 1.09 -1.25 -1.57 0.00 0.00 175.55 172.87 2gc3 s PRO 75 N -3.03 4.04 0.00 -1.71 0.04 -1.26 -4.77 135.00 128.31 2gc3 s PRO 75 Ca 0.66 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.31 2gc3 s PRO 75 Cb -0.21 -2.51 0.00 0.00 0.04 0.00 0.00 34.50 31.83 2gc3 s PRO 75 CO 0.25 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.43 2gc3 n GLY 76 N 0.38 2.40 3.00 0.56 0.00 -1.26 -4.99 105.19 105.26 2gc3 n GLY 76 Ca 0.06 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 2gc3 n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gc3 s LYS 77 N -2.00 0.39 -0.43 1.61 1.02 -1.26 -0.51 119.74 118.56 2gc3 s LYS 77 Ca 0.00 -0.49 -0.09 0.00 0.02 0.00 0.00 55.97 55.41 2gc3 s LYS 77 Cb 0.00 -0.21 0.09 0.00 -0.52 0.00 0.00 37.83 37.19 2gc3 s LYS 77 CO 0.00 0.04 0.28 0.08 -0.92 0.00 0.00 175.35 174.83 2gc3 s VAL 78 N -0.90 4.18 0.00 3.17 1.01 0.63 -4.91 120.40 123.58 2gc3 s VAL 78 Ca -0.07 -1.52 0.00 0.00 0.00 0.00 0.00 61.98 60.39 2gc3 s VAL 78 Cb -0.07 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.69 2gc3 s VAL 78 CO -0.00 -0.58 0.00 0.61 0.00 0.00 0.00 175.10 175.13 2gc3 n GLY 79 N 4.90 3.06 0.02 4.51 0.00 -1.26 -2.13 105.19 114.28 2gc3 n GLY 79 Ca -0.09 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.83 2gc3 n GLY 79 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gc3 n LYS 80 N 12.94 0.22 -2.88 1.61 5.02 -1.26 -4.95 118.16 128.87 2gc3 n LYS 80 Ca 0.00 -0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 2gc3 n LYS 80 Cb 0.00 -1.56 -0.04 0.00 -0.02 0.00 0.00 35.03 33.41 2gc3 n LYS 80 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2gc3 s GLU 81 N -3.16 4.15 0.60 1.97 2.12 -0.91 -0.51 118.70 122.96 2gc3 s GLU 81 Ca 0.05 0.91 -0.19 0.00 0.36 0.00 0.00 54.97 56.10 2gc3 s GLU 81 Cb 0.15 -3.66 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 2gc3 s GLU 81 CO 0.81 -0.56 1.29 -0.06 -0.54 0.00 0.00 175.26 176.20 2gc3 s PHE 82 N 2.90 2.24 0.35 5.30 0.40 -0.92 -0.27 117.98 127.99 2gc3 s PHE 82 Ca 0.35 1.46 -0.28 0.00 -0.60 0.00 0.00 56.93 57.87 2gc3 s PHE 82 Cb -0.15 -3.66 -0.12 0.00 0.51 0.00 0.00 43.02 39.60 2gc3 s PHE 82 CO 0.08 -2.69 1.33 1.19 0.70 0.00 0.00 175.22 175.83 2gc3 n PHE 83 N -1.53 2.43 -4.05 0.36 3.01 0.33 -4.79 117.46 113.23 2gc3 n PHE 83 Ca 0.13 0.53 -0.10 0.00 1.01 0.00 0.00 57.45 59.02 2gc3 n PHE 83 Cb 0.48 -2.44 -0.07 0.00 -0.01 0.00 0.00 39.48 37.44 2gc3 n PHE 83 CO 0.00 0.00 0.00 -0.59 1.01 0.00 0.00 176.76 177.18 2gc3 s PHE 84 N -1.11 0.61 0.56 1.38 -0.12 -1.26 -1.84 117.98 116.20 2gc3 s PHE 84 Ca 0.55 -0.93 -0.16 0.00 -0.05 0.00 0.00 56.93 56.34 2gc3 s PHE 84 Cb -0.54 -0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 41.70 2gc3 s PHE 84 CO 0.62 -0.82 1.02 0.95 -0.05 0.00 0.00 175.22 176.94 2gc3 s THR 85 N -4.05 4.21 0.24 -4.49 -4.23 -0.63 -4.89 115.64 101.80 2gc3 s THR 85 Ca 0.26 1.02 -0.06 0.00 -1.18 0.00 0.00 61.69 61.73 2gc3 s THR 85 Cb 0.03 -3.57 0.23 0.00 1.34 0.00 0.00 72.50 70.52 2gc3 s THR 85 CO 0.08 -0.64 1.68 0.11 -0.54 0.00 0.00 174.62 175.31 2gc3 h LYS 86 N 0.56 0.24 0.00 3.99 1.57 -1.95 -3.43 116.57 117.56 2gc3 h LYS 86 Ca -0.46 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2gc3 h LYS 86 Cb 1.20 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2gc3 h LYS 86 CO 0.60 0.16 0.00 0.41 -0.57 0.00 0.00 179.45 180.04 2gc3 n GLY 87 N -1.35 -0.69 3.53 3.86 0.00 -1.26 -4.88 105.19 104.40 2gc3 n GLY 87 Ca 0.13 -1.51 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 2gc3 n GLY 87 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2gc3 s HIS 88 N -3.14 -0.49 0.64 1.61 -3.43 -1.10 -4.70 115.29 104.67 2gc3 s HIS 88 Ca 0.00 0.75 -0.07 0.00 -0.80 0.00 0.00 55.06 54.93 2gc3 s HIS 88 Cb 0.00 0.46 0.02 0.00 -1.43 0.00 0.00 32.58 31.63 2gc3 s HIS 88 CO 0.00 -0.52 0.96 -0.06 -2.00 0.00 0.00 174.74 173.13 2gc3 s PHE 89 N -1.63 3.20 0.16 0.38 0.08 -0.68 -2.28 117.98 117.21 2gc3 s PHE 89 Ca -0.04 0.68 -0.15 0.00 0.12 0.00 0.00 56.93 57.54 2gc3 s PHE 89 Cb -0.00 -2.90 -0.07 0.00 -0.57 0.00 0.00 43.02 39.48 2gc3 s PHE 89 CO 0.02 -1.01 0.58 -1.01 -0.10 0.00 0.00 175.22 173.70 2gc3 s HIS 90 N -3.12 3.61 0.18 0.36 3.76 -1.26 0.36 115.29 119.18 2gc3 s HIS 90 Ca 0.56 1.12 -0.13 0.00 -0.15 0.00 0.00 55.06 56.46 2gc3 s HIS 90 Cb -0.11 -2.42 0.14 0.00 1.11 0.00 0.00 32.58 31.31 2gc3 s HIS 90 CO 0.46 0.41 1.77 0.00 -0.85 0.00 0.00 174.74 176.53 2gc3 h ALA 91 N 3.52 0.61 -1.71 -1.40 0.00 -0.94 -3.09 119.26 116.25 2gc3 h ALA 91 Ca -0.48 0.04 -0.63 0.00 0.00 0.00 0.00 54.91 53.84 2gc3 h ALA 91 Cb 1.19 -0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.82 2gc3 h ALA 91 CO 0.66 -0.15 0.53 0.15 0.00 0.00 0.00 179.25 180.43 2gc3 s LYS 92 N -6.13 3.16 0.39 0.00 1.02 -0.54 -4.95 119.74 112.70 2gc3 s LYS 92 Ca -0.13 -0.70 0.09 0.00 0.02 0.00 0.00 55.97 55.25 2gc3 s LYS 92 Cb 0.14 -4.18 0.86 0.00 -0.52 0.00 0.00 37.83 34.13 2gc3 s LYS 92 CO 0.73 -1.71 1.98 -0.07 -0.92 0.00 0.00 175.35 175.36 2gc3 h LEU 93 N 11.19 0.53 0.00 3.17 3.38 -1.84 -2.56 115.31 129.18 2gc3 h LEU 93 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2gc3 h LEU 93 Cb 1.07 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2gc3 h LEU 93 CO 1.15 0.34 0.00 -0.90 0.09 0.00 0.00 178.44 179.12 2gc3 n ASP 94 N -4.48 0.00 -4.71 -0.43 3.85 -1.26 -0.47 116.55 109.05 2gc3 n ASP 94 Ca 0.10 -1.74 -0.42 0.00 -0.71 0.00 0.00 54.79 52.02 2gc3 n ASP 94 Cb 0.26 0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 40.00 2gc3 n ASP 94 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 2gc3 s ARG 95 N -2.00 4.54 0.75 0.11 3.00 -0.97 -4.35 118.95 120.04 2gc3 s ARG 95 Ca 0.11 1.45 -0.07 0.00 0.00 0.00 0.00 55.73 57.22 2gc3 s ARG 95 Cb 0.05 -3.45 0.10 0.00 0.00 0.00 0.00 34.95 31.65 2gc3 s ARG 95 CO 0.09 -0.08 1.06 0.00 0.00 0.00 0.00 175.30 176.37 2gc3 s ALA 96 N 1.06 3.15 0.01 2.13 0.00 -1.26 -4.29 121.76 122.55 2gc3 s ALA 96 Ca 0.52 -1.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.17 2gc3 s ALA 96 Cb -0.22 -2.46 0.01 0.00 0.00 0.00 0.00 23.12 20.46 2gc3 s ALA 96 CO 0.28 -1.54 0.21 -2.00 0.00 0.00 0.00 175.76 172.71 2gc3 s GLU 97 N -5.33 0.61 -0.10 0.00 2.12 -0.25 -4.21 118.70 111.55 2gc3 s GLU 97 Ca 0.64 -0.40 0.03 0.00 0.36 0.00 0.00 54.97 55.60 2gc3 s GLU 97 Cb -0.08 0.26 0.01 0.00 0.26 0.00 0.00 34.13 34.58 2gc3 s GLU 97 CO 0.46 -0.17 -0.20 0.08 -0.54 0.00 0.00 175.26 174.89 2gc3 s VAL 98 N -1.74 1.81 -0.06 3.70 1.01 -0.75 -0.84 120.40 123.52 2gc3 s VAL 98 Ca -0.11 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.03 2gc3 s VAL 98 Cb -0.05 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 2gc3 s VAL 98 CO 0.01 0.50 -0.14 -0.31 0.00 0.00 0.00 175.10 175.16 2gc3 s TYR 99 N 0.53 2.73 -0.21 5.22 1.51 -0.70 -0.91 117.35 125.52 2gc3 s TYR 99 Ca -0.15 -0.23 0.01 0.00 -1.01 0.00 0.00 57.07 55.69 2gc3 s TYR 99 Cb -0.17 -1.67 0.03 0.00 -0.11 0.00 0.00 41.96 40.04 2gc3 s TYR 99 CO 0.05 0.13 -0.15 0.08 -1.11 0.00 0.00 175.55 174.56 2gc3 s VAL 100 N -0.56 2.31 0.08 0.71 1.01 0.79 -0.61 120.40 124.13 2gc3 s VAL 100 Ca 0.08 -1.07 -0.30 0.00 0.00 0.00 0.00 61.98 60.69 2gc3 s VAL 100 Cb -0.11 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 2gc3 s VAL 100 CO 0.01 0.35 0.99 0.00 0.00 0.00 0.00 175.10 176.46 2gc3 s ALA 101 N 1.27 3.24 -0.09 5.51 0.00 -0.03 -0.87 121.76 130.79 2gc3 s ALA 101 Ca 0.01 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.58 2gc3 s ALA 101 Cb -0.15 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2gc3 s ALA 101 CO -0.09 -0.13 -0.08 1.28 0.00 0.00 0.00 175.76 176.74 2gc3 n LEU 102 N 3.15 2.99 -3.66 0.00 4.77 0.46 -0.75 117.00 123.96 2gc3 n LEU 102 Ca 0.04 -0.05 -0.15 0.00 -0.03 0.00 0.00 56.01 55.82 2gc3 n LEU 102 Cb 0.49 -0.31 -0.08 0.00 -2.33 0.00 0.00 43.42 41.19 2gc3 n LEU 102 CO 0.52 0.65 0.20 -0.75 -1.33 0.00 0.00 177.39 176.68 2gc3 s LYS 103 N -2.18 0.82 0.79 3.23 2.20 -0.87 -4.68 119.74 119.05 2gc3 s LYS 103 Ca -0.12 0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.53 2gc3 s LYS 103 Cb 0.03 0.37 0.00 0.00 -1.51 0.00 0.00 37.83 36.73 2gc3 s LYS 103 CO 0.21 -0.23 0.00 0.41 -0.36 0.00 0.00 175.35 175.37 2gc3 n GLY 104 N 1.23 -1.81 2.91 5.54 0.00 -1.25 -0.70 105.19 111.11 2gc3 n GLY 104 Ca -0.20 -1.68 -0.22 0.00 0.00 0.00 0.00 46.02 43.93 2gc3 n GLY 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gc3 s LYS 105 N 0.00 1.04 0.00 1.61 2.20 -1.26 -4.13 119.74 119.20 2gc3 s LYS 105 Ca 0.00 -0.16 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 2gc3 s LYS 105 Cb 0.00 -1.02 0.00 0.00 -1.51 0.00 0.00 37.83 35.30 2gc3 s LYS 105 CO 0.00 -0.09 0.00 0.41 -0.36 0.00 0.00 175.35 175.31 2gc3 n GLY 106 N 4.15 2.87 0.00 5.54 0.00 -0.70 -2.06 105.19 115.00 2gc3 n GLY 106 Ca -0.22 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2gc3 n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gc3 n GLY 107 N 0.00 -0.34 3.16 -0.02 0.00 -0.43 -1.46 105.19 106.10 2gc3 n GLY 107 Ca 0.00 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.75 2gc3 n GLY 107 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2gc3 s MET 108 N -2.00 2.28 -0.17 1.61 1.75 0.23 0.11 119.30 123.10 2gc3 s MET 108 Ca 0.00 -0.70 -0.14 0.00 -1.25 0.00 0.00 55.69 53.60 2gc3 s MET 108 Cb 0.00 -1.85 -0.05 0.00 2.84 0.00 0.00 34.83 35.77 2gc3 s MET 108 CO 0.00 0.21 0.29 -0.51 -0.65 0.00 0.00 175.02 174.36 2gc3 s LEU 109 N 0.22 4.22 0.16 4.11 1.43 0.11 -1.02 118.68 127.90 2gc3 s LEU 109 Ca -0.10 0.47 0.10 0.00 -1.03 0.00 0.00 54.13 53.57 2gc3 s LEU 109 Cb -0.15 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 2gc3 s LEU 109 CO 0.05 0.08 -0.23 -0.76 0.23 0.00 0.00 176.35 175.72 2gc3 s LEU 110 N 0.60 2.39 -0.20 1.79 1.02 0.09 -0.80 118.68 123.57 2gc3 s LEU 110 Ca 0.16 -0.81 -0.16 0.00 0.02 0.00 0.00 54.13 53.34 2gc3 s LEU 110 Cb -0.13 -1.05 0.06 0.00 0.02 0.00 0.00 46.19 45.09 2gc3 s LEU 110 CO 0.04 0.08 0.53 -1.58 0.02 0.00 0.00 176.35 175.44 2gc3 s GLN 111 N -2.44 0.58 0.66 1.70 0.74 -0.48 -0.74 119.66 119.67 2gc3 s GLN 111 Ca 0.16 0.83 -0.09 0.00 0.05 0.00 0.00 55.36 56.31 2gc3 s GLN 111 Cb -0.08 0.19 0.02 0.00 1.10 0.00 0.00 33.01 34.24 2gc3 s GLN 111 CO 0.07 -0.11 1.01 0.95 -0.55 0.00 0.00 175.29 176.66 2gc3 s THR 112 N 0.77 3.43 0.65 -0.34 -4.23 -0.71 0.31 115.64 115.52 2gc3 s THR 112 Ca -0.04 0.20 0.31 0.00 -1.18 0.00 0.00 61.69 60.98 2gc3 s THR 112 Cb -0.05 -3.42 0.32 0.00 1.34 0.00 0.00 72.50 70.70 2gc3 s THR 112 CO -0.06 -0.49 1.97 -0.65 -0.54 0.00 0.00 174.62 174.85 2gc3 h PRO 113 N -0.45 0.00 -0.01 3.99 0.11 -1.93 0.12 132.00 133.82 2gc3 h PRO 113 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2gc3 h PRO 113 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2gc3 h PRO 113 CO 0.62 0.00 -0.09 0.39 -0.21 0.00 0.00 178.00 178.71 2gc3 n GLU 114 N -3.04 1.24 -0.67 1.05 4.71 -1.26 -4.95 120.64 117.71 2gc3 n GLU 114 Ca -0.01 -0.65 0.00 0.00 -0.01 0.00 0.00 57.16 56.49 2gc3 n GLU 114 Cb 0.38 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.32 2gc3 n GLU 114 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2gc3 n GLY 115 N 1.23 0.73 3.67 0.62 0.00 0.41 -5.02 105.19 106.82 2gc3 n GLY 115 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2gc3 n GLY 115 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gc3 s ASP 116 N -2.35 6.59 0.17 1.61 -0.00 -1.26 -4.71 116.67 116.71 2gc3 s ASP 116 Ca 0.00 2.44 0.06 0.00 -0.00 0.00 0.00 52.55 55.05 2gc3 s ASP 116 Cb 0.00 -2.54 -0.04 0.00 -0.00 0.00 0.00 42.92 40.34 2gc3 s ASP 116 CO 0.00 -0.94 0.07 0.00 -0.00 0.00 0.00 175.17 174.30 2gc3 s ALA 117 N 3.57 3.38 -0.03 5.23 0.00 -1.26 -1.74 121.76 130.92 2gc3 s ALA 117 Ca 0.77 -1.30 -0.06 0.00 0.00 0.00 0.00 51.96 51.37 2gc3 s ALA 117 Cb -0.38 -1.17 0.01 0.00 0.00 0.00 0.00 23.12 21.57 2gc3 s ALA 117 CO 0.33 0.49 0.14 0.21 0.00 0.00 0.00 175.76 176.94 2gc3 s LYS 118 N -3.03 0.34 -0.10 0.00 2.20 0.08 -4.98 119.74 114.25 2gc3 s LYS 118 Ca 0.29 -0.12 0.04 0.00 -0.36 0.00 0.00 55.97 55.82 2gc3 s LYS 118 Cb -0.10 0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.38 2gc3 s LYS 118 CO 0.21 -0.07 -0.22 -0.46 -0.36 0.00 0.00 175.35 174.45 2gc3 s TRP 119 N -0.71 2.44 -0.20 4.03 -0.11 -1.26 -0.73 118.94 122.40 2gc3 s TRP 119 Ca -0.08 -1.04 0.01 0.00 1.22 0.00 0.00 56.10 56.21 2gc3 s TRP 119 Cb -0.05 -1.65 0.03 0.00 -1.50 0.00 0.00 33.47 30.31 2gc3 s TRP 119 CO 0.01 -0.44 -0.16 0.42 -4.62 0.00 0.00 176.95 172.16 2gc3 s ILE 120 N 0.47 1.99 0.40 5.86 -1.09 -0.19 -4.98 121.20 123.65 2gc3 s ILE 120 Ca -0.16 -1.11 -0.27 0.00 -2.23 0.00 0.00 60.65 56.87 2gc3 s ILE 120 Cb -0.17 -1.92 -0.10 0.00 -1.58 0.00 0.00 42.46 38.69 2gc3 s ILE 120 CO 0.06 0.32 1.47 -0.44 -1.23 0.00 0.00 174.94 175.13 2gc3 s SER 121 N 1.27 6.21 -0.06 3.58 0.01 -1.26 -0.60 113.70 122.85 2gc3 s SER 121 Ca 0.00 3.01 0.00 0.00 1.31 0.00 0.00 55.95 60.28 2gc3 s SER 121 Cb -0.15 -2.66 0.02 0.00 0.21 0.00 0.00 66.02 63.44 2gc3 s SER 121 CO -0.10 -0.96 -0.04 -0.04 0.41 0.00 0.00 173.24 172.51 2gc3 s MET 122 N -2.19 0.91 0.18 12.44 -1.94 -0.53 -4.87 119.30 123.29 2gc3 s MET 122 Ca 0.55 -0.09 0.02 0.00 -1.71 0.00 0.00 55.69 54.45 2gc3 s MET 122 Cb -0.46 -0.99 -0.05 0.00 2.01 0.00 0.00 34.83 35.35 2gc3 s MET 122 CO 0.61 -0.15 0.02 -1.21 -0.01 0.00 0.00 175.02 174.29 2gc3 s GLU 123 N 1.24 1.15 0.20 2.03 2.02 -1.26 -1.71 118.70 122.36 2gc3 s GLU 123 Ca -0.06 -1.57 -0.32 0.00 0.02 0.00 0.00 54.97 53.04 2gc3 s GLU 123 Cb -0.14 -0.23 -0.15 0.00 0.10 0.00 0.00 34.13 33.71 2gc3 s GLU 123 CO -0.02 -0.17 1.26 -2.30 0.02 0.00 0.00 175.26 174.05 2gc3 n PRO 124 N -0.27 1.50 0.00 0.39 -0.02 -1.26 -0.92 135.00 134.42 2gc3 n PRO 124 Ca -0.05 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2gc3 n PRO 124 Cb 0.64 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 2gc3 n PRO 124 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gc3 n GLY 125 N 2.07 2.02 3.71 -1.23 0.00 0.07 -4.97 105.19 106.86 2gc3 n GLY 125 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2gc3 n GLY 125 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gc3 s THR 126 N -2.33 3.47 -0.17 2.61 2.01 -0.09 -4.84 115.64 116.29 2gc3 s THR 126 Ca 0.00 1.01 -0.04 0.00 0.31 0.00 0.00 61.69 62.97 2gc3 s THR 126 Cb 0.00 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.84 2gc3 s THR 126 CO 0.00 0.06 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.26 2gc3 s VAL 127 N 1.48 3.81 -0.17 3.82 1.01 -1.26 -0.85 120.40 128.24 2gc3 s VAL 127 Ca 0.64 -0.38 -0.04 0.00 0.00 0.00 0.00 61.98 62.21 2gc3 s VAL 127 Cb -0.35 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.33 2gc3 s VAL 127 CO 0.29 0.47 -0.04 -0.69 0.00 0.00 0.00 175.10 175.14 2gc3 s VAL 128 N 0.61 3.75 -0.35 2.92 1.01 0.22 -4.97 120.40 123.59 2gc3 s VAL 128 Ca -0.02 -0.40 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 2gc3 s VAL 128 Cb -0.14 -2.66 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 2gc3 s VAL 128 CO 0.02 0.47 0.47 -0.47 0.00 0.00 0.00 175.10 175.59 2gc3 s TYR 129 N 0.66 3.19 -0.46 5.22 6.14 -1.26 -1.72 117.35 129.11 2gc3 s TYR 129 Ca -0.02 0.09 -0.17 0.00 0.64 0.00 0.00 57.07 57.60 2gc3 s TYR 129 Cb -0.14 -2.85 0.05 0.00 0.42 0.00 0.00 41.96 39.43 2gc3 s TYR 129 CO 0.02 -0.52 0.48 0.08 0.64 0.00 0.00 175.55 176.26 2gc3 s VAL 130 N 2.27 5.06 0.83 3.14 1.01 -0.02 -5.01 120.40 127.69 2gc3 s VAL 130 Ca 0.16 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2gc3 s VAL 130 Cb -0.16 -4.14 0.09 0.00 0.00 0.00 0.00 36.38 32.17 2gc3 s VAL 130 CO 0.13 -0.59 1.09 -2.84 0.00 0.00 0.00 175.10 172.89 2gc3 s PRO 131 N 2.15 1.78 0.31 2.72 0.02 -1.26 -1.09 135.00 139.63 2gc3 s PRO 131 Ca 0.11 0.92 -0.26 0.00 0.02 0.00 0.00 61.00 61.78 2gc3 s PRO 131 Cb -0.20 -1.86 -0.14 0.00 0.02 0.00 0.00 34.50 32.32 2gc3 s PRO 131 CO 0.11 -1.90 0.80 -2.30 -0.33 0.00 0.00 177.00 173.38 2gc3 n PRO 132 N -3.66 0.88 -0.28 5.54 -0.02 -1.26 -2.90 135.00 133.29 2gc3 n PRO 132 Ca 0.08 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2gc3 n PRO 132 Cb 0.55 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 2gc3 n PRO 132 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2gc3 n TYR 133 N -0.13 0.00 -3.26 6.00 4.01 0.38 -4.95 117.16 119.22 2gc3 n TYR 133 Ca 0.12 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.46 2gc3 n TYR 133 Cb 0.33 -0.01 -0.07 0.00 -0.31 0.00 0.00 39.34 39.28 2gc3 n TYR 133 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2gc3 s TRP 134 N -3.27 3.32 0.60 -0.72 0.52 -1.14 -4.08 118.94 114.17 2gc3 s TRP 134 Ca 0.00 0.69 -0.18 0.00 0.02 0.00 0.00 56.10 56.63 2gc3 s TRP 134 Cb 0.00 -2.68 -0.03 0.00 -1.15 0.00 0.00 33.47 29.61 2gc3 s TRP 134 CO 0.00 -0.18 1.19 0.00 0.02 0.00 0.00 176.95 177.98 2gc3 s ALA 135 N 1.91 2.53 -0.08 0.98 0.00 0.15 -4.80 121.76 122.45 2gc3 s ALA 135 Ca 0.22 0.93 -0.07 0.00 0.00 0.00 0.00 51.96 53.05 2gc3 s ALA 135 Cb -0.15 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.56 2gc3 s ALA 135 CO 0.09 -1.16 0.22 -3.38 0.00 0.00 0.00 175.76 171.53 2gc3 s HIS 136 N -1.71 -0.25 -0.01 0.00 -3.43 -0.97 -1.39 115.29 107.54 2gc3 s HIS 136 Ca 0.76 0.61 0.00 0.00 -0.80 0.00 0.00 55.06 55.63 2gc3 s HIS 136 Cb -0.28 0.07 0.02 0.00 -1.43 0.00 0.00 32.58 30.95 2gc3 s HIS 136 CO 0.34 -0.14 0.01 0.50 -2.00 0.00 0.00 174.74 173.45 2gc3 s ARG 137 N 0.39 0.05 0.09 -0.38 3.52 0.02 -2.73 118.95 119.91 2gc3 s ARG 137 Ca -0.02 0.08 -0.06 0.00 -0.13 0.00 0.00 55.73 55.60 2gc3 s ARG 137 Cb -0.04 -0.20 -0.05 0.00 -1.56 0.00 0.00 34.95 33.10 2gc3 s ARG 137 CO -0.02 -0.09 0.34 0.95 -0.81 0.00 0.00 175.30 175.67 2gc3 s THR 138 N 0.60 5.21 -0.02 4.11 -4.23 -1.26 0.05 115.64 120.10 2gc3 s THR 138 Ca -0.05 0.11 0.03 0.00 -1.18 0.00 0.00 61.69 60.60 2gc3 s THR 138 Cb -0.08 -3.61 -0.00 0.00 1.34 0.00 0.00 72.50 70.15 2gc3 s THR 138 CO -0.02 0.18 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.45 2gc3 s VAL 139 N -1.50 0.92 -0.37 2.29 1.01 0.12 -1.60 120.40 121.27 2gc3 s VAL 139 Ca 0.35 -0.46 -0.14 0.00 0.00 0.00 0.00 61.98 61.73 2gc3 s VAL 139 Cb -0.13 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.46 2gc3 s VAL 139 CO 0.21 0.27 0.29 0.21 0.00 0.00 0.00 175.10 176.08 2gc3 s ASN 140 N -0.00 6.10 0.00 3.32 3.84 -0.77 -1.31 114.94 126.12 2gc3 s ASN 140 Ca -0.00 -0.56 0.20 0.00 0.21 0.00 0.00 52.86 52.71 2gc3 s ASN 140 Cb -0.07 -2.16 0.51 0.00 -0.55 0.00 0.00 41.25 38.98 2gc3 s ASN 140 CO 0.00 -0.34 1.43 2.30 -2.79 0.00 0.00 177.10 177.70 2gc3 n ILE 141 N 5.16 0.86 -3.80 -5.21 -5.35 -0.87 -4.25 119.36 105.90 2gc3 n ILE 141 Ca -0.11 -0.93 0.00 0.00 -0.27 0.00 0.00 62.75 61.44 2gc3 n ILE 141 Cb 0.49 0.63 0.00 0.00 -1.74 0.00 0.00 39.64 39.02 2gc3 n ILE 141 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gc3 n GLY 142 N 1.36 4.19 0.78 3.28 0.00 -1.19 -4.97 105.19 108.63 2gc3 n GLY 142 Ca 0.20 -2.19 0.08 0.00 0.00 0.00 0.00 46.02 44.12 2gc3 n GLY 142 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2gc3 n ASP 143 N -1.14 2.78 -4.50 1.61 5.68 -1.26 -4.51 116.55 115.21 2gc3 n ASP 143 Ca 0.00 -1.81 -0.24 0.00 -0.50 0.00 0.00 54.79 52.24 2gc3 n ASP 143 Cb 0.00 -0.14 -0.11 0.00 -1.14 0.00 0.00 41.12 39.74 2gc3 n ASP 143 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 2gc3 s GLU 144 N -1.22 1.73 0.30 0.11 -1.05 -1.26 -4.81 118.70 112.49 2gc3 s GLU 144 Ca 0.25 -1.93 -0.30 0.00 -0.15 0.00 0.00 54.97 52.85 2gc3 s GLU 144 Cb 0.15 -1.31 -0.12 0.00 -0.44 0.00 0.00 34.13 32.41 2gc3 s GLU 144 CO 0.22 -0.02 1.53 -2.30 0.95 0.00 0.00 175.26 175.64 2gc3 n PRO 145 N -0.74 2.56 -3.29 -4.83 -0.02 -1.26 -4.29 135.00 123.13 2gc3 n PRO 145 Ca -0.04 0.91 -0.41 0.00 -2.02 0.00 0.00 63.50 61.93 2gc3 n PRO 145 Cb 0.65 -2.65 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 2gc3 n PRO 145 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2gc3 s PHE 146 N -0.26 3.19 -0.07 6.00 5.36 0.30 -3.74 117.98 128.77 2gc3 s PHE 146 Ca 0.62 0.15 0.05 0.00 -0.96 0.00 0.00 56.93 56.79 2gc3 s PHE 146 Cb -0.52 -2.83 -0.01 0.00 -0.34 0.00 0.00 43.02 39.31 2gc3 s PHE 146 CO 0.52 -0.49 -0.21 0.42 -1.46 0.00 0.00 175.22 174.00 2gc3 s ILE 147 N 2.27 2.41 0.15 3.12 1.01 0.12 -0.47 121.20 129.82 2gc3 s ILE 147 Ca 0.17 -0.94 -0.16 0.00 0.00 0.00 0.00 60.65 59.72 2gc3 s ILE 147 Cb -0.16 -1.91 0.03 0.00 0.01 0.00 0.00 42.46 40.43 2gc3 s ILE 147 CO 0.13 0.57 0.44 0.72 0.00 0.00 0.00 174.94 176.79 2gc3 s PHE 148 N -0.22 -0.16 -0.03 3.97 -0.71 -0.92 -0.40 117.98 119.51 2gc3 s PHE 148 Ca -0.01 -0.16 0.05 0.00 -1.04 0.00 0.00 56.93 55.76 2gc3 s PHE 148 Cb -0.13 0.29 -0.03 0.00 -1.21 0.00 0.00 43.02 41.94 2gc3 s PHE 148 CO 0.03 -0.77 -0.16 -1.17 -1.34 0.00 0.00 175.22 171.82 2gc3 s LEU 149 N -2.83 2.67 -0.03 -1.99 2.96 -0.05 -0.84 118.68 118.57 2gc3 s LEU 149 Ca 0.05 -0.25 0.05 0.00 -0.22 0.00 0.00 54.13 53.76 2gc3 s LEU 149 Cb 0.01 -1.54 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 2gc3 s LEU 149 CO -0.09 0.33 -0.17 0.00 -1.32 0.00 0.00 176.35 175.10 2gc3 s ALA 150 N -0.76 1.48 -0.13 5.97 0.00 0.15 -0.15 121.76 128.32 2gc3 s ALA 150 Ca 0.12 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.39 2gc3 s ALA 150 Cb -0.11 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.59 2gc3 s ALA 150 CO 0.01 0.31 -0.19 0.42 0.00 0.00 0.00 175.76 176.31 2gc3 s ILE 151 N -0.17 1.83 0.03 0.00 1.09 -0.08 -0.62 121.20 123.28 2gc3 s ILE 151 Ca 0.01 -0.84 -0.04 0.00 -1.10 0.00 0.00 60.65 58.68 2gc3 s ILE 151 Cb -0.09 -1.64 -0.01 0.00 -1.06 0.00 0.00 42.46 39.66 2gc3 s ILE 151 CO 0.01 0.51 0.06 -0.72 -0.10 0.00 0.00 174.94 174.69 2gc3 s TYR 152 N 0.89 0.23 0.38 3.97 1.13 -0.27 -1.81 117.35 121.86 2gc3 s TYR 152 Ca -0.07 -0.52 -0.28 0.00 -1.41 0.00 0.00 57.07 54.80 2gc3 s TYR 152 Cb -0.15 -0.17 -0.11 0.00 -1.10 0.00 0.00 41.96 40.43 2gc3 s TYR 152 CO -0.02 -0.32 1.40 -2.30 -2.51 0.00 0.00 175.55 171.81 2gc3 n PRO 153 N 0.98 2.41 0.30 -3.49 -0.02 -1.26 -0.34 135.00 133.57 2gc3 n PRO 153 Ca -0.20 0.85 0.19 0.00 -2.02 0.00 0.00 63.50 62.31 2gc3 n PRO 153 Cb 0.58 -2.54 0.91 0.00 -0.02 0.00 0.00 33.50 32.43 2gc3 n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gc3 h ALA 154 N 2.70 1.06 -0.56 3.55 0.00 -1.57 -2.09 119.26 122.35 2gc3 h ALA 154 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2gc3 h ALA 154 Cb 1.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2gc3 h ALA 154 CO 0.63 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.51 2gc3 n ASP 155 N -3.20 3.74 -0.17 0.00 5.75 -1.26 -4.23 116.55 117.18 2gc3 n ASP 155 Ca -0.01 -2.13 -0.07 0.00 -0.01 0.00 0.00 54.79 52.56 2gc3 n ASP 155 Cb 0.20 -0.42 0.02 0.00 -1.03 0.00 0.00 41.12 39.89 2gc3 n ASP 155 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gc3 h ALA 156 N 3.32 0.64 -1.78 2.12 0.00 -1.71 -3.39 119.26 118.46 2gc3 h ALA 156 Ca 0.00 -0.06 0.19 0.00 0.00 0.00 0.00 54.91 55.05 2gc3 h ALA 156 Cb 1.01 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2gc3 h ALA 156 CO 0.05 0.11 -0.26 0.41 0.00 0.00 0.00 179.25 179.57 2gc3 n GLY 157 N -1.15 -1.95 2.98 0.00 0.00 -1.26 -0.63 105.19 103.18 2gc3 n GLY 157 Ca 0.02 -1.29 -0.22 0.00 0.00 0.00 0.00 46.02 44.53 2gc3 n GLY 157 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gc3 s HIS 158 N -1.44 1.10 -0.33 1.61 3.76 -1.26 -3.64 115.29 115.08 2gc3 s HIS 158 Ca 0.00 -0.35 0.03 0.00 -0.15 0.00 0.00 55.06 54.60 2gc3 s HIS 158 Cb 0.00 -0.84 0.10 0.00 1.11 0.00 0.00 32.58 32.95 2gc3 s HIS 158 CO 0.00 -0.20 0.05 0.34 -0.85 0.00 0.00 174.74 174.08 2gc3 s ASP 159 N 0.60 4.67 -0.04 1.40 2.15 0.16 -4.47 116.67 121.15 2gc3 s ASP 159 Ca -0.11 -2.07 0.11 0.00 0.43 0.00 0.00 52.55 50.91 2gc3 s ASP 159 Cb -0.13 -1.55 -0.23 0.00 -0.30 0.00 0.00 42.92 40.71 2gc3 s ASP 159 CO 0.02 -0.37 0.67 1.88 -0.17 0.00 0.00 175.17 177.19 2gc3 h TYR 160 N 7.67 0.04 -0.69 -5.34 -1.99 -1.84 -1.80 116.97 113.02 2gc3 h TYR 160 Ca -0.06 -0.03 0.10 0.00 2.00 0.00 0.00 58.73 60.75 2gc3 h TYR 160 Cb 1.02 -0.00 -0.12 0.00 2.00 0.00 0.00 36.73 39.63 2gc3 h TYR 160 CO 0.46 1.06 -0.43 0.78 -0.00 0.00 0.00 178.16 180.03 2gc3 h GLY 161 N 3.30 -0.36 0.80 3.88 0.00 -1.93 0.35 103.07 109.11 2gc3 h GLY 161 Ca -0.28 0.56 0.04 0.00 0.00 0.00 0.00 47.33 47.65 2gc3 h GLY 161 CO 0.08 -0.15 0.33 -0.84 0.00 0.00 0.00 176.54 175.96 2gc3 h THR 162 N -0.16 1.02 -0.18 4.70 2.02 -1.99 -2.01 112.91 116.31 2gc3 h THR 162 Ca 0.21 -0.22 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 2gc3 h THR 162 Cb 0.55 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2gc3 h THR 162 CO -0.76 0.12 -0.48 0.40 0.37 0.00 0.00 175.52 175.17 2gc3 h ILE 163 N 0.64 1.32 -0.47 3.11 1.08 -1.58 -1.11 117.51 120.49 2gc3 h ILE 163 Ca 0.24 -1.69 0.00 0.00 -0.39 0.00 0.00 64.86 63.03 2gc3 h ILE 163 Cb 0.08 1.70 -0.02 0.00 -3.07 0.00 0.00 36.82 35.51 2gc3 h ILE 163 CO -0.13 0.52 0.30 0.00 -0.69 0.00 0.00 178.15 178.15 2gc3 h ALA 164 N 1.13 0.60 0.13 1.87 0.00 -0.43 0.58 119.26 123.14 2gc3 h ALA 164 Ca 0.02 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.58 2gc3 h ALA 164 Cb 0.97 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2gc3 h ALA 164 CO 0.09 0.07 -1.51 1.05 0.00 0.00 0.00 179.25 178.94 2gc3 h GLU 165 N 0.64 0.27 0.00 0.00 4.11 -1.34 -3.42 114.58 114.84 2gc3 h GLU 165 Ca 0.17 -0.47 -0.06 0.00 0.07 0.00 0.00 59.36 59.08 2gc3 h GLU 165 Cb -0.05 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2gc3 h GLU 165 CO -0.04 1.15 -1.41 1.63 0.07 0.00 0.00 179.01 180.42 2gc3 n LYS 166 N -3.48 1.34 0.00 1.06 5.02 -0.43 -5.11 118.16 116.56 2gc3 n LYS 166 Ca -0.16 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 2gc3 n LYS 166 Cb 1.05 -1.18 0.00 0.00 -0.02 0.00 0.00 35.03 34.87 2gc3 n LYS 166 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gc3 n GLY 167 N 2.27 -1.37 3.93 0.72 0.00 0.19 -4.80 105.19 106.13 2gc3 n GLY 167 Ca -0.06 -1.25 -0.26 0.00 0.00 0.00 0.00 46.02 44.45 2gc3 n GLY 167 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gc3 s PHE 168 N 0.00 3.49 -0.76 1.61 0.40 -1.26 -4.74 117.98 116.72 2gc3 s PHE 168 Ca 0.00 0.45 0.26 0.00 -0.60 0.00 0.00 56.93 57.04 2gc3 s PHE 168 Cb 0.00 -1.97 0.90 0.00 0.51 0.00 0.00 43.02 42.47 2gc3 s PHE 168 CO 0.00 0.17 1.79 -1.13 0.70 0.00 0.00 175.22 176.75 2gc3 n SER 169 N -1.34 0.63 -4.39 1.36 3.41 -1.26 -4.70 113.62 107.32 2gc3 n SER 169 Ca -0.04 0.57 -0.28 0.00 -0.26 0.00 0.00 58.87 58.87 2gc3 n SER 169 Cb 0.55 -0.73 -0.13 0.00 -0.26 0.00 0.00 64.21 63.64 2gc3 n SER 169 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2gc3 s LYS 170 N -3.10 1.41 0.13 4.33 -0.14 -1.26 -1.23 119.74 119.87 2gc3 s LYS 170 Ca 0.10 -1.39 0.07 0.00 -1.36 0.00 0.00 55.97 53.40 2gc3 s LYS 170 Cb 0.13 -1.82 -0.04 0.00 -1.68 0.00 0.00 37.83 34.43 2gc3 s LYS 170 CO 0.55 0.42 -0.17 0.96 -0.76 0.00 0.00 175.35 176.35 2gc3 s ILE 171 N -1.28 1.58 -0.22 2.17 -4.36 0.46 -4.67 121.20 114.88 2gc3 s ILE 171 Ca 0.15 -1.74 -0.01 0.00 -0.26 0.00 0.00 60.65 58.80 2gc3 s ILE 171 Cb -0.09 -1.63 0.02 0.00 1.25 0.00 0.00 42.46 42.01 2gc3 s ILE 171 CO 0.07 -0.30 -0.10 -0.69 0.24 0.00 0.00 174.94 174.16 2gc3 s VAL 172 N -1.86 2.69 0.18 8.37 1.01 -1.26 -1.36 120.40 128.15 2gc3 s VAL 172 Ca 0.10 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.17 2gc3 s VAL 172 Cb -0.06 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 2gc3 s VAL 172 CO 0.05 0.32 -0.04 0.27 0.00 0.00 0.00 175.10 175.70 2gc3 s ILE 173 N 1.33 0.94 -0.31 2.22 -4.36 -0.61 -2.17 121.20 118.22 2gc3 s ILE 173 Ca 0.02 -2.02 -0.10 0.00 -0.26 0.00 0.00 60.65 58.29 2gc3 s ILE 173 Cb -0.15 -2.06 -0.01 0.00 1.25 0.00 0.00 42.46 41.49 2gc3 s ILE 173 CO -0.07 -0.55 0.16 -0.70 0.24 0.00 0.00 174.94 174.02 2gc3 s GLU 174 N -3.84 3.31 -0.08 0.37 2.12 0.33 -1.12 118.70 119.79 2gc3 s GLU 174 Ca 0.22 -0.74 -0.00 0.00 0.36 0.00 0.00 54.97 54.81 2gc3 s GLU 174 Cb 0.05 -3.58 0.02 0.00 0.26 0.00 0.00 34.13 30.88 2gc3 s GLU 174 CO 0.04 -0.43 -0.05 -2.00 -0.54 0.00 0.00 175.26 172.28 2gc3 s GLU 175 N 1.61 1.07 -1.31 4.30 2.12 -0.52 -4.79 118.70 121.18 2gc3 s GLU 175 Ca 0.04 -0.11 -0.02 0.00 0.36 0.00 0.00 54.97 55.25 2gc3 s GLU 175 Cb -0.17 -1.20 0.01 0.00 0.26 0.00 0.00 34.13 33.03 2gc3 s GLU 175 CO 0.06 -0.21 0.81 0.09 -0.54 0.00 0.00 175.26 175.46 2gc3 n ASN 176 N 4.73 -1.91 0.00 -1.70 5.03 -1.26 -2.62 115.26 117.53 2gc3 n ASN 176 Ca -0.14 -0.77 0.00 0.00 0.87 0.00 0.00 54.58 54.54 2gc3 n ASN 176 Cb 0.50 -4.28 0.00 0.00 -1.02 0.00 0.00 39.78 34.98 2gc3 n ASN 176 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2gc3 n GLY 177 N -1.52 0.30 3.07 7.41 0.00 -1.26 -5.00 105.19 108.18 2gc3 n GLY 177 Ca -0.25 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.65 2gc3 n GLY 177 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2gc3 s GLU 178 N -0.84 0.54 0.00 1.61 -1.05 -1.08 -5.13 118.70 112.76 2gc3 s GLU 178 Ca 0.00 -0.82 -0.30 0.00 -0.15 0.00 0.00 54.97 53.70 2gc3 s GLU 178 Cb 0.00 -0.23 -0.04 0.00 -0.44 0.00 0.00 34.13 33.43 2gc3 s GLU 178 CO 0.00 0.03 1.11 0.08 0.95 0.00 0.00 175.26 177.43 2gc3 s VAL 179 N -1.72 4.41 -0.04 1.83 1.01 -1.26 -1.43 120.40 123.20 2gc3 s VAL 179 Ca -0.08 1.73 0.03 0.00 0.00 0.00 0.00 61.98 63.66 2gc3 s VAL 179 Cb -0.08 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.20 2gc3 s VAL 179 CO -0.01 0.09 -0.13 -0.54 0.00 0.00 0.00 175.10 174.51 2gc3 s LYS 180 N 1.39 1.52 -0.41 2.72 1.02 -0.28 -4.98 119.74 120.72 2gc3 s LYS 180 Ca 0.55 -0.47 -0.17 0.00 0.02 0.00 0.00 55.97 55.90 2gc3 s LYS 180 Cb -0.25 -1.32 0.02 0.00 -0.52 0.00 0.00 37.83 35.76 2gc3 s LYS 180 CO 0.26 0.15 0.44 0.08 -0.92 0.00 0.00 175.35 175.36 2gc3 s VAL 181 N 0.25 5.08 0.28 3.17 1.01 -1.26 -1.58 120.40 127.35 2gc3 s VAL 181 Ca -0.06 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.73 2gc3 s VAL 181 Cb -0.12 -4.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 2gc3 s VAL 181 CO 0.02 -0.38 -0.01 0.68 0.00 0.00 0.00 175.10 175.41 2gc3 s VAL 182 N 2.17 1.37 0.30 2.92 -7.23 -0.47 -4.95 120.40 114.50 2gc3 s VAL 182 Ca 0.13 -2.06 -0.30 0.00 -1.81 0.00 0.00 61.98 57.94 2gc3 s VAL 182 Cb -0.17 -2.52 -0.11 0.00 0.56 0.00 0.00 36.38 34.14 2gc3 s VAL 182 CO 0.14 -0.22 1.57 -1.81 -0.31 0.00 0.00 175.10 174.46 2gc3 s ASP 183 N -3.42 6.39 -0.15 4.85 1.11 -1.26 -0.40 116.67 123.79 2gc3 s ASP 183 Ca 0.31 2.94 -0.29 0.00 0.18 0.00 0.00 52.55 55.69 2gc3 s ASP 183 Cb 0.06 -2.64 -0.04 0.00 1.07 0.00 0.00 42.92 41.37 2gc3 s ASP 183 CO 0.12 -0.89 1.71 0.21 1.18 0.00 0.00 175.17 177.50 2gc3 s ASN 184 N 0.42 6.38 0.24 0.27 3.84 -0.36 -4.61 114.94 121.12 2gc3 s ASN 184 Ca 0.62 1.91 0.23 0.00 0.21 0.00 0.00 52.86 55.83 2gc3 s ASN 184 Cb -0.47 -2.53 0.96 0.00 -0.55 0.00 0.00 41.25 38.65 2gc3 s ASN 184 CO 0.49 -1.21 1.71 -2.65 -2.79 0.00 0.00 177.10 172.64 2gc3 n PRO 185 N 7.60 0.19 -0.28 0.43 -0.02 -1.26 -2.54 135.00 139.13 2gc3 n PRO 185 Ca 0.19 0.40 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 2gc3 n PRO 185 Cb 0.44 -1.85 0.28 0.00 -0.02 0.00 0.00 33.50 32.35 2gc3 n PRO 185 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2gc3 n ARG 186 N -2.20 2.55 0.00 -0.52 0.63 -1.26 -5.26 116.66 110.60 2gc3 n ARG 186 Ca 0.02 -2.38 0.13 0.00 -0.92 0.00 0.00 57.85 54.70 2gc3 n ARG 186 Cb 0.24 -1.53 0.33 0.00 0.45 0.00 0.00 32.46 31.95 2gc3 n ARG 186 CO 0.00 0.00 0.00 1.87 -2.51 0.00 0.00 177.63 176.99