#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g4s s PRO 5 N 0.00 4.28 0.12 1.97 0.02 -1.26 -4.89 135.00 135.24 3g4s s PRO 5 Ca 0.00 2.29 0.12 0.00 0.02 0.00 0.00 61.00 63.43 3g4s s PRO 5 Cb 0.00 -3.11 0.57 0.00 0.02 0.00 0.00 34.50 31.98 3g4s s PRO 5 CO 0.00 -0.40 1.37 0.00 -0.33 0.00 0.00 177.00 177.64 3g4s n ALA 6 N 2.21 1.24 0.33 -1.55 0.00 -1.26 -2.53 120.51 118.96 3g4s n ALA 6 Ca 0.06 0.05 0.22 0.00 0.00 0.00 0.00 53.44 53.77 3g4s n ALA 6 Cb 0.40 -1.18 1.16 0.00 0.00 0.00 0.00 19.45 19.83 3g4s n ALA 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3g4s h SER 7 N 0.00 0.00 0.84 0.00 4.64 -2.00 0.30 113.55 117.33 3g4s h SER 7 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 3g4s h SER 7 Cb 0.10 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 3g4s h SER 7 CO 0.00 0.00 -1.23 0.24 -0.87 0.00 0.00 176.83 174.97 3g4s h MET 8 N 0.00 0.00 0.00 4.77 2.86 -1.89 -3.40 114.93 117.27 3g4s h MET 8 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g4s h MET 8 Cb 0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.73 3g4s h MET 8 CO -0.00 0.78 0.00 0.66 1.06 0.00 0.00 176.91 179.41 3g4s n TYR 9 N -3.22 0.00 0.12 -0.22 4.02 -0.41 -4.79 117.16 112.66 3g4s n TYR 9 Ca -0.06 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.85 3g4s n TYR 9 Cb 0.97 0.00 0.39 0.00 -0.02 0.00 0.00 39.34 40.67 3g4s n TYR 9 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 176.86 175.92 3g4s h ARG 10 N 0.00 0.23 -6.82 -0.72 0.11 -0.62 -3.42 114.38 103.15 3g4s h ARG 10 Ca 0.00 -0.05 -0.50 0.00 0.10 0.00 0.00 59.98 59.53 3g4s h ARG 10 Cb 0.01 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.06 3g4s h ARG 10 CO 0.00 0.38 0.11 -0.51 0.10 0.00 0.00 179.97 180.04 3g4s s ASP 11 N -6.88 6.55 -0.46 0.08 1.01 -1.26 -1.19 116.67 114.52 3g4s s ASP 11 Ca -0.05 1.13 -0.13 0.00 0.71 0.00 0.00 52.55 54.21 3g4s s ASP 11 Cb 0.15 -2.32 0.08 0.00 1.01 0.00 0.00 42.92 41.84 3g4s s ASP 11 CO 0.73 -0.37 0.35 -0.63 0.21 0.00 0.00 175.17 175.46 3g4s s ILE 12 N -2.32 4.77 0.00 0.77 1.01 -1.26 -4.78 121.20 119.39 3g4s s ILE 12 Ca 0.51 -1.27 0.00 0.00 0.00 0.00 0.00 60.65 59.89 3g4s s ILE 12 Cb -0.10 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.46 3g4s s ILE 12 CO 0.30 -0.58 0.00 -0.90 0.00 0.00 0.00 174.94 173.75 3g4s n ASP 13 N 5.07 0.21 -4.87 3.58 5.68 -1.26 -5.10 116.55 119.87 3g4s n ASP 13 Ca -0.11 0.00 -0.31 0.00 -0.50 0.00 0.00 54.79 53.87 3g4s n ASP 13 Cb 0.43 0.03 -0.04 0.00 -1.14 0.00 0.00 41.12 40.41 3g4s n ASP 13 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3g4s s LYS 14 N -0.46 3.84 1.16 0.11 1.02 -1.26 -5.07 119.74 119.08 3g4s s LYS 14 Ca 0.00 0.57 -0.17 0.00 0.02 0.00 0.00 55.97 56.39 3g4s s LYS 14 Cb 0.00 -2.36 0.27 0.00 -0.52 0.00 0.00 37.83 35.22 3g4s s LYS 14 CO 0.00 -0.04 1.07 -2.14 -0.92 0.00 0.00 175.35 173.32 3g4s s PRO 15 N -3.76 -0.91 -0.45 -1.68 0.02 -1.26 -4.90 135.00 122.06 3g4s s PRO 15 Ca 0.53 0.23 -0.28 0.00 0.02 0.00 0.00 61.00 61.50 3g4s s PRO 15 Cb -0.10 -1.61 -0.00 0.00 0.02 0.00 0.00 34.50 32.81 3g4s s PRO 15 CO 0.29 -3.56 1.62 0.00 -0.33 0.00 0.00 177.00 175.02 3g4s s ALA 16 N -2.85 2.78 -0.70 -1.55 0.00 -1.26 -4.90 121.76 113.28 3g4s s ALA 16 Ca 0.69 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.47 3g4s s ALA 16 Cb -0.15 -4.06 0.17 0.00 0.00 0.00 0.00 23.12 19.08 3g4s s ALA 16 CO 0.58 -2.85 0.49 -0.47 0.00 0.00 0.00 175.76 173.51 3g4s s TYR 17 N 6.68 3.56 0.00 0.00 5.04 -1.26 -4.86 117.35 126.51 3g4s s TYR 17 Ca 0.66 -3.29 0.00 0.00 -2.44 0.00 0.00 57.07 52.01 3g4s s TYR 17 Cb -0.16 -2.78 0.00 0.00 0.35 0.00 0.00 41.96 39.37 3g4s s TYR 17 CO 0.29 -0.59 0.00 0.25 -1.34 0.00 0.00 175.55 174.16 3g4s n THR 18 N 2.15 0.00 -1.69 4.34 -2.24 -1.26 -2.09 114.28 113.49 3g4s n THR 18 Ca 0.18 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.63 3g4s n THR 18 Cb 0.35 0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.68 3g4s n THR 18 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3g4s s ARG 19 N -1.61 2.15 0.10 -0.78 1.81 -1.26 -4.85 118.95 114.52 3g4s s ARG 19 Ca 0.00 1.00 0.14 0.00 -1.72 0.00 0.00 55.73 55.15 3g4s s ARG 19 Cb 0.00 -4.60 0.62 0.00 -0.45 0.00 0.00 34.95 30.52 3g4s s ARG 19 CO 0.00 -3.36 1.43 0.54 -0.68 0.00 0.00 175.30 173.24 3g4s n ARG 20 N 9.01 0.06 0.00 3.54 1.74 -1.26 -1.53 116.66 128.23 3g4s n ARG 20 Ca 0.35 0.40 0.15 0.00 -0.77 0.00 0.00 57.85 57.98 3g4s n ARG 20 Cb 0.52 -1.65 0.74 0.00 -1.02 0.00 0.00 32.46 31.06 3g4s n ARG 20 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3g4s n GLU 21 N -1.77 1.01 0.00 5.56 0.00 -1.26 -3.66 120.64 120.52 3g4s n GLU 21 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 57.16 56.90 3g4s n GLU 21 Cb 0.12 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.07 3g4s n GLU 21 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3g4s n TYR 22 N -0.75 0.00 -3.88 -1.84 4.02 -0.58 -5.03 117.16 109.11 3g4s n TYR 22 Ca 0.19 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.73 3g4s n TYR 22 Cb 0.22 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.45 3g4s n TYR 22 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3g4s s ILE 23 N -1.71 5.03 0.07 -0.72 1.01 -0.85 -5.11 121.20 118.92 3g4s s ILE 23 Ca 0.00 0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.77 3g4s s ILE 23 Cb 0.00 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 3g4s s ILE 23 CO 0.00 0.44 -0.18 0.42 0.00 0.00 0.00 174.94 175.62 3g4s s THR 24 N 0.47 1.44 0.00 2.92 -4.23 -1.26 -4.63 115.64 110.35 3g4s s THR 24 Ca 0.05 -1.32 0.00 0.00 -1.18 0.00 0.00 61.69 59.25 3g4s s THR 24 Cb -0.12 -1.31 0.00 0.00 1.34 0.00 0.00 72.50 72.41 3g4s s THR 24 CO 0.00 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 3g4s n GLY 25 N 1.43 0.86 3.66 3.99 0.00 -1.26 -4.86 105.19 109.01 3g4s n GLY 25 Ca -0.19 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 3g4s n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g4s s ILE 26 N -2.76 4.86 0.23 -0.61 1.01 -1.26 -4.79 121.20 117.87 3g4s s ILE 26 Ca 0.00 1.64 -0.30 0.00 0.00 0.00 0.00 60.65 61.98 3g4s s ILE 26 Cb 0.00 -4.14 -0.10 0.00 0.01 0.00 0.00 42.46 38.23 3g4s s ILE 26 CO 0.00 -0.01 1.47 -2.84 0.00 0.00 0.00 174.94 173.57 3g4s s PRO 27 N 2.37 4.25 0.91 2.79 0.02 -1.26 -4.98 135.00 139.10 3g4s s PRO 27 Ca 0.38 2.32 -0.11 0.00 0.02 0.00 0.00 61.00 63.61 3g4s s PRO 27 Cb -0.16 -3.12 0.14 0.00 0.02 0.00 0.00 34.50 31.38 3g4s s PRO 27 CO 0.11 -0.47 1.11 0.20 -0.33 0.00 0.00 177.00 177.61 3g4s s GLY 28 N 0.58 1.65 0.28 0.52 0.00 -1.26 -4.69 107.32 104.41 3g4s s GLY 28 Ca 0.62 0.29 -0.30 0.00 0.00 0.00 0.00 44.72 45.33 3g4s s GLY 28 CO 0.40 0.75 1.57 -0.45 0.00 0.00 0.00 173.10 175.37 3g4s s SER 29 N -2.96 6.43 0.29 1.64 0.15 -1.26 -4.91 113.70 113.07 3g4s s SER 29 Ca 0.65 2.89 0.25 0.00 0.70 0.00 0.00 55.95 60.44 3g4s s SER 29 Cb -0.21 -2.63 0.55 0.00 -1.71 0.00 0.00 66.02 62.02 3g4s s SER 29 CO 0.58 -0.88 1.64 0.11 1.20 0.00 0.00 173.24 175.90 3g4s h LYS 30 N 4.93 0.00 -6.78 5.44 1.57 -1.93 -3.45 116.57 116.35 3g4s h LYS 30 Ca -0.47 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.80 3g4s h LYS 30 Cb 1.22 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.55 3g4s h LYS 30 CO 0.79 0.00 0.53 0.42 -0.57 0.00 0.00 179.45 180.62 3g4s s ILE 31 N -3.16 3.38 -0.20 1.86 1.01 -1.26 -4.94 121.20 117.89 3g4s s ILE 31 Ca 0.08 1.31 -0.11 0.00 0.00 0.00 0.00 60.65 61.94 3g4s s ILE 31 Cb 0.09 -3.84 -0.09 0.00 0.01 0.00 0.00 42.46 38.64 3g4s s ILE 31 CO 0.64 0.28 -0.27 0.00 0.00 0.00 0.00 174.94 175.60 3g4s n ALA 32 N 1.51 1.62 -3.41 9.38 0.00 -1.26 -5.01 120.51 123.33 3g4s n ALA 32 Ca 0.01 -0.81 -0.32 0.00 0.00 0.00 0.00 53.44 52.32 3g4s n ALA 32 Cb 0.44 0.21 -0.17 0.00 0.00 0.00 0.00 19.45 19.94 3g4s n ALA 32 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3g4s s GLN 33 N -2.42 2.96 -0.07 0.00 -0.21 -1.26 -4.98 119.66 113.68 3g4s s GLN 33 Ca -0.28 -0.84 0.20 0.00 0.02 0.00 0.00 55.36 54.46 3g4s s GLN 33 Cb 0.10 -2.30 -0.29 0.00 1.00 0.00 0.00 33.01 31.52 3g4s s GLN 33 CO 0.36 0.09 0.39 0.72 -2.12 0.00 0.00 175.29 174.73 3g4s n HIS 34 N 3.76 0.09 -3.96 0.91 8.25 -1.26 -4.80 115.22 118.21 3g4s n HIS 34 Ca -0.19 0.03 -0.34 0.00 -0.26 0.00 0.00 57.72 56.95 3g4s n HIS 34 Cb 0.52 -0.70 -0.14 0.00 1.12 0.00 0.00 29.99 30.79 3g4s n HIS 34 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3g4s s LYS 35 N -3.16 2.68 0.33 -0.41 -0.14 -1.26 -2.14 119.74 115.64 3g4s s LYS 35 Ca -0.08 -1.08 0.09 0.00 -1.36 0.00 0.00 55.97 53.54 3g4s s LYS 35 Cb 0.11 -3.01 -0.05 0.00 -1.68 0.00 0.00 37.83 33.20 3g4s s LYS 35 CO 0.88 -0.47 0.03 -1.64 -0.76 0.00 0.00 175.35 173.38 3g4s s MET 36 N 1.28 2.14 3.32 1.68 -1.94 -0.31 -4.95 119.30 120.51 3g4s s MET 36 Ca -0.02 -1.67 0.00 0.00 -1.71 0.00 0.00 55.69 52.29 3g4s s MET 36 Cb -0.18 -1.99 0.00 0.00 2.01 0.00 0.00 34.83 34.67 3g4s s MET 36 CO -0.04 0.17 0.00 0.41 -0.01 0.00 0.00 175.02 175.55 3g4s n GLY 37 N -0.97 0.56 3.26 -0.03 0.00 -1.26 -2.04 105.19 104.71 3g4s n GLY 37 Ca -0.04 -1.05 -0.44 0.00 0.00 0.00 0.00 46.02 44.49 3g4s n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g4s s ARG 38 N 0.00 3.23 0.00 1.61 0.52 -0.54 -4.92 118.95 118.84 3g4s s ARG 38 Ca 0.00 -2.41 0.05 0.00 -0.52 0.00 0.00 55.73 52.85 3g4s s ARG 38 Cb 0.00 -4.20 0.28 0.00 0.52 0.00 0.00 34.95 31.55 3g4s s ARG 38 CO 0.00 -1.26 1.00 0.36 0.02 0.00 0.00 175.30 175.42 3g4s n LYS 39 N 3.95 0.80 -0.01 3.54 2.85 -1.26 -2.98 118.16 125.04 3g4s n LYS 39 Ca 0.10 0.00 -0.01 0.00 -1.05 0.00 0.00 58.31 57.34 3g4s n LYS 39 Cb 0.44 -1.09 -0.12 0.00 -0.65 0.00 0.00 35.03 33.60 3g4s n LYS 39 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 3g4s n GLN 40 N -0.59 0.65 -3.40 -1.58 6.02 -1.26 -4.93 117.38 112.28 3g4s n GLN 40 Ca 0.04 0.09 -0.31 0.00 -0.01 0.00 0.00 57.00 56.80 3g4s n GLN 40 Cb 0.02 -1.68 -0.05 0.00 1.02 0.00 0.00 30.24 29.55 3g4s n GLN 40 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3g4s s LYS 41 N -2.90 3.76 0.64 -1.09 2.20 -1.16 -5.10 119.74 116.10 3g4s s LYS 41 Ca -0.06 0.21 -0.10 0.00 -0.36 0.00 0.00 55.97 55.66 3g4s s LYS 41 Cb 0.09 -2.65 -0.01 0.00 -1.51 0.00 0.00 37.83 33.75 3g4s s LYS 41 CO 0.83 0.30 1.03 -0.51 -0.36 0.00 0.00 175.35 176.64 3g4s s ASP 42 N -2.53 5.81 0.43 1.43 1.01 -1.26 -4.99 116.67 116.57 3g4s s ASP 42 Ca 0.46 1.17 0.24 0.00 0.71 0.00 0.00 52.55 55.14 3g4s s ASP 42 Cb -0.11 -2.12 0.48 0.00 1.01 0.00 0.00 42.92 42.17 3g4s s ASP 42 CO 0.23 -1.08 1.66 0.00 0.21 0.00 0.00 175.17 176.20 3g4s h ALA 43 N -0.41 1.00 0.00 5.23 0.00 -1.97 -3.15 119.26 119.96 3g4s h ALA 43 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3g4s h ALA 43 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3g4s h ALA 43 CO 0.63 0.00 -0.16 -0.25 0.00 0.00 0.00 179.25 179.46 3g4s n ASP 44 N -3.03 0.37 -0.19 0.00 8.00 -1.26 -3.40 116.55 117.04 3g4s n ASP 44 Ca 0.04 0.34 0.14 0.00 0.71 0.00 0.00 54.79 56.01 3g4s n ASP 44 Cb 0.50 -0.36 0.72 0.00 -0.02 0.00 0.00 41.12 41.96 3g4s n ASP 44 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3g4s n ASP 45 N -1.76 0.57 -4.45 -2.24 8.00 -1.19 -4.82 116.55 110.67 3g4s n ASP 45 Ca 0.06 -1.27 -0.33 0.00 0.71 0.00 0.00 54.79 53.96 3g4s n ASP 45 Cb 0.37 -0.01 -0.13 0.00 -0.02 0.00 0.00 41.12 41.33 3g4s n ASP 45 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3g4s s TYR 46 N -1.98 2.73 -0.06 1.24 1.51 -1.22 -5.03 117.35 114.54 3g4s s TYR 46 Ca 0.41 -0.28 0.19 0.00 -1.01 0.00 0.00 57.07 56.38 3g4s s TYR 46 Cb 0.20 -1.68 0.45 0.00 -0.11 0.00 0.00 41.96 40.82 3g4s s TYR 46 CO 0.33 0.08 1.62 -1.35 -1.11 0.00 0.00 175.55 175.12 3g4s h PRO 47 N 5.69 0.00 -6.30 -1.71 0.11 -1.88 -3.46 132.00 124.45 3g4s h PRO 47 Ca -0.41 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.02 3g4s h PRO 47 Cb 1.17 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.08 3g4s h PRO 47 CO 0.52 0.34 -0.73 0.08 -0.21 0.00 0.00 178.00 177.99 3g4s s VAL 48 N -3.28 3.39 -0.38 3.15 1.01 -1.18 -4.34 120.40 118.76 3g4s s VAL 48 Ca 0.03 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.29 3g4s s VAL 48 Cb 0.08 -2.41 0.16 0.00 0.00 0.00 0.00 36.38 34.21 3g4s s VAL 48 CO 0.69 0.49 0.30 -1.58 0.00 0.00 0.00 175.10 175.00 3g4s s GLN 49 N -1.08 0.73 -0.27 2.72 0.74 -1.22 -2.92 119.66 118.36 3g4s s GLN 49 Ca 0.14 -1.63 -0.10 0.00 0.05 0.00 0.00 55.36 53.83 3g4s s GLN 49 Cb -0.11 -1.26 -0.04 0.00 1.10 0.00 0.00 33.01 32.70 3g4s s GLN 49 CO 0.04 -1.29 0.14 0.42 -0.55 0.00 0.00 175.29 174.05 3g4s s ILE 50 N 0.65 4.95 0.21 -2.34 1.01 -1.04 -1.29 121.20 123.33 3g4s s ILE 50 Ca 0.25 0.05 0.08 0.00 0.00 0.00 0.00 60.65 61.02 3g4s s ILE 50 Cb -0.10 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 3g4s s ILE 50 CO -0.09 0.29 0.04 -0.44 0.00 0.00 0.00 174.94 174.74 3g4s s SER 51 N 1.66 4.88 -0.41 3.58 0.01 -0.30 -2.35 113.70 120.78 3g4s s SER 51 Ca 0.07 -0.41 -0.14 0.00 1.31 0.00 0.00 55.95 56.78 3g4s s SER 51 Cb -0.16 -1.06 0.03 0.00 0.21 0.00 0.00 66.02 65.04 3g4s s SER 51 CO 0.08 0.05 0.29 -0.22 0.41 0.00 0.00 173.24 173.85 3g4s s LEU 52 N -3.26 5.10 -0.17 2.44 2.96 -0.52 -1.42 118.68 123.80 3g4s s LEU 52 Ca 0.29 -1.02 -0.13 0.00 -0.22 0.00 0.00 54.13 53.05 3g4s s LEU 52 Cb -0.08 -2.12 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 3g4s s LEU 52 CO 0.20 -0.47 0.24 -0.63 -1.32 0.00 0.00 176.35 174.38 3g4s s ILE 53 N 1.63 5.34 -0.24 6.68 1.01 0.13 -1.65 121.20 134.09 3g4s s ILE 53 Ca 0.04 0.44 -0.23 0.00 0.00 0.00 0.00 60.65 60.91 3g4s s ILE 53 Cb -0.20 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 38.67 3g4s s ILE 53 CO 0.08 0.40 0.73 -0.69 0.00 0.00 0.00 174.94 175.47 3g4s s VAL 54 N 0.44 4.91 0.12 2.92 1.01 -0.67 -0.65 120.40 128.48 3g4s s VAL 54 Ca 0.14 1.37 -0.03 0.00 0.00 0.00 0.00 61.98 63.46 3g4s s VAL 54 Cb -0.12 -4.03 -0.21 0.00 0.00 0.00 0.00 36.38 32.01 3g4s s VAL 54 CO 0.02 -0.01 1.26 -0.33 0.00 0.00 0.00 175.10 176.04 3g4s h GLU 55 N 7.72 0.31 -6.24 2.72 5.08 -1.81 0.18 114.58 122.54 3g4s h GLU 55 Ca -0.26 -0.40 -0.67 0.00 -1.00 0.00 0.00 59.36 57.03 3g4s h GLU 55 Cb 1.11 0.13 -0.16 0.00 0.50 0.00 0.00 28.75 30.33 3g4s h GLU 55 CO 0.82 1.12 -0.68 -1.21 -1.00 0.00 0.00 179.01 178.06 3g4s s GLU 56 N -3.02 2.64 -0.61 2.33 2.02 -1.26 -4.51 118.70 116.28 3g4s s GLU 56 Ca -0.04 -0.68 -0.27 0.00 0.02 0.00 0.00 54.97 54.00 3g4s s GLU 56 Cb 0.08 -2.57 -0.00 0.00 0.10 0.00 0.00 34.13 31.74 3g4s s GLU 56 CO 0.87 0.61 1.64 0.99 0.02 0.00 0.00 175.26 179.38 3g4s s THR 57 N -1.03 3.53 0.52 3.63 2.01 -1.26 -4.39 115.64 118.65 3g4s s THR 57 Ca 0.18 0.36 0.00 0.00 0.31 0.00 0.00 61.69 62.54 3g4s s THR 57 Cb -0.11 -4.24 0.00 0.00 0.01 0.00 0.00 72.50 68.15 3g4s s THR 57 CO 0.08 -1.15 0.00 1.33 -0.69 0.00 0.00 174.62 174.20 3g4s n VAL 58 N 6.96 0.00 -3.51 3.82 0.24 -0.65 -4.73 118.33 120.46 3g4s n VAL 58 Ca 0.15 -2.45 -0.29 0.00 -2.04 0.00 0.00 64.34 59.71 3g4s n VAL 58 Cb 0.50 0.49 -0.12 0.00 -1.47 0.00 0.00 33.84 33.24 3g4s n VAL 58 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3g4s s GLN 59 N -3.87 0.67 -0.13 7.34 0.74 -0.33 -1.70 119.66 122.38 3g4s s GLN 59 Ca 0.00 -1.43 -0.23 0.00 0.05 0.00 0.00 55.36 53.76 3g4s s GLN 59 Cb -0.00 -1.49 -0.03 0.00 1.10 0.00 0.00 33.01 32.59 3g4s s GLN 59 CO 0.00 -1.19 0.70 -0.51 -0.55 0.00 0.00 175.29 173.74 3g4s s LEU 60 N 0.97 4.24 0.77 3.68 1.43 -1.06 -4.05 118.68 124.65 3g4s s LEU 60 Ca 0.18 1.07 -0.11 0.00 -1.03 0.00 0.00 54.13 54.24 3g4s s LEU 60 Cb -0.23 -3.05 0.05 0.00 0.03 0.00 0.00 46.19 43.00 3g4s s LEU 60 CO -0.00 -0.22 1.09 -0.13 0.23 0.00 0.00 176.35 177.32 3g4s s ARG 61 N 1.39 2.28 0.59 1.70 0.52 -1.26 -1.28 118.95 122.90 3g4s s ARG 61 Ca 0.35 1.18 0.33 0.00 -0.52 0.00 0.00 55.73 57.07 3g4s s ARG 61 Cb -0.17 -1.90 1.88 0.00 0.52 0.00 0.00 34.95 35.29 3g4s s ARG 61 CO 0.14 -1.62 2.24 1.12 0.02 0.00 0.00 175.30 177.20 3g4s h HIS 62 N -1.07 0.00 0.06 -0.53 2.07 -1.53 -1.01 115.15 113.14 3g4s h HIS 62 Ca -0.44 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 56.81 3g4s h HIS 62 Cb 1.23 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.23 3g4s h HIS 62 CO 0.58 0.03 -1.13 0.78 -3.07 0.00 0.00 177.93 175.12 3g4s h GLY 63 N 0.26 0.64 2.00 6.13 0.00 -1.92 -1.28 103.07 108.91 3g4s h GLY 63 Ca -0.00 -1.24 -0.10 0.00 0.00 0.00 0.00 47.33 45.98 3g4s h GLY 63 CO 0.00 1.10 -0.48 1.76 0.00 0.00 0.00 176.54 178.92 3g4s h SER 64 N 0.28 0.00 -0.01 0.19 0.02 -1.66 -1.55 113.55 110.82 3g4s h SER 64 Ca -0.14 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.74 3g4s h SER 64 Cb 1.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.33 3g4s h SER 64 CO 0.21 0.48 -0.25 -0.07 -1.14 0.00 0.00 176.83 176.07 3g4s h LEU 65 N 0.00 0.24 -0.72 5.07 4.07 -1.17 -2.67 115.31 120.12 3g4s h LEU 65 Ca -0.00 -0.75 -0.04 0.00 0.08 0.00 0.00 57.88 57.17 3g4s h LEU 65 Cb 1.05 -0.07 -0.03 0.00 1.08 0.00 0.00 40.66 42.68 3g4s h LEU 65 CO 0.06 0.95 0.31 -0.08 -1.08 0.00 0.00 178.44 178.60 3g4s h GLU 66 N -0.45 1.07 -0.33 1.13 4.57 -1.19 -1.34 114.58 118.03 3g4s h GLU 66 Ca -0.03 -0.18 -0.13 0.00 -1.18 0.00 0.00 59.36 57.84 3g4s h GLU 66 Cb 0.98 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.38 3g4s h GLU 66 CO 0.05 0.86 -0.33 0.00 -1.18 0.00 0.00 179.01 178.42 3g4s h ALA 67 N 1.15 0.80 0.00 2.92 0.00 -1.38 0.32 119.26 123.08 3g4s h ALA 67 Ca 0.24 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3g4s h ALA 67 Cb 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3g4s h ALA 67 CO -0.02 0.65 -0.22 -1.13 0.00 0.00 0.00 179.25 178.53 3g4s n SER 68 N -4.07 0.39 -0.02 0.00 3.41 -1.00 -2.90 113.62 109.41 3g4s n SER 68 Ca -0.01 0.27 -0.18 0.00 -0.26 0.00 0.00 58.87 58.69 3g4s n SER 68 Cb 0.49 -0.27 -0.14 0.00 -0.26 0.00 0.00 64.21 64.03 3g4s n SER 68 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3g4s n ARG 69 N -1.74 0.72 0.00 4.33 0.63 -0.52 -3.93 116.66 116.15 3g4s n ARG 69 Ca 0.06 0.24 0.00 0.00 -0.92 0.00 0.00 57.85 57.23 3g4s n ARG 69 Cb 0.37 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.59 3g4s n ARG 69 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 3g4s n LEU 70 N -3.33 0.01 0.00 6.15 7.94 0.09 -1.06 117.00 126.79 3g4s n LEU 70 Ca -0.31 0.92 0.03 0.00 -1.11 0.00 0.00 56.01 55.54 3g4s n LEU 70 Cb 1.05 -0.48 0.13 0.00 0.53 0.00 0.00 43.42 44.64 3g4s n LEU 70 CO 0.41 -0.48 0.57 -1.54 -1.11 0.00 0.00 177.39 175.24 3g4s n SER 71 N -1.94 0.00 -0.04 1.96 3.41 -1.14 -0.46 113.62 115.40 3g4s n SER 71 Ca 0.00 0.41 -0.21 0.00 -0.26 0.00 0.00 58.87 58.81 3g4s n SER 71 Cb 0.00 -0.43 -0.13 0.00 -0.26 0.00 0.00 64.21 63.39 3g4s n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g4s h ALA 72 N 2.22 0.24 0.00 7.33 0.00 -1.66 -3.32 119.26 124.07 3g4s h ALA 72 Ca 0.00 -1.15 -0.17 0.00 0.00 0.00 0.00 54.91 53.59 3g4s h ALA 72 Cb 0.08 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3g4s h ALA 72 CO 0.00 0.81 -0.81 -0.97 0.00 0.00 0.00 179.25 178.28 3g4s h ASN 73 N -0.55 0.00 0.60 0.00 -0.00 -0.19 -3.15 115.58 112.29 3g4s h ASN 73 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.98 3g4s h ASN 73 Cb 1.58 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.90 3g4s h ASN 73 CO -0.04 0.81 0.00 0.54 -0.00 0.00 0.00 177.43 178.74 3g4s n ARG 74 N -3.52 0.06 -0.01 6.67 1.74 0.39 -1.33 116.66 120.65 3g4s n ARG 74 Ca -0.00 0.28 -0.10 0.00 -0.77 0.00 0.00 57.85 57.26 3g4s n ARG 74 Cb 0.79 -1.60 -0.14 0.00 -1.02 0.00 0.00 32.46 30.49 3g4s n ARG 74 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3g4s h HIS 75 N 0.00 0.07 0.00 -1.55 2.76 -1.64 -2.80 115.15 111.99 3g4s h HIS 75 Ca 0.00 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.12 3g4s h HIS 75 Cb 0.30 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.26 3g4s h HIS 75 CO 0.00 1.10 0.00 -0.07 -1.30 0.00 0.00 177.93 177.66 3g4s h LEU 76 N 0.01 0.00 0.00 0.26 3.38 -1.37 0.93 115.31 118.52 3g4s h LEU 76 Ca -0.29 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.40 3g4s h LEU 76 Cb 2.00 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.71 3g4s h LEU 76 CO 0.09 0.00 -1.60 0.40 0.09 0.00 0.00 178.44 177.42 3g4s h ILE 77 N 0.00 0.98 0.01 1.22 2.04 -1.32 -2.75 117.51 117.69 3g4s h ILE 77 Ca 0.00 -2.81 -0.00 0.00 1.00 0.00 0.00 64.86 63.05 3g4s h ILE 77 Cb 0.93 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 3g4s h ILE 77 CO 0.00 0.57 -0.00 0.50 0.00 0.00 0.00 178.15 179.22 3g4s h LYS 78 N 0.00 -0.01 0.05 2.37 3.64 -1.30 -2.68 116.57 118.64 3g4s h LYS 78 Ca -0.24 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.89 3g4s h LYS 78 Cb 1.98 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.78 3g4s h LYS 78 CO 0.09 0.76 -1.21 0.93 -2.27 0.00 0.00 179.45 177.75 3g4s h GLU 79 N -0.80 0.11 -0.06 1.90 4.39 -0.99 -3.35 114.58 115.78 3g4s h GLU 79 Ca -0.00 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.51 3g4s h GLU 79 Cb 0.77 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.50 3g4s h GLU 79 CO 0.00 1.03 0.00 1.28 -1.16 0.00 0.00 179.01 180.17 3g4s n LEU 80 N -3.39 2.52 0.00 1.33 4.77 -1.04 -5.07 117.00 116.12 3g4s n LEU 80 Ca -0.06 -1.06 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 3g4s n LEU 80 Cb 0.99 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.06 3g4s n LEU 80 CO 0.49 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 3g4s n GLY 81 N 0.99 -0.56 0.26 -0.72 0.00 -1.01 -3.46 105.19 100.70 3g4s n GLY 81 Ca 0.11 -1.72 0.13 0.00 0.00 0.00 0.00 46.02 44.54 3g4s n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3g4s h GLU 82 N 0.00 0.00 -2.06 1.61 5.08 -1.88 -3.24 114.58 114.08 3g4s h GLU 82 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 3g4s h GLU 82 Cb 0.00 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.84 3g4s h GLU 82 CO 0.00 0.12 -0.97 0.39 -1.00 0.00 0.00 179.01 177.55 3g4s n GLU 83 N -3.48 1.92 -1.69 2.33 1.02 -1.26 -5.04 120.64 114.44 3g4s n GLU 83 Ca -0.01 -3.98 -0.30 0.00 -0.02 0.00 0.00 57.16 52.85 3g4s n GLU 83 Cb 0.27 -1.91 0.18 0.00 -0.02 0.00 0.00 31.44 29.97 3g4s n GLU 83 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3g4s s GLY 84 N -2.89 1.69 -1.20 0.62 0.00 -1.22 -4.97 107.32 99.36 3g4s s GLY 84 Ca 0.43 -1.01 -0.05 0.00 0.00 0.00 0.00 44.72 44.09 3g4s s GLY 84 CO -0.10 -0.27 1.99 1.34 0.00 0.00 0.00 173.10 176.06 3g4s n ASP 85 N -3.95 7.02 -3.91 1.64 2.03 -1.26 -4.72 116.55 113.39 3g4s n ASP 85 Ca 0.13 -3.33 -0.12 0.00 0.52 0.00 0.00 54.79 51.99 3g4s n ASP 85 Cb 0.60 -1.32 -0.08 0.00 -0.72 0.00 0.00 41.12 39.60 3g4s n ASP 85 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 3g4s s TYR 86 N -1.97 0.98 -0.29 -0.67 -0.85 -1.26 -4.15 117.35 109.15 3g4s s TYR 86 Ca 0.43 -1.21 -0.01 0.00 -0.52 0.00 0.00 57.07 55.76 3g4s s TYR 86 Cb 0.15 -0.29 0.18 0.00 0.38 0.00 0.00 41.96 42.37 3g4s s TYR 86 CO -0.05 -0.84 0.55 -1.59 -1.52 0.00 0.00 175.55 172.10 3g4s s LYS 87 N -3.88 0.52 0.14 -3.49 -2.85 -0.98 -1.47 119.74 107.73 3g4s s LYS 87 Ca 0.33 0.88 -0.00 0.00 -1.00 0.00 0.00 55.97 56.18 3g4s s LYS 87 Cb 0.03 0.33 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 3g4s s LYS 87 CO 0.14 -0.65 0.31 1.41 0.10 0.00 0.00 175.35 176.67 3g4s s MET 88 N 2.79 3.50 -0.07 1.78 1.75 -0.86 -1.50 119.30 126.68 3g4s s MET 88 Ca 0.19 -0.39 -0.07 0.00 -1.25 0.00 0.00 55.69 54.17 3g4s s MET 88 Cb -0.15 -2.93 0.02 0.00 2.84 0.00 0.00 34.83 34.61 3g4s s MET 88 CO -0.20 0.50 0.19 0.99 -0.65 0.00 0.00 175.02 175.85 3g4s s THR 89 N -1.70 0.01 -0.41 10.11 2.01 -0.20 -1.17 115.64 124.29 3g4s s THR 89 Ca 0.37 -0.06 -0.03 0.00 0.31 0.00 0.00 61.69 62.28 3g4s s THR 89 Cb -0.12 -0.30 0.11 0.00 0.01 0.00 0.00 72.50 72.21 3g4s s THR 89 CO 0.28 -0.04 0.21 -0.22 -0.69 0.00 0.00 174.62 174.16 3g4s s LEU 90 N -0.04 5.25 0.00 4.42 2.96 -0.91 -1.21 118.68 129.15 3g4s s LEU 90 Ca -0.01 -2.06 0.25 0.00 -0.22 0.00 0.00 54.13 52.08 3g4s s LEU 90 Cb -0.02 -1.83 1.30 0.00 0.50 0.00 0.00 46.19 46.14 3g4s s LEU 90 CO 0.00 -0.54 1.83 -2.11 -1.32 0.00 0.00 176.35 174.22 3g4s n ARG 91 N 4.55 0.45 -3.88 1.98 1.85 -1.11 -4.83 116.66 115.66 3g4s n ARG 91 Ca -0.02 0.04 -0.28 0.00 -1.00 0.00 0.00 57.85 56.60 3g4s n ARG 91 Cb 0.41 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.29 3g4s n ARG 91 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3g4s s LYS 92 N -2.44 3.46 -0.02 2.89 -0.14 -1.26 -5.11 119.74 117.11 3g4s s LYS 92 Ca 0.26 -0.49 0.02 0.00 -1.36 0.00 0.00 55.97 54.41 3g4s s LYS 92 Cb 0.17 -2.96 0.00 0.00 -1.68 0.00 0.00 37.83 33.36 3g4s s LYS 92 CO 0.35 0.52 -0.08 -0.06 -0.76 0.00 0.00 175.35 175.32 3g4s s PHE 93 N -1.70 0.86 -0.51 3.18 0.40 -1.26 -5.12 117.98 113.83 3g4s s PHE 93 Ca 0.36 -0.20 -0.28 0.00 -0.60 0.00 0.00 56.93 56.20 3g4s s PHE 93 Cb -0.12 -0.60 0.02 0.00 0.51 0.00 0.00 43.02 42.83 3g4s s PHE 93 CO 0.28 -0.08 1.29 -1.25 0.70 0.00 0.00 175.22 176.17 3g4s s PRO 94 N 0.12 3.52 -0.05 0.24 0.04 -1.26 -4.54 135.00 133.06 3g4s s PRO 94 Ca -0.02 0.54 0.03 0.00 0.04 0.00 0.00 61.00 61.59 3g4s s PRO 94 Cb -0.07 -4.02 -0.06 0.00 0.04 0.00 0.00 34.50 30.39 3g4s s PRO 94 CO 0.00 -1.66 0.00 0.72 0.04 0.00 0.00 177.00 176.10 3g4s n HIS 95 N 8.72 0.00 -2.24 0.56 8.25 -0.76 -4.76 115.22 124.99 3g4s n HIS 95 Ca 0.12 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.17 3g4s n HIS 95 Cb 0.49 -0.24 -0.03 0.00 1.12 0.00 0.00 29.99 31.33 3g4s n HIS 95 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3g4s s GLN 96 N -2.12 3.19 0.08 -0.41 2.00 0.27 -4.48 119.66 118.19 3g4s s GLN 96 Ca -0.04 0.70 -0.31 0.00 -2.00 0.00 0.00 55.36 53.72 3g4s s GLN 96 Cb 0.02 -4.19 -0.06 0.00 0.80 0.00 0.00 33.01 29.58 3g4s s GLN 96 CO 0.19 -2.06 1.23 0.08 -0.50 0.00 0.00 175.29 174.22 3g4s s VAL 97 N 6.79 3.86 0.15 1.34 1.01 -0.89 -0.20 120.40 132.47 3g4s s VAL 97 Ca 0.61 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.99 3g4s s VAL 97 Cb -0.13 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 3g4s s VAL 97 CO 0.26 0.12 0.20 -0.76 0.00 0.00 0.00 175.10 174.92 3g4s s LEU 98 N 0.92 4.05 0.31 3.92 1.43 0.39 -4.86 118.68 124.83 3g4s s LEU 98 Ca 0.59 0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.77 3g4s s LEU 98 Cb -0.31 -2.64 -0.06 0.00 0.03 0.00 0.00 46.19 43.21 3g4s s LEU 98 CO 0.30 0.07 -0.04 -0.13 0.23 0.00 0.00 176.35 176.79 3g4s s ARG 99 N -3.08 1.64 -0.29 1.70 0.52 -1.26 -2.13 118.95 116.05 3g4s s ARG 99 Ca 0.32 -1.86 -0.12 0.00 -0.52 0.00 0.00 55.73 53.55 3g4s s ARG 99 Cb -0.11 -1.22 0.12 0.00 0.52 0.00 0.00 34.95 34.27 3g4s s ARG 99 CO 0.26 0.00 0.71 -2.00 0.02 0.00 0.00 175.30 174.29 3g4s s GLU 100 N -3.74 0.57 -0.70 3.54 2.12 -1.08 -4.87 118.70 114.55 3g4s s GLU 100 Ca 0.32 1.29 -0.26 0.00 0.36 0.00 0.00 54.97 56.67 3g4s s GLU 100 Cb 0.05 0.61 0.04 0.00 0.26 0.00 0.00 34.13 35.09 3g4s s GLU 100 CO 0.14 -0.17 1.18 1.21 -0.54 0.00 0.00 175.26 177.08 3g4s s ASN 101 N 2.46 6.19 -0.34 -1.70 2.47 -1.26 -2.72 114.94 120.04 3g4s s ASN 101 Ca -0.07 -0.53 -0.01 0.00 0.42 0.00 0.00 52.86 52.67 3g4s s ASN 101 Cb -0.09 -2.52 0.12 0.00 -1.45 0.00 0.00 41.25 37.31 3g4s s ASN 101 CO -0.19 -1.69 0.17 -1.59 -3.72 0.00 0.00 177.10 170.08 3g4s s LYS 102 N 5.19 0.58 0.00 0.43 -2.85 -1.26 -5.05 119.74 116.78 3g4s s LYS 102 Ca 0.32 -1.14 0.00 0.00 -1.00 0.00 0.00 55.97 54.15 3g4s s LYS 102 Cb -0.10 -1.53 0.00 0.00 -2.06 0.00 0.00 37.83 34.13 3g4s s LYS 102 CO 0.15 -1.11 0.00 -3.47 0.10 0.00 0.00 175.35 171.02 3g4s n ASP 114 N 4.48 0.00 0.00 0.03 -0.08 -1.26 -5.14 116.55 114.58 3g4s n ASP 114 Ca 0.04 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 3g4s n ASP 114 Cb 0.39 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.85 3g4s n ASP 114 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3g4s n GLY 115 N 0.00 0.83 0.65 0.27 0.00 -1.26 -4.38 105.19 101.30 3g4s n GLY 115 Ca 0.00 -1.69 0.12 0.00 0.00 0.00 0.00 46.02 44.46 3g4s n GLY 115 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3g4s n MET 116 N 0.00 1.74 -2.52 1.61 2.81 -1.26 -4.86 117.12 114.65 3g4s n MET 116 Ca 0.00 -1.31 -0.42 0.00 -1.81 0.00 0.00 57.70 54.16 3g4s n MET 116 Cb 0.00 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.01 3g4s n MET 116 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 3g4s s ARG 117 N -2.16 4.39 -0.79 0.03 3.52 -1.26 -3.25 118.95 119.43 3g4s s ARG 117 Ca 0.28 1.61 -0.04 0.00 -0.13 0.00 0.00 55.73 57.46 3g4s s ARG 117 Cb 0.20 -3.51 -0.05 0.00 -1.56 0.00 0.00 34.95 30.03 3g4s s ARG 117 CO 0.39 -0.36 0.70 0.00 -0.81 0.00 0.00 175.30 175.22 3g4s n ALA 118 N 4.86 -2.09 0.28 6.12 0.00 -1.26 -4.95 120.51 123.47 3g4s n ALA 118 Ca 0.10 0.10 0.18 0.00 0.00 0.00 0.00 53.44 53.81 3g4s n ALA 118 Cb 0.47 -4.20 0.72 0.00 0.00 0.00 0.00 19.45 16.44 3g4s n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g4s h ALA 119 N -0.01 1.00 -1.90 0.00 0.00 -1.88 -3.44 119.26 113.04 3g4s h ALA 119 Ca -0.41 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 53.92 3g4s h ALA 119 Cb 1.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3g4s h ALA 119 CO 0.33 0.00 1.26 0.12 0.00 0.00 0.00 179.25 180.96 3g4s s PHE 120 N -3.70 1.83 0.76 0.00 5.36 -1.26 -4.73 117.98 116.24 3g4s s PHE 120 Ca 0.01 0.60 -0.11 0.00 -0.96 0.00 0.00 56.93 56.47 3g4s s PHE 120 Cb 0.09 -4.12 0.05 0.00 -0.34 0.00 0.00 43.02 38.70 3g4s s PHE 120 CO 0.53 -3.00 1.09 0.20 -1.46 0.00 0.00 175.22 172.58 3g4s s GLY 121 N 5.88 1.70 0.54 13.12 0.00 -1.26 -4.94 107.32 122.35 3g4s s GLY 121 Ca 0.79 0.27 -0.08 0.00 0.00 0.00 0.00 44.72 45.70 3g4s s GLY 121 CO 0.33 0.61 0.89 -1.59 0.00 0.00 0.00 173.10 173.34 3g4s s LYS 122 N -4.87 3.55 -0.15 2.90 -2.85 -1.10 -4.63 119.74 112.58 3g4s s LYS 122 Ca 0.61 0.42 -0.29 0.00 -1.00 0.00 0.00 55.97 55.71 3g4s s LYS 122 Cb -0.17 -2.25 -0.02 0.00 -2.06 0.00 0.00 37.83 33.32 3g4s s LYS 122 CO 0.55 -0.36 1.40 0.42 0.10 0.00 0.00 175.35 177.46 3g4s s ILE 123 N -2.92 4.03 -0.15 3.79 1.09 -1.26 -2.62 121.20 123.15 3g4s s ILE 123 Ca 0.51 1.23 0.02 0.00 -1.10 0.00 0.00 60.65 61.30 3g4s s ILE 123 Cb -0.11 -3.84 -0.10 0.00 -1.06 0.00 0.00 42.46 37.35 3g4s s ILE 123 CO 0.49 -0.16 -0.13 1.33 -0.10 0.00 0.00 174.94 176.37 3g4s n VAL 124 N 5.56 0.89 -3.14 2.92 0.24 -0.90 -4.79 118.33 119.10 3g4s n VAL 124 Ca 0.15 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3g4s n VAL 124 Cb 0.44 -1.04 0.00 0.00 -1.47 0.00 0.00 33.84 31.77 3g4s n VAL 124 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g4s n GLY 125 N 2.74 1.66 3.18 7.63 0.00 -1.25 -4.72 105.19 114.43 3g4s n GLY 125 Ca -0.27 -0.92 -0.19 0.00 0.00 0.00 0.00 46.02 44.64 3g4s n GLY 125 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g4s s THR 126 N -2.72 1.17 0.08 2.61 2.01 -1.26 -0.46 115.64 117.06 3g4s s THR 126 Ca 0.00 -1.36 -0.03 0.00 0.31 0.00 0.00 61.69 60.61 3g4s s THR 126 Cb 0.00 -1.15 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 3g4s s THR 126 CO 0.00 -0.24 0.05 0.00 -0.69 0.00 0.00 174.62 173.74 3g4s s ALA 127 N -1.36 0.45 -0.14 7.40 0.00 0.72 -1.22 121.76 127.61 3g4s s ALA 127 Ca -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.80 3g4s s ALA 127 Cb -0.09 0.49 -0.01 0.00 0.00 0.00 0.00 23.12 23.50 3g4s s ALA 127 CO 0.02 -0.44 -0.14 0.00 0.00 0.00 0.00 175.76 175.21 3g4s s ALA 128 N -3.95 2.56 -0.45 0.00 0.00 -0.40 -0.56 121.76 118.96 3g4s s ALA 128 Ca 0.12 -0.94 -0.29 0.00 0.00 0.00 0.00 51.96 50.85 3g4s s ALA 128 Cb 0.07 -1.21 0.03 0.00 0.00 0.00 0.00 23.12 22.01 3g4s s ALA 128 CO -0.07 0.16 1.11 1.03 0.00 0.00 0.00 175.76 177.99 3g4s s ARG 129 N 0.51 3.76 -0.22 0.00 0.52 -1.26 -2.58 118.95 119.68 3g4s s ARG 129 Ca -0.10 0.60 -0.02 0.00 -0.52 0.00 0.00 55.73 55.69 3g4s s ARG 129 Cb -0.16 -3.88 0.01 0.00 0.52 0.00 0.00 34.95 31.43 3g4s s ARG 129 CO 0.04 -1.30 -0.08 0.08 0.02 0.00 0.00 175.30 174.06 3g4s s VAL 130 N 4.28 2.96 0.50 3.52 1.01 -0.69 -5.04 120.40 126.94 3g4s s VAL 130 Ca 0.47 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.64 3g4s s VAL 130 Cb -0.08 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 3g4s s VAL 130 CO 0.29 0.41 0.88 -1.10 0.00 0.00 0.00 175.10 175.57 3g4s s GLN 131 N 1.40 3.70 0.35 2.72 -1.52 -1.26 -1.63 119.66 123.42 3g4s s GLN 131 Ca 0.05 0.55 -0.28 0.00 -1.95 0.00 0.00 55.36 53.72 3g4s s GLN 131 Cb -0.14 -2.27 -0.10 0.00 -0.22 0.00 0.00 33.01 30.28 3g4s s GLN 131 CO -0.06 -0.25 1.31 0.00 -0.25 0.00 0.00 175.29 176.04 3g4s s ALA 132 N -2.72 3.45 0.00 6.09 0.00 -1.26 -3.09 121.76 124.23 3g4s s ALA 132 Ca 0.52 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.75 3g4s s ALA 132 Cb -0.10 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.53 3g4s s ALA 132 CO 0.41 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 175.87 3g4s n GLY 133 N 0.75 1.67 3.87 0.00 0.00 0.63 -4.98 105.19 107.12 3g4s n GLY 133 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 3g4s n GLY 133 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g4s s GLU 134 N -0.70 3.70 -0.33 1.61 2.02 -1.18 -4.77 118.70 119.06 3g4s s GLU 134 Ca 0.00 0.73 -0.17 0.00 0.02 0.00 0.00 54.97 55.55 3g4s s GLU 134 Cb 0.00 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 32.07 3g4s s GLU 134 CO 0.00 -0.41 0.45 -0.65 0.02 0.00 0.00 175.26 174.67 3g4s s GLN 135 N -4.73 3.69 -0.16 1.61 -0.21 -1.26 -1.67 119.66 116.93 3g4s s GLN 135 Ca 0.55 -0.17 -0.26 0.00 0.02 0.00 0.00 55.36 55.50 3g4s s GLN 135 Cb -0.11 -3.77 -0.23 0.00 1.00 0.00 0.00 33.01 29.89 3g4s s GLN 135 CO 0.45 -0.54 0.58 1.25 -2.12 0.00 0.00 175.29 174.92 3g4s h LEU 136 N 8.90 0.00 -9.06 2.90 5.85 -1.71 -3.45 115.31 118.75 3g4s h LEU 136 Ca -0.29 -0.83 -0.67 0.00 0.84 0.00 0.00 57.88 56.92 3g4s h LEU 136 Cb 1.14 0.00 -0.19 0.00 0.37 0.00 0.00 40.66 41.98 3g4s h LEU 136 CO 0.73 1.15 -0.81 -0.36 -0.34 0.00 0.00 178.44 178.80 3g4s s PHE 137 N -2.26 2.47 -0.17 1.25 0.40 -1.25 -2.76 117.98 115.66 3g4s s PHE 137 Ca -0.22 -0.30 -0.05 0.00 -0.60 0.00 0.00 56.93 55.77 3g4s s PHE 137 Cb -0.00 -1.30 0.09 0.00 0.51 0.00 0.00 43.02 42.31 3g4s s PHE 137 CO 0.65 0.39 0.30 0.99 0.70 0.00 0.00 175.22 178.25 3g4s s THR 138 N -1.21 -0.47 0.10 0.64 2.01 -0.35 -1.44 115.64 114.91 3g4s s THR 138 Ca 0.18 0.13 0.05 0.00 0.31 0.00 0.00 61.69 62.36 3g4s s THR 138 Cb -0.10 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 3g4s s THR 138 CO 0.09 0.01 -0.03 0.00 -0.69 0.00 0.00 174.62 174.01 3g4s s ALA 139 N 2.46 3.21 -0.20 7.40 0.00 -0.99 -1.03 121.76 132.60 3g4s s ALA 139 Ca 0.04 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 50.83 3g4s s ALA 139 Cb -0.13 -1.12 0.06 0.00 0.00 0.00 0.00 23.12 21.93 3g4s s ALA 139 CO -0.11 0.68 -0.01 0.71 0.00 0.00 0.00 175.76 177.03 3g4s s TYR 140 N -1.29 1.67 0.05 0.00 1.51 -0.56 -2.51 117.35 116.22 3g4s s TYR 140 Ca 0.25 -1.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.07 3g4s s TYR 140 Cb -0.11 -1.29 -0.00 0.00 -0.11 0.00 0.00 41.96 40.45 3g4s s TYR 140 CO 0.17 -0.67 0.02 0.00 -1.11 0.00 0.00 175.55 173.96 3g4s s ASN 142 N -1.33 6.17 0.31 0.00 -0.87 -1.26 -3.09 114.94 114.86 3g4s s ASN 142 Ca 0.02 0.12 0.04 0.00 -1.57 0.00 0.00 52.86 51.47 3g4s s ASN 142 Cb 0.00 -1.70 0.63 0.00 -0.02 0.00 0.00 41.25 40.16 3g4s s ASN 142 CO 0.02 -0.29 1.86 0.58 -2.57 0.00 0.00 177.10 176.69 3g4s h VAL 143 N 0.91 0.91 0.00 1.60 2.07 -1.98 -2.52 116.25 117.24 3g4s h VAL 143 Ca -0.49 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 66.61 3g4s h VAL 143 Cb 1.24 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3g4s h VAL 143 CO 0.59 0.17 -0.50 -0.33 0.02 0.00 0.00 177.57 177.51 3g4s h GLU 144 N 0.91 0.00 -0.19 1.57 5.08 -2.01 -3.28 114.58 116.67 3g4s h GLU 144 Ca 0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 3g4s h GLU 144 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3g4s h GLU 144 CO -0.23 0.50 0.00 -0.25 -1.00 0.00 0.00 179.01 178.03 3g4s n ASP 145 N -3.23 1.88 -0.14 1.42 9.92 -0.96 -4.42 116.55 121.00 3g4s n ASP 145 Ca 0.02 -1.74 -0.06 0.00 -0.53 0.00 0.00 54.79 52.48 3g4s n ASP 145 Cb 0.73 -0.12 0.11 0.00 -0.64 0.00 0.00 41.12 41.20 3g4s n ASP 145 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3g4s h ALA 146 N 4.11 1.00 0.00 2.24 0.00 -1.58 -2.92 119.26 122.11 3g4s h ALA 146 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3g4s h ALA 146 Cb 0.55 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3g4s h ALA 146 CO 0.00 0.61 0.00 0.39 0.00 0.00 0.00 179.25 180.25 3g4s n GLU 147 N -4.19 0.46 -0.04 0.00 -0.58 -1.26 -1.76 120.64 113.26 3g4s n GLU 147 Ca 0.02 0.03 -0.06 0.00 -0.42 0.00 0.00 57.16 56.73 3g4s n GLU 147 Cb 0.33 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 29.56 3g4s n GLU 147 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3g4s n HIS 148 N -1.23 0.53 0.02 -0.32 8.25 -1.11 -3.92 115.22 117.44 3g4s n HIS 148 Ca 0.14 0.19 -0.06 0.00 -0.26 0.00 0.00 57.72 57.72 3g4s n HIS 148 Cb 0.19 -1.05 -0.11 0.00 1.12 0.00 0.00 29.99 30.13 3g4s n HIS 148 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 3g4s h VAL 149 N 0.00 1.09 0.00 1.59 3.04 -1.32 -2.15 116.25 118.50 3g4s h VAL 149 Ca -0.35 -2.82 0.00 0.00 -1.01 0.00 0.00 66.70 62.52 3g4s h VAL 149 Cb 1.97 2.51 0.00 0.00 -2.01 0.00 0.00 31.29 33.76 3g4s h VAL 149 CO 0.05 0.62 0.00 0.29 -1.01 0.00 0.00 177.57 177.52 3g4s n LYS 150 N -3.14 0.33 -0.00 4.17 5.02 -0.72 -1.65 118.16 122.16 3g4s n LYS 150 Ca -0.09 0.07 0.06 0.00 -2.02 0.00 0.00 58.31 56.33 3g4s n LYS 150 Cb 0.96 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 34.40 3g4s n LYS 150 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3g4s n GLU 151 N -1.28 1.45 0.15 1.97 4.07 -1.19 -3.58 120.64 122.23 3g4s n GLU 151 Ca 0.11 -0.07 0.11 0.00 -0.06 0.00 0.00 57.16 57.25 3g4s n GLU 151 Cb 0.17 -1.18 0.07 0.00 -0.06 0.00 0.00 31.44 30.45 3g4s n GLU 151 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3g4s h ALA 152 N 1.23 0.72 0.00 4.31 0.00 -0.62 -3.26 119.26 121.64 3g4s h ALA 152 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3g4s h ALA 152 Cb 0.42 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3g4s h ALA 152 CO 0.00 0.04 -1.45 1.19 0.00 0.00 0.00 179.25 179.03 3g4s n PHE 153 N -2.88 0.56 0.18 0.00 0.99 -0.71 -2.99 117.46 112.61 3g4s n PHE 153 Ca 0.01 0.16 0.05 0.00 -0.00 0.00 0.00 57.45 57.68 3g4s n PHE 153 Cb 0.55 -0.78 0.24 0.00 -1.00 0.00 0.00 39.48 38.49 3g4s n PHE 153 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 3g4s h ARG 154 N 0.00 0.00 0.00 -1.08 2.43 -1.61 -2.56 114.38 111.56 3g4s h ARG 154 Ca -0.02 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 58.86 3g4s h ARG 154 Cb 1.04 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 3g4s h ARG 154 CO 0.00 0.40 -1.72 0.54 -1.51 0.00 0.00 179.97 177.68 3g4s n ARG 155 N -3.38 0.63 0.08 0.20 1.74 -1.23 -4.27 116.66 110.43 3g4s n ARG 155 Ca 0.01 0.30 -0.06 0.00 -0.77 0.00 0.00 57.85 57.33 3g4s n ARG 155 Cb 0.58 -1.79 0.10 0.00 -1.02 0.00 0.00 32.46 30.34 3g4s n ARG 155 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g4s h ALA 156 N 1.00 0.81 0.00 7.54 0.00 -1.43 -3.15 119.26 124.03 3g4s h ALA 156 Ca -0.29 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.06 3g4s h ALA 156 Cb 2.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.72 3g4s h ALA 156 CO 0.08 0.75 0.00 2.48 0.00 0.00 0.00 179.25 182.56 3g4s n TYR 157 N -3.85 0.76 0.72 0.00 0.18 -0.98 -3.13 117.16 110.87 3g4s n TYR 157 Ca -0.03 0.24 0.13 0.00 1.88 0.00 0.00 57.90 60.13 3g4s n TYR 157 Cb 0.64 -0.89 0.46 0.00 -0.38 0.00 0.00 39.34 39.17 3g4s n TYR 157 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 3g4s n ASN 158 N -2.14 0.60 -0.66 9.48 3.02 -1.19 -3.55 115.26 120.82 3g4s n ASN 158 Ca 0.05 0.56 0.08 0.00 -0.03 0.00 0.00 54.58 55.23 3g4s n ASN 158 Cb 0.36 -0.72 0.10 0.00 -0.61 0.00 0.00 39.78 38.91 3g4s n ASN 158 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3g4s n LYS 159 N -2.06 1.49 -4.13 3.52 5.02 -1.18 -4.98 118.16 115.83 3g4s n LYS 159 Ca 0.06 -1.59 -0.26 0.00 -2.02 0.00 0.00 58.31 54.50 3g4s n LYS 159 Cb 0.40 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 34.05 3g4s n LYS 159 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3g4s s ILE 160 N -1.20 2.07 0.11 -0.18 -4.36 -1.23 -4.67 121.20 111.74 3g4s s ILE 160 Ca 0.21 -1.68 -0.05 0.00 -0.26 0.00 0.00 60.65 58.87 3g4s s ILE 160 Cb 0.13 -2.75 -0.22 0.00 1.25 0.00 0.00 42.46 40.88 3g4s s ILE 160 CO 0.19 0.00 1.24 0.74 0.24 0.00 0.00 174.94 177.35 3g4s h THR 161 N 1.28 1.43 -1.81 8.37 2.02 -1.94 -3.48 112.91 118.77 3g4s h THR 161 Ca -0.42 -2.67 -0.44 0.00 0.77 0.00 0.00 66.41 63.65 3g4s h THR 161 Cb 1.27 2.62 0.04 0.00 -1.74 0.00 0.00 68.15 70.34 3g4s h THR 161 CO 0.68 0.79 -0.11 -2.16 0.37 0.00 0.00 175.52 175.08 3g4s s PRO 162 N -3.03 2.52 0.27 6.66 0.04 -1.26 -5.08 135.00 135.11 3g4s s PRO 162 Ca -0.05 -1.12 -0.28 0.00 0.04 0.00 0.00 61.00 59.58 3g4s s PRO 162 Cb 0.08 -2.60 -0.09 0.00 0.04 0.00 0.00 34.50 31.93 3g4s s PRO 162 CO 0.88 -0.65 0.94 -1.12 0.04 0.00 0.00 177.00 177.09 3g4s s SER 163 N -4.47 7.52 0.11 6.66 0.01 -1.26 -4.91 113.70 117.36 3g4s s SER 163 Ca 0.58 1.91 0.05 0.00 1.31 0.00 0.00 55.95 59.80 3g4s s SER 163 Cb -0.09 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 3g4s s SER 163 CO 0.37 0.06 -0.12 0.00 0.41 0.00 0.00 173.24 173.96 3g4s s ARG 165 N -2.78 3.51 -0.43 0.00 0.52 0.18 -4.96 118.95 114.99 3g4s s ARG 165 Ca 0.08 -0.29 -0.07 0.00 -0.52 0.00 0.00 55.73 54.92 3g4s s ARG 165 Cb -0.04 -3.08 0.10 0.00 0.52 0.00 0.00 34.95 32.45 3g4s s ARG 165 CO 0.02 0.57 0.26 0.42 0.02 0.00 0.00 175.30 176.58 3g4s s ILE 166 N -0.46 3.95 -0.17 1.52 1.01 -1.26 0.17 121.20 125.97 3g4s s ILE 166 Ca 0.10 -1.65 -0.05 0.00 0.00 0.00 0.00 60.65 59.05 3g4s s ILE 166 Cb -0.12 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3g4s s ILE 166 CO 0.02 -0.60 0.00 -0.75 0.00 0.00 0.00 174.94 173.61 3g4s s LYS 167 N 1.34 3.79 -0.38 2.79 2.20 -0.51 -4.97 119.74 124.00 3g4s s LYS 167 Ca 0.04 -0.45 -0.21 0.00 -0.36 0.00 0.00 55.97 54.99 3g4s s LYS 167 Cb -0.24 -3.03 0.01 0.00 -1.51 0.00 0.00 37.83 33.06 3g4s s LYS 167 CO -0.00 0.25 0.69 0.08 -0.36 0.00 0.00 175.35 176.01 3g4s s VAL 168 N 0.38 4.81 -0.14 4.02 1.01 -1.26 -1.15 120.40 128.08 3g4s s VAL 168 Ca -0.01 0.58 0.21 0.00 0.00 0.00 0.00 61.98 62.75 3g4s s VAL 168 Cb -0.13 -4.16 -0.17 0.00 0.00 0.00 0.00 36.38 31.92 3g4s s VAL 168 CO 0.02 -0.43 0.71 1.21 0.00 0.00 0.00 175.10 176.61 3g4s n GLU 169 N 6.25 0.64 -3.56 2.72 4.07 -0.42 -4.81 120.64 125.52 3g4s n GLU 169 Ca 0.00 0.03 -0.25 0.00 -0.06 0.00 0.00 57.16 56.88 3g4s n GLU 169 Cb 0.48 -1.69 -0.15 0.00 -0.06 0.00 0.00 31.44 30.02 3g4s n GLU 169 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 3g4s s ARG 170 N -3.23 0.13 0.00 5.31 0.52 -1.25 -4.96 118.95 115.48 3g4s s ARG 170 Ca -0.05 -0.11 0.00 0.00 -0.52 0.00 0.00 55.73 55.05 3g4s s ARG 170 Cb 0.10 -1.51 0.00 0.00 0.52 0.00 0.00 34.95 34.07 3g4s s ARG 170 CO 0.84 -0.76 0.00 0.41 0.02 0.00 0.00 175.30 175.81 3g4s n GLY 171 N 5.28 -1.44 1.39 -3.53 0.00 -1.26 -3.37 105.19 102.27 3g4s n GLY 171 Ca -0.06 0.67 0.05 0.00 0.00 0.00 0.00 46.02 46.67 3g4s n GLY 171 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3g4s n GLU 172 N 0.00 3.50 -2.03 1.61 1.02 -1.26 -4.71 120.64 118.77 3g4s n GLU 172 Ca 0.00 -2.10 -0.41 0.00 -0.02 0.00 0.00 57.16 54.63 3g4s n GLU 172 Cb 0.00 -1.96 -0.00 0.00 -0.02 0.00 0.00 31.44 29.46 3g4s n GLU 172 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3g4s n GLU 173 N 0.48 4.11 0.00 3.49 4.71 -1.26 -5.31 120.64 126.86 3g4s n GLU 173 Ca 0.19 -3.32 0.00 0.00 -0.01 0.00 0.00 57.16 54.01 3g4s n GLU 173 Cb 0.85 -2.77 0.00 0.00 -1.01 0.00 0.00 31.44 28.50 3g4s n GLU 173 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11