#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g34 s ASP 2 N 0.00 4.22 -0.29 3.17 2.15 -1.26 -5.07 116.67 119.60 2g34 s ASP 2 Ca 0.00 -1.17 -0.17 0.00 0.43 0.00 0.00 52.55 51.64 2g34 s ASP 2 Cb 0.00 -1.57 0.14 0.00 -0.30 0.00 0.00 42.92 41.19 2g34 s ASP 2 CO 0.00 -0.15 0.95 0.27 -0.17 0.00 0.00 175.17 176.07 2g34 s ILE 3 N 1.19 0.00 -0.25 4.11 -5.25 -1.26 -5.15 121.20 114.58 2g34 s ILE 3 Ca -0.05 0.00 -0.02 0.00 -0.99 0.00 0.00 60.65 59.59 2g34 s ILE 3 Cb -0.18 -1.00 0.02 0.00 2.95 0.00 0.00 42.46 44.25 2g34 s ILE 3 CO -0.06 0.00 -0.04 -0.62 -1.79 0.00 0.00 174.94 172.43 2g34 s ASP 4 N 1.22 4.44 0.31 4.36 -1.08 -1.26 -4.97 116.67 119.69 2g34 s ASP 4 Ca -0.07 -0.83 0.23 0.00 -0.52 0.00 0.00 52.55 51.35 2g34 s ASP 4 Cb -0.04 -1.70 1.14 0.00 -1.46 0.00 0.00 42.92 40.86 2g34 s ASP 4 CO -0.14 -0.13 1.69 -0.81 0.52 0.00 0.00 175.17 176.29 2g34 n PRO 5 N 4.70 0.16 0.01 4.34 -0.04 -1.26 -2.16 135.00 140.75 2g34 n PRO 5 Ca -0.16 0.58 -0.12 0.00 -0.04 0.00 0.00 63.50 63.75 2g34 n PRO 5 Cb 0.47 -1.95 -0.14 0.00 -0.04 0.00 0.00 33.50 31.85 2g34 n PRO 5 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2g34 h TYR 6 N 0.00 0.18 -0.78 0.54 -1.99 -1.93 -3.39 116.97 109.59 2g34 h TYR 6 Ca 0.00 -0.13 0.14 0.00 2.00 0.00 0.00 58.73 60.74 2g34 h TYR 6 Cb 0.11 -0.01 -0.09 0.00 2.00 0.00 0.00 36.73 38.74 2g34 h TYR 6 CO 0.00 1.22 0.35 -0.22 -0.00 0.00 0.00 178.16 179.51 2g34 h LYS 7 N 0.03 0.50 -0.44 4.88 3.64 -1.22 0.64 116.57 124.60 2g34 h LYS 7 Ca -0.27 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.07 2g34 h LYS 7 Cb 1.99 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.68 2g34 h LYS 7 CO 0.10 0.33 0.24 1.49 -2.27 0.00 0.00 179.45 179.34 2g34 h GLU 8 N 0.51 0.59 -0.94 1.90 4.81 -1.76 1.28 114.58 120.97 2g34 h GLU 8 Ca 0.43 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.56 2g34 h GLU 8 Cb 0.62 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 2g34 h GLU 8 CO -0.38 0.44 0.05 1.19 -0.73 0.00 0.00 179.01 179.58 2g34 n PHE 9 N -4.42 0.53 -3.53 0.92 3.01 0.11 -4.85 117.46 109.22 2g34 n PHE 9 Ca 0.03 -0.40 -0.20 0.00 1.01 0.00 0.00 57.45 57.89 2g34 n PHE 9 Cb 0.10 -0.27 0.02 0.00 -0.01 0.00 0.00 39.48 39.32 2g34 n PHE 9 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g34 n GLY 10 N 0.14 -1.16 3.58 1.37 0.00 0.44 -5.00 105.19 104.56 2g34 n GLY 10 Ca 0.09 0.51 -0.12 0.00 0.00 0.00 0.00 46.02 46.49 2g34 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g34 s ALA 11 N -3.19 0.22 -0.00 4.61 0.00 -0.54 -4.93 121.76 117.93 2g34 s ALA 11 Ca 0.20 -1.21 -0.01 0.00 0.00 0.00 0.00 51.96 50.94 2g34 s ALA 11 Cb -0.07 1.03 0.00 0.00 0.00 0.00 0.00 23.12 24.08 2g34 s ALA 11 CO 0.84 -0.85 0.02 -0.08 0.00 0.00 0.00 175.76 175.68 2g34 s THR 12 N -3.08 0.01 0.15 0.00 -1.32 -1.26 -2.69 115.64 107.44 2g34 s THR 12 Ca 0.25 -0.05 -0.15 0.00 -1.21 0.00 0.00 61.69 60.53 2g34 s THR 12 Cb -0.02 -0.05 0.02 0.00 -1.51 0.00 0.00 72.50 70.95 2g34 s THR 12 CO 0.16 -0.03 1.76 1.62 -2.21 0.00 0.00 174.62 175.92 2g34 h VAL 13 N 5.09 1.16 -0.47 5.08 3.04 -1.98 -3.00 116.25 125.17 2g34 h VAL 13 Ca -0.25 -0.40 0.10 0.00 -1.01 0.00 0.00 66.70 65.14 2g34 h VAL 13 Cb 1.21 0.62 -0.09 0.00 -2.01 0.00 0.00 31.29 31.01 2g34 h VAL 13 CO 0.49 0.16 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.73 2g34 h GLU 14 N 0.58 -0.05 -1.33 4.17 5.08 -1.97 0.74 114.58 121.81 2g34 h GLU 14 Ca 0.16 0.00 0.42 0.00 -1.00 0.00 0.00 59.36 58.94 2g34 h GLU 14 Cb 0.05 0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.19 2g34 h GLU 14 CO -0.03 -0.03 0.87 1.25 -1.00 0.00 0.00 179.01 180.07 2g34 h LEU 15 N -0.05 0.24 0.19 1.33 6.46 -1.90 0.78 115.31 122.35 2g34 h LEU 15 Ca 0.23 0.12 -0.35 0.00 -0.12 0.00 0.00 57.88 57.75 2g34 h LEU 15 Cb 0.39 0.10 0.01 0.00 -0.73 0.00 0.00 40.66 40.43 2g34 h LEU 15 CO -0.51 -0.14 -1.74 -0.07 -0.62 0.00 0.00 178.44 175.37 2g34 h LEU 16 N 0.11 0.61 -2.39 2.25 3.38 0.17 -3.27 115.31 116.17 2g34 h LEU 16 Ca 0.79 -0.94 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2g34 h LEU 16 Cb 2.53 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 43.08 2g34 h LEU 16 CO -0.36 1.79 0.09 -1.28 0.09 0.00 0.00 178.44 178.76 2g34 h SER 17 N 0.09 0.00 -2.34 -0.43 0.87 0.47 -2.51 113.55 109.70 2g34 h SER 17 Ca -0.34 0.00 -0.77 0.00 -1.23 0.00 0.00 61.79 59.45 2g34 h SER 17 Cb 2.09 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 63.74 2g34 h SER 17 CO 0.17 0.00 0.67 0.49 -0.53 0.00 0.00 176.83 177.63 2g34 n PHE 18 N -3.76 2.95 -2.66 2.24 3.72 0.12 -4.09 117.46 115.98 2g34 n PHE 18 Ca -0.01 -2.86 -0.04 0.00 -0.05 0.00 0.00 57.45 54.49 2g34 n PHE 18 Cb 0.19 -1.06 0.06 0.00 -0.94 0.00 0.00 39.48 37.73 2g34 n PHE 18 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2g34 n LEU 19 N 0.11 -1.21 -2.29 4.37 7.94 -0.94 -4.89 117.00 120.08 2g34 n LEU 19 Ca 0.41 -1.33 -0.25 0.00 -1.11 0.00 0.00 56.01 53.73 2g34 n LEU 19 Cb 0.30 0.53 -0.01 0.00 0.53 0.00 0.00 43.42 44.76 2g34 n LEU 19 CO 0.51 1.38 -0.04 -2.65 -1.11 0.00 0.00 177.39 175.48 2g34 n PRO 20 N 1.90 0.00 -0.32 1.96 -0.02 -1.26 -4.79 135.00 132.48 2g34 n PRO 20 Ca 0.05 0.00 0.17 0.00 -2.02 0.00 0.00 63.50 61.70 2g34 n PRO 20 Cb 0.69 -0.52 0.34 0.00 -0.02 0.00 0.00 33.50 33.99 2g34 n PRO 20 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2g34 h SER 21 N 0.47 -0.14 -1.02 2.55 4.64 -1.90 -1.55 113.55 116.61 2g34 h SER 21 Ca -0.15 0.24 0.35 0.00 -0.47 0.00 0.00 61.79 61.76 2g34 h SER 21 Cb 0.75 0.36 -0.10 0.00 -0.31 0.00 0.00 62.40 63.10 2g34 h SER 21 CO 0.29 -0.29 0.66 -0.90 -0.87 0.00 0.00 176.83 175.72 2g34 n ASP 22 N -5.34 0.14 0.00 4.97 5.75 -1.26 -1.79 116.55 119.02 2g34 n ASP 22 Ca 0.25 0.99 0.00 0.00 -0.01 0.00 0.00 54.79 56.02 2g34 n ASP 22 Cb 0.82 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 2g34 n ASP 22 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2g34 n PHE 23 N -4.10 0.00 -1.32 2.11 -0.00 -0.58 -4.67 117.46 108.91 2g34 n PHE 23 Ca 0.29 0.00 -0.55 0.00 -0.00 0.00 0.00 57.45 57.19 2g34 n PHE 23 Cb 1.15 -0.09 -0.12 0.00 -0.00 0.00 0.00 39.48 40.42 2g34 n PHE 23 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 2g34 n PHE 24 N -0.89 1.08 -0.93 -5.13 3.01 -0.74 -4.88 117.46 108.99 2g34 n PHE 24 Ca 0.00 0.65 -0.37 0.00 1.01 0.00 0.00 57.45 58.74 2g34 n PHE 24 Cb 0.00 -2.33 0.06 0.00 -0.01 0.00 0.00 39.48 37.20 2g34 n PHE 24 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 2g34 n PRO 25 N 7.76 -0.35 -1.95 -1.08 -0.02 -1.26 -4.84 135.00 133.26 2g34 n PRO 25 Ca 0.56 -0.10 -0.41 0.00 -2.02 0.00 0.00 63.50 61.53 2g34 n PRO 25 Cb 0.00 -1.16 -0.02 0.00 -0.02 0.00 0.00 33.50 32.30 2g34 n PRO 25 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2g34 s SER 26 N -1.20 6.57 0.12 2.55 0.15 -1.26 -4.84 113.70 115.79 2g34 s SER 26 Ca 0.41 2.79 -0.22 0.00 0.70 0.00 0.00 55.95 59.63 2g34 s SER 26 Cb 0.03 -2.64 -0.05 0.00 -1.71 0.00 0.00 66.02 61.65 2g34 s SER 26 CO 0.67 -0.74 1.15 1.33 1.20 0.00 0.00 173.24 176.86 2g34 n VAL 27 N 1.65 -0.49 0.00 4.45 0.24 -1.26 -1.89 118.33 121.03 2g34 n VAL 27 Ca 0.05 1.80 0.00 0.00 -2.04 0.00 0.00 64.34 64.15 2g34 n VAL 27 Cb 0.40 -2.24 0.00 0.00 -1.47 0.00 0.00 33.84 30.53 2g34 n VAL 27 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2g34 n ARG 28 N -4.83 0.00 -0.33 7.34 5.12 -1.26 0.20 116.66 122.90 2g34 n ARG 28 Ca 0.01 0.80 -0.08 0.00 -1.93 0.00 0.00 57.85 56.66 2g34 n ARG 28 Cb 0.19 -1.28 -0.07 0.00 -1.16 0.00 0.00 32.46 30.14 2g34 n ARG 28 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2g34 n ASP 29 N -2.35 -0.81 0.08 0.55 8.00 -0.79 0.59 116.55 121.83 2g34 n ASP 29 Ca 0.00 1.40 -0.16 0.00 0.71 0.00 0.00 54.79 56.74 2g34 n ASP 29 Cb 0.00 -0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 40.81 2g34 n ASP 29 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2g34 h LEU 30 N 0.00 -1.60 0.00 0.64 3.38 -0.40 -0.46 115.31 116.87 2g34 h LEU 30 Ca 0.14 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2g34 h LEU 30 Cb 0.34 0.60 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2g34 h LEU 30 CO -0.75 -0.53 0.00 -0.11 0.09 0.00 0.00 178.44 177.14 2g34 n LEU 31 N -5.39 0.00 -0.25 1.67 7.94 0.54 -0.64 117.00 120.86 2g34 n LEU 31 Ca -0.08 0.39 -0.01 0.00 -1.11 0.00 0.00 56.01 55.20 2g34 n LEU 31 Cb 0.40 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.37 2g34 n LEU 31 CO 0.14 0.00 0.38 0.47 -1.11 0.00 0.00 177.39 177.27 2g34 n ASP 32 N -0.65 -0.43 0.00 1.96 8.00 0.24 -0.41 116.55 125.25 2g34 n ASP 32 Ca 0.00 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.64 2g34 n ASP 32 Cb 0.00 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 40.84 2g34 n ASP 32 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2g34 n THR 33 N -4.96 0.00 -0.22 -3.53 -1.04 -0.18 -2.77 114.28 101.58 2g34 n THR 33 Ca 0.07 0.78 -0.06 0.00 -2.04 0.00 0.00 64.05 62.80 2g34 n THR 33 Cb 0.26 -1.48 -0.05 0.00 -1.82 0.00 0.00 70.33 67.24 2g34 n THR 33 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g34 n ALA 34 N -1.76 -0.33 -0.56 2.41 0.00 0.18 -3.08 120.51 117.36 2g34 n ALA 34 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2g34 n ALA 34 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2g34 n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g34 n ALA 35 N -3.27 0.00 0.11 0.00 0.00 0.45 -0.95 120.51 116.85 2g34 n ALA 35 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2g34 n ALA 35 Cb 0.14 0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2g34 n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g34 n ALA 36 N -1.48 1.83 -0.01 0.00 0.00 -1.11 -1.33 120.51 118.41 2g34 n ALA 36 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2g34 n ALA 36 Cb 0.00 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 2g34 n ALA 36 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2g34 n LEU 37 N 1.22 0.00 0.00 0.00 4.77 -0.13 -4.77 117.00 118.09 2g34 n LEU 37 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2g34 n LEU 37 Cb 0.11 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2g34 n LEU 37 CO 0.00 0.05 0.09 -1.22 -1.33 0.00 0.00 177.39 174.98 2g34 n TYR 38 N -1.95 0.00 -0.06 -1.77 4.01 -0.73 -4.95 117.16 111.71 2g34 n TYR 38 Ca -0.03 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.70 2g34 n TYR 38 Cb 0.43 0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.46 2g34 n TYR 38 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2g34 n ARG 39 N 0.00 -0.06 0.00 -0.72 0.63 -0.44 0.29 116.66 116.37 2g34 n ARG 39 Ca 0.00 0.24 0.00 0.00 -0.92 0.00 0.00 57.85 57.17 2g34 n ARG 39 Cb 0.35 -0.36 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2g34 n ARG 39 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2g34 n ASP 40 N -4.21 0.00 -0.30 6.15 8.00 -1.26 -1.19 116.55 123.73 2g34 n ASP 40 Ca 0.01 0.75 0.13 0.00 0.71 0.00 0.00 54.79 56.39 2g34 n ASP 40 Cb 0.05 -0.25 0.30 0.00 -0.02 0.00 0.00 41.12 41.20 2g34 n ASP 40 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g34 h ALA 41 N -1.64 1.41 -0.69 2.24 0.00 -0.57 0.40 119.26 120.42 2g34 h ALA 41 Ca 0.00 0.17 0.15 0.00 0.00 0.00 0.00 54.91 55.22 2g34 h ALA 41 Cb 0.00 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 17.85 2g34 h ALA 41 CO 0.00 -0.35 0.11 -0.07 0.00 0.00 0.00 179.25 178.94 2g34 h LEU 42 N 0.38 -0.09 -4.81 0.00 3.38 0.20 0.13 115.31 114.50 2g34 h LEU 42 Ca 0.56 0.15 -0.70 0.00 0.09 0.00 0.00 57.88 57.98 2g34 h LEU 42 Cb 1.06 0.22 -0.25 0.00 0.09 0.00 0.00 40.66 41.78 2g34 h LEU 42 CO -0.54 -0.06 0.90 -0.62 0.09 0.00 0.00 178.44 178.21 2g34 n GLU 43 N -5.20 2.65 -4.38 1.13 1.02 0.13 -4.96 120.64 111.03 2g34 n GLU 43 Ca 0.12 -3.21 -0.29 0.00 -0.02 0.00 0.00 57.16 53.75 2g34 n GLU 43 Cb 0.41 -2.23 -0.12 0.00 -0.02 0.00 0.00 31.44 29.48 2g34 n GLU 43 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2g34 s SER 44 N -0.79 3.70 0.00 1.62 0.15 0.03 -4.98 113.70 113.43 2g34 s SER 44 Ca 0.54 -0.60 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2g34 s SER 44 Cb 0.43 -0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.29 2g34 s SER 44 CO -0.34 0.19 0.30 -2.65 1.20 0.00 0.00 173.24 171.94 2g34 n PRO 45 N 0.93 0.51 -3.65 5.44 -0.02 -1.26 -4.55 135.00 132.40 2g34 n PRO 45 Ca -0.16 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.04 2g34 n PRO 45 Cb 0.53 -1.21 -0.16 0.00 -0.02 0.00 0.00 33.50 32.63 2g34 n PRO 45 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2g34 s GLU 46 N -1.18 0.34 0.00 -0.52 0.41 -1.26 -5.02 118.70 111.47 2g34 s GLU 46 Ca 0.00 -0.36 -0.02 0.00 -0.41 0.00 0.00 54.97 54.18 2g34 s GLU 46 Cb 0.00 -1.82 -0.07 0.00 -1.78 0.00 0.00 34.13 30.46 2g34 s GLU 46 CO 0.00 -0.75 2.28 -2.39 -0.49 0.00 0.00 175.26 173.91 2g34 n HIS 47 N 5.16 0.00 0.00 1.61 1.44 -1.26 -4.76 115.22 117.40 2g34 n HIS 47 Ca -0.07 -1.05 0.00 0.00 -2.01 0.00 0.00 57.72 54.59 2g34 n HIS 47 Cb 0.47 -0.78 0.00 0.00 0.12 0.00 0.00 29.99 29.80 2g34 n HIS 47 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2g34 n ALA 48 N 1.83 0.00 -2.34 1.59 0.00 -1.26 -4.07 120.51 116.26 2g34 n ALA 48 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 2g34 n ALA 48 Cb 0.57 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.87 2g34 n ALA 48 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2g34 s SER 49 N -4.92 3.16 0.19 0.00 1.04 -1.26 -5.03 113.70 106.89 2g34 s SER 49 Ca 0.00 -0.55 -0.15 0.00 0.48 0.00 0.00 55.95 55.72 2g34 s SER 49 Cb 0.00 -0.31 0.18 0.00 0.10 0.00 0.00 66.02 65.99 2g34 s SER 49 CO 0.00 0.28 1.64 -0.65 0.98 0.00 0.00 173.24 175.48 2g34 h PRO 50 N 4.97 -0.02 -0.49 4.02 0.11 -2.01 -0.86 132.00 137.72 2g34 h PRO 50 Ca -0.46 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.72 2g34 h PRO 50 Cb 1.14 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.18 2g34 h PRO 50 CO 0.45 -0.01 -0.22 0.72 -0.21 0.00 0.00 178.00 178.72 2g34 n HIS 51 N -5.40 -0.06 0.00 0.65 8.25 -1.26 0.41 115.22 117.82 2g34 n HIS 51 Ca 0.05 0.60 0.00 0.00 -0.26 0.00 0.00 57.72 58.12 2g34 n HIS 51 Cb 0.30 -0.64 0.00 0.00 1.12 0.00 0.00 29.99 30.77 2g34 n HIS 51 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2g34 n HIS 52 N -4.68 0.00 -0.21 4.41 8.25 -0.33 0.39 115.22 123.05 2g34 n HIS 52 Ca 0.04 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.44 2g34 n HIS 52 Cb 0.17 -0.21 -0.05 0.00 1.12 0.00 0.00 29.99 31.02 2g34 n HIS 52 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2g34 n THR 53 N -1.55 -0.33 0.00 1.59 -1.04 0.17 -1.18 114.28 111.94 2g34 n THR 53 Ca 0.00 1.52 0.00 0.00 -2.04 0.00 0.00 64.05 63.53 2g34 n THR 53 Cb 0.00 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 66.59 2g34 n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g34 n ALA 54 N -3.23 -0.05 0.00 2.41 0.00 0.42 -3.15 120.51 116.91 2g34 n ALA 54 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2g34 n ALA 54 Cb 0.13 0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.82 2g34 n ALA 54 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2g34 n LEU 55 N -1.51 0.00 -0.32 0.00 7.94 0.16 0.18 117.00 123.44 2g34 n LEU 55 Ca 0.00 0.00 0.15 0.00 -1.11 0.00 0.00 56.01 55.05 2g34 n LEU 55 Cb 0.00 0.00 0.30 0.00 0.53 0.00 0.00 43.42 44.25 2g34 n LEU 55 CO 0.00 0.00 0.85 0.08 -1.11 0.00 0.00 177.39 177.21 2g34 h ARG 56 N 0.00 0.05 -0.24 1.96 -0.00 -1.49 0.11 114.38 114.77 2g34 h ARG 56 Ca 0.00 -0.00 0.03 0.00 -0.00 0.00 0.00 59.98 60.01 2g34 h ARG 56 Cb 0.00 -0.01 -0.06 0.00 -0.00 0.00 0.00 29.97 29.90 2g34 h ARG 56 CO 0.00 0.03 -0.40 1.96 -0.00 0.00 0.00 179.97 181.56 2g34 h GLN 57 N 0.05 -0.32 -0.85 0.08 1.08 0.17 2.35 115.11 117.68 2g34 h GLN 57 Ca 0.59 0.02 0.17 0.00 -1.45 0.00 0.00 58.65 57.98 2g34 h GLN 57 Cb 1.23 0.07 -0.10 0.00 -0.05 0.00 0.00 27.48 28.63 2g34 h GLN 57 CO -0.84 -0.21 0.39 0.00 -0.95 0.00 0.00 178.83 177.22 2g34 h ALA 58 N -0.46 1.28 -1.77 3.87 0.00 -0.95 0.31 119.26 121.55 2g34 h ALA 58 Ca 0.04 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2g34 h ALA 58 Cb 0.45 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2g34 h ALA 58 CO -0.40 -0.20 0.00 -0.89 0.00 0.00 0.00 179.25 177.76 2g34 n ILE 59 N -4.96 0.00 0.00 0.00 5.41 0.24 -0.46 119.36 119.60 2g34 n ILE 59 Ca 0.18 1.20 0.00 0.00 1.00 0.00 0.00 62.75 65.14 2g34 n ILE 59 Cb 0.50 -2.12 0.00 0.00 -0.71 0.00 0.00 39.64 37.31 2g34 n ILE 59 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2g34 n LEU 60 N -1.23 0.00 -0.06 1.39 0.00 0.73 0.43 117.00 118.25 2g34 n LEU 60 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 56.01 56.48 2g34 n LEU 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 2g34 n LEU 60 CO 0.00 0.00 0.09 0.00 0.00 0.00 0.00 177.39 177.48 2g34 n ALA 61 N -1.02 -0.04 0.07 1.96 0.00 0.11 0.25 120.51 121.84 2g34 n ALA 61 Ca 0.00 0.15 -0.04 0.00 0.00 0.00 0.00 53.44 53.55 2g34 n ALA 61 Cb 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.37 2g34 n ALA 61 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 2g34 h TRP 62 N 0.00 -0.24 -0.53 0.00 7.01 0.12 0.22 115.95 122.53 2g34 h TRP 62 Ca 0.05 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.11 2g34 h TRP 62 Cb 0.09 0.08 -0.09 0.00 -2.10 0.00 0.00 29.16 27.13 2g34 h TRP 62 CO -0.14 -0.15 -0.53 0.78 -2.79 0.00 0.00 178.44 175.61 2g34 h GLY 63 N -0.95 -0.84 1.41 2.65 0.00 1.47 1.59 103.07 108.40 2g34 h GLY 63 Ca -0.03 0.69 0.04 0.00 0.00 0.00 0.00 47.33 48.03 2g34 h GLY 63 CO 0.04 -0.11 0.31 -1.80 0.00 0.00 0.00 176.54 174.98 2g34 h ASP 64 N -0.30 0.41 0.66 0.19 3.58 0.33 0.21 116.42 121.49 2g34 h ASP 64 Ca 0.11 -0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.53 2g34 h ASP 64 Cb 0.57 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 41.53 2g34 h ASP 64 CO -0.66 0.28 -0.31 0.25 -2.88 0.00 0.00 179.24 175.91 2g34 h LEU 65 N 0.47 -0.75 -0.77 2.28 5.85 0.50 -2.03 115.31 120.87 2g34 h LEU 65 Ca 0.19 0.03 0.08 0.00 0.84 0.00 0.00 57.88 59.02 2g34 h LEU 65 Cb 0.17 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.32 2g34 h LEU 65 CO -0.05 -0.50 0.44 -0.03 -0.34 0.00 0.00 178.44 177.96 2g34 h MET 66 N -0.96 0.73 -0.67 1.25 4.05 0.19 1.00 114.93 120.53 2g34 h MET 66 Ca -0.09 -0.04 0.20 0.00 -0.28 0.00 0.00 59.70 59.48 2g34 h MET 66 Cb 0.67 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 31.28 2g34 h MET 66 CO 0.15 0.49 0.70 1.15 0.23 0.00 0.00 176.91 179.63 2g34 h THR 67 N 0.76 0.27 0.02 -0.77 2.02 -0.46 0.38 112.91 115.12 2g34 h THR 67 Ca 0.36 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 67.22 2g34 h THR 67 Cb 0.30 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 2g34 h THR 67 CO -0.23 0.00 -1.77 -0.11 0.37 0.00 0.00 175.52 173.78 2g34 n LEU 68 N -3.63 2.08 -0.32 2.58 7.94 0.22 -3.88 117.00 121.99 2g34 n LEU 68 Ca 0.14 0.33 0.13 0.00 -1.11 0.00 0.00 56.01 55.50 2g34 n LEU 68 Cb 0.94 -0.95 0.27 0.00 0.53 0.00 0.00 43.42 44.21 2g34 n LEU 68 CO 0.28 0.48 0.84 0.00 -1.11 0.00 0.00 177.39 177.88 2g34 h ALA 69 N -0.50 1.13 -0.58 1.96 0.00 0.46 0.81 119.26 122.54 2g34 h ALA 69 Ca -0.46 0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2g34 h ALA 69 Cb 1.53 0.51 -0.02 0.00 0.00 0.00 0.00 17.79 19.81 2g34 h ALA 69 CO -0.21 -0.53 0.17 1.79 0.00 0.00 0.00 179.25 180.47 2g34 h THR 70 N 0.06 1.24 -0.77 0.00 1.35 -0.96 -2.75 112.91 111.09 2g34 h THR 70 Ca 0.56 -0.84 0.18 0.00 -0.55 0.00 0.00 66.41 65.76 2g34 h THR 70 Cb 1.13 0.68 -0.13 0.00 -1.73 0.00 0.00 68.15 68.09 2g34 h THR 70 CO -0.82 0.31 0.00 -0.25 -0.25 0.00 0.00 175.52 174.51 2g34 h TRP 71 N 0.83 -0.06 -0.71 4.73 7.01 0.53 0.45 115.95 128.73 2g34 h TRP 71 Ca 0.19 0.06 0.24 0.00 2.11 0.00 0.00 58.89 61.49 2g34 h TRP 71 Cb 0.30 0.15 -0.13 0.00 -2.10 0.00 0.00 29.16 27.38 2g34 h TRP 71 CO 0.02 -0.25 0.18 0.28 -2.79 0.00 0.00 178.44 175.88 2g34 n VAL 72 N -5.36 -0.30 -0.94 2.65 0.31 -0.90 0.19 118.33 113.99 2g34 n VAL 72 Ca 0.14 1.51 -0.15 0.00 -0.01 0.00 0.00 64.34 65.83 2g34 n VAL 72 Cb 0.48 -2.31 -0.01 0.00 -0.91 0.00 0.00 33.84 31.09 2g34 n VAL 72 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2g34 n GLY 73 N -1.28 3.70 2.01 2.92 0.00 0.16 -3.48 105.19 109.21 2g34 n GLY 73 Ca 0.21 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2g34 n GLY 73 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2g34 n THR 74 N 0.93 0.00 1.44 2.61 -1.04 0.52 -4.89 114.28 113.84 2g34 n THR 74 Ca 0.29 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.32 2g34 n THR 74 Cb 0.59 -0.03 0.07 0.00 -1.82 0.00 0.00 70.33 69.14 2g34 n THR 74 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2g34 n ASN 75 N -2.58 0.92 -4.17 8.00 4.13 -1.19 -4.77 115.26 115.59 2g34 n ASN 75 Ca 0.00 -2.02 -0.26 0.00 1.68 0.00 0.00 54.58 53.98 2g34 n ASN 75 Cb 0.00 -0.14 -0.16 0.00 -1.54 0.00 0.00 39.78 37.94 2g34 n ASN 75 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2g34 s LEU 76 N -0.96 1.97 -0.61 3.41 2.96 -1.23 -5.09 118.68 119.14 2g34 s LEU 76 Ca 0.10 -0.36 0.04 0.00 -0.22 0.00 0.00 54.13 53.70 2g34 s LEU 76 Cb 0.06 -1.01 0.16 0.00 0.50 0.00 0.00 46.19 45.90 2g34 s LEU 76 CO 0.07 0.19 0.42 -1.61 -1.32 0.00 0.00 176.35 174.09 2g34 s GLU 77 N -0.15 2.00 -0.39 1.98 2.02 -1.26 -4.79 118.70 118.10 2g34 s GLU 77 Ca 0.00 -2.91 -0.01 0.00 0.02 0.00 0.00 54.97 52.08 2g34 s GLU 77 Cb -0.10 -2.91 0.24 0.00 0.10 0.00 0.00 34.13 31.45 2g34 s GLU 77 CO 0.01 -1.28 1.05 -3.47 0.02 0.00 0.00 175.26 171.59 2g34 n ASP 78 N 2.39 -2.00 -0.19 -0.19 2.03 -1.26 -5.03 116.55 112.29 2g34 n ASP 78 Ca 0.19 -2.02 0.30 0.00 0.52 0.00 0.00 54.79 53.78 2g34 n ASP 78 Cb 0.37 1.11 0.61 0.00 -0.72 0.00 0.00 41.12 42.49 2g34 n ASP 78 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2g34 h PRO 79 N 3.91 0.00 0.43 -0.67 0.11 -1.96 0.28 132.00 134.10 2g34 h PRO 79 Ca -0.10 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.98 2g34 h PRO 79 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2g34 h PRO 79 CO -0.03 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 177.55 2g34 h ALA 80 N 0.98 -0.58 0.00 -0.75 0.00 -1.98 -2.06 119.26 114.88 2g34 h ALA 80 Ca 0.46 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 55.03 2g34 h ALA 80 Cb 2.39 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 20.37 2g34 h ALA 80 CO -0.00 -0.82 -1.44 0.77 0.00 0.00 0.00 179.25 177.76 2g34 h SER 81 N -0.59 0.00 0.10 0.00 0.02 -1.72 -3.30 113.55 108.07 2g34 h SER 81 Ca -0.06 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2g34 h SER 81 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 2g34 h SER 81 CO 0.10 0.75 -0.05 -0.09 -1.14 0.00 0.00 176.83 176.40 2g34 h ARG 82 N 0.00 -0.13 0.00 3.45 2.43 -1.02 -2.62 114.38 116.49 2g34 h ARG 82 Ca -0.19 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 2g34 h ARG 82 Cb 1.74 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.32 2g34 h ARG 82 CO 0.06 0.18 0.00 -0.25 -1.51 0.00 0.00 179.97 178.45 2g34 n ASP 83 N -5.01 0.00 -0.05 -3.80 9.92 -0.77 -3.41 116.55 113.43 2g34 n ASP 83 Ca -0.08 -0.83 -0.22 0.00 -0.53 0.00 0.00 54.79 53.13 2g34 n ASP 83 Cb 0.20 -0.02 -0.13 0.00 -0.64 0.00 0.00 41.12 40.53 2g34 n ASP 83 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 2g34 n LEU 84 N -1.02 2.33 -0.23 0.64 7.94 -1.10 -4.34 117.00 121.22 2g34 n LEU 84 Ca 0.20 0.28 0.01 0.00 -1.11 0.00 0.00 56.01 55.39 2g34 n LEU 84 Cb 0.10 -1.03 0.12 0.00 0.53 0.00 0.00 43.42 43.14 2g34 n LEU 84 CO 0.16 0.63 1.03 -0.37 -1.11 0.00 0.00 177.39 177.73 2g34 h VAL 85 N -0.40 0.82 -1.19 1.96 -1.51 -1.49 -1.44 116.25 113.00 2g34 h VAL 85 Ca -0.42 -0.18 0.36 0.00 -1.23 0.00 0.00 66.70 65.22 2g34 h VAL 85 Cb 1.73 0.25 -0.11 0.00 -2.13 0.00 0.00 31.29 31.03 2g34 h VAL 85 CO -0.07 0.10 0.77 0.58 -1.23 0.00 0.00 177.57 177.72 2g34 h VAL 86 N 0.52 0.31 0.00 7.19 2.07 -1.76 -2.29 116.25 122.30 2g34 h VAL 86 Ca 0.33 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.77 2g34 h VAL 86 Cb 0.36 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2g34 h VAL 86 CO -0.28 0.04 0.00 -0.24 0.02 0.00 0.00 177.57 177.11 2g34 n SER 87 N -4.64 0.00 -0.48 0.57 2.88 -0.54 -1.29 113.62 110.12 2g34 n SER 87 Ca 0.31 0.54 0.40 0.00 -1.33 0.00 0.00 58.87 58.80 2g34 n SER 87 Cb 1.18 -0.04 0.68 0.00 -0.75 0.00 0.00 64.21 65.27 2g34 n SER 87 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2g34 h TYR 88 N 0.00 0.47 0.00 0.66 3.20 -1.60 -2.43 116.97 117.26 2g34 h TYR 88 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2g34 h TYR 88 Cb 0.00 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.16 2g34 h TYR 88 CO -0.00 -0.22 0.00 0.28 -1.64 0.00 0.00 178.16 176.57 2g34 n VAL 89 N -4.65 0.00 0.00 1.81 0.31 -0.89 -0.95 118.33 113.96 2g34 n VAL 89 Ca 0.39 0.57 0.00 0.00 -0.01 0.00 0.00 64.34 65.29 2g34 n VAL 89 Cb 1.54 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 2g34 n VAL 89 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2g34 n ASN 90 N -0.33 0.00 0.00 4.52 4.13 -0.41 -1.57 115.26 121.60 2g34 n ASN 90 Ca 0.00 0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.28 2g34 n ASN 90 Cb 0.00 -0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.22 2g34 n ASN 90 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 2g34 n THR 91 N -0.79 0.00 0.00 3.41 -1.04 -0.93 -4.54 114.28 110.39 2g34 n THR 91 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2g34 n THR 91 Cb 0.02 -0.31 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 2g34 n THR 91 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2g34 n ASN 92 N -0.69 0.00 -0.10 8.00 3.02 -0.13 -2.51 115.26 122.86 2g34 n ASN 92 Ca 0.00 0.25 -0.16 0.00 -0.03 0.00 0.00 54.58 54.64 2g34 n ASN 92 Cb 0.00 -0.25 -0.05 0.00 -0.61 0.00 0.00 39.78 38.87 2g34 n ASN 92 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2g34 n VAL 93 N -1.22 1.46 -0.45 2.41 0.31 -0.61 -4.38 118.33 115.85 2g34 n VAL 93 Ca 0.00 -0.04 0.37 0.00 -0.01 0.00 0.00 64.34 64.66 2g34 n VAL 93 Cb 0.04 -2.12 0.66 0.00 -0.91 0.00 0.00 33.84 31.50 2g34 n VAL 93 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2g34 h GLY 94 N -0.93 1.10 0.00 2.92 0.00 -1.47 -2.99 103.07 101.70 2g34 h GLY 94 Ca -0.25 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2g34 h GLY 94 CO -0.15 -0.31 0.00 -0.10 0.00 0.00 0.00 176.54 175.98 2g34 n LEU 95 N -4.59 0.00 -0.25 3.11 7.94 -1.10 0.36 117.00 122.48 2g34 n LEU 95 Ca 0.36 0.00 0.32 0.00 -1.11 0.00 0.00 56.01 55.58 2g34 n LEU 95 Cb 1.41 0.00 0.62 0.00 0.53 0.00 0.00 43.42 45.98 2g34 n LEU 95 CO 0.25 0.00 1.29 0.11 -1.11 0.00 0.00 177.39 177.93 2g34 h LYS 96 N 0.00 0.00 0.00 1.96 1.57 -1.79 0.38 116.57 118.70 2g34 h LYS 96 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2g34 h LYS 96 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2g34 h LYS 96 CO 0.00 0.00 -0.92 1.19 -0.57 0.00 0.00 179.45 179.15 2g34 n PHE 97 N -3.59 0.28 0.00 -1.35 3.01 -0.27 -3.88 117.46 111.66 2g34 n PHE 97 Ca 0.24 0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.78 2g34 n PHE 97 Cb 1.39 -0.44 0.00 0.00 -0.01 0.00 0.00 39.48 40.42 2g34 n PHE 97 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 2g34 n ARG 98 N -1.93 0.00 -0.31 -1.08 1.85 1.15 -2.02 116.66 114.32 2g34 n ARG 98 Ca 0.02 0.28 0.02 0.00 -1.00 0.00 0.00 57.85 57.18 2g34 n ARG 98 Cb 0.42 -0.76 0.09 0.00 -1.05 0.00 0.00 32.46 31.17 2g34 n ARG 98 CO 0.00 0.00 0.00 -0.56 -0.01 0.00 0.00 177.63 177.06 2g34 h GLN 99 N 0.00 -0.02 0.24 2.89 -0.00 -1.77 0.78 115.11 117.24 2g34 h GLN 99 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 58.65 58.66 2g34 h GLN 99 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.45 2g34 h GLN 99 CO 0.00 -0.01 -0.38 1.25 -0.00 0.00 0.00 178.83 179.69 2g34 h LEU 100 N -0.02 -1.07 0.00 0.06 6.46 -1.76 2.04 115.31 121.02 2g34 h LEU 100 Ca 0.39 0.11 0.00 0.00 -0.12 0.00 0.00 57.88 58.25 2g34 h LEU 100 Cb 0.62 0.39 0.00 0.00 -0.73 0.00 0.00 40.66 40.93 2g34 h LEU 100 CO -0.88 -0.49 0.00 -0.11 -0.62 0.00 0.00 178.44 176.34 2g34 n LEU 101 N -5.46 0.00 -0.12 2.25 7.94 0.23 -0.49 117.00 121.35 2g34 n LEU 101 Ca -0.08 0.80 -0.04 0.00 -1.11 0.00 0.00 56.01 55.57 2g34 n LEU 101 Cb 0.37 -0.30 -0.04 0.00 0.53 0.00 0.00 43.42 43.98 2g34 n LEU 101 CO 0.24 -0.30 0.49 -0.25 -1.11 0.00 0.00 177.39 176.47 2g34 h TRP 102 N 0.00 -0.69 -0.17 1.96 7.01 -0.09 -1.37 115.95 122.60 2g34 h TRP 102 Ca 0.00 0.04 0.02 0.00 2.11 0.00 0.00 58.89 61.06 2g34 h TRP 102 Cb 0.00 0.34 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 2g34 h TRP 102 CO -0.50 -0.15 -0.10 0.34 -2.79 0.00 0.00 178.44 175.23 2g34 n PHE 103 N -3.80 -0.08 0.12 2.65 7.35 0.69 0.14 117.46 124.53 2g34 n PHE 103 Ca 0.00 0.22 -0.16 0.00 -0.76 0.00 0.00 57.45 56.75 2g34 n PHE 103 Cb 0.11 -0.38 -0.09 0.00 0.35 0.00 0.00 39.48 39.47 2g34 n PHE 103 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2g34 h HIS 104 N 0.00 -1.41 -0.71 -5.13 3.86 0.33 -2.38 115.15 109.71 2g34 h HIS 104 Ca 0.03 0.04 0.08 0.00 -1.16 0.00 0.00 60.37 59.35 2g34 h HIS 104 Cb 0.07 0.60 -0.11 0.00 1.06 0.00 0.00 27.41 29.03 2g34 h HIS 104 CO -0.28 -0.58 -0.53 0.82 0.86 0.00 0.00 177.93 178.23 2g34 h ILE 105 N -0.73 0.02 -0.58 2.45 2.04 0.16 0.15 117.51 121.03 2g34 h ILE 105 Ca 0.00 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.10 2g34 h ILE 105 Cb 0.74 0.02 -0.10 0.00 -0.74 0.00 0.00 36.82 36.74 2g34 h ILE 105 CO -0.27 0.00 0.31 -1.20 0.00 0.00 0.00 178.15 176.99 2g34 n SER 106 N -5.34 0.20 0.00 1.72 7.64 0.42 -0.94 113.62 117.32 2g34 n SER 106 Ca 0.01 0.96 0.00 0.00 1.01 0.00 0.00 58.87 60.84 2g34 n SER 106 Cb 0.32 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 2g34 n SER 106 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2g34 n ALA 107 N -2.58 -0.17 -0.35 -0.43 0.00 0.53 0.88 120.51 118.39 2g34 n ALA 107 Ca 0.22 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.94 2g34 n ALA 107 Cb 0.74 0.04 0.53 0.00 0.00 0.00 0.00 19.45 20.76 2g34 n ALA 107 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2g34 h LEU 108 N 0.00 0.43 0.03 0.00 8.10 -1.14 0.97 115.31 123.70 2g34 h LEU 108 Ca 0.00 0.20 -0.00 0.00 0.11 0.00 0.00 57.88 58.18 2g34 h LEU 108 Cb 0.00 0.16 0.00 0.00 -0.44 0.00 0.00 40.66 40.38 2g34 h LEU 108 CO 0.00 -0.21 -0.02 0.71 -4.11 0.00 0.00 178.44 174.82 2g34 h THR 109 N 0.21 1.08 0.00 0.15 1.35 -1.00 -3.43 112.91 111.27 2g34 h THR 109 Ca 0.77 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 66.28 2g34 h THR 109 Cb 1.94 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 69.67 2g34 h THR 109 CO -0.61 0.09 0.00 0.49 -0.25 0.00 0.00 175.52 175.24 2g34 n PHE 110 N -5.04 0.00 0.00 4.73 3.72 0.26 -5.07 117.46 116.06 2g34 n PHE 110 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 2g34 n PHE 110 Cb 0.11 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 2g34 n PHE 110 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2g34 n GLY 111 N 3.64 1.82 0.00 1.37 0.00 0.26 -4.94 105.19 107.34 2g34 n GLY 111 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2g34 n GLY 111 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2g34 n ARG 112 N -0.41 0.00 -0.08 1.61 0.63 -1.26 -1.65 116.66 115.50 2g34 n ARG 112 Ca 0.00 0.02 -0.02 0.00 -0.92 0.00 0.00 57.85 56.92 2g34 n ARG 112 Cb 0.00 -0.54 -0.02 0.00 0.45 0.00 0.00 32.46 32.35 2g34 n ARG 112 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2g34 n GLU 113 N -0.06 -0.08 -0.18 -0.14 -0.58 -1.26 -0.00 120.64 118.34 2g34 n GLU 113 Ca 0.00 0.89 0.03 0.00 -0.42 0.00 0.00 57.16 57.66 2g34 n GLU 113 Cb 0.00 -1.33 0.07 0.00 -0.57 0.00 0.00 31.44 29.62 2g34 n GLU 113 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2g34 n THR 114 N -3.32 -0.21 -0.13 2.62 -2.24 -1.25 0.14 114.28 109.90 2g34 n THR 114 Ca 0.00 1.13 -0.10 0.00 -2.27 0.00 0.00 64.05 62.82 2g34 n THR 114 Cb 0.05 -1.57 -0.07 0.00 -2.10 0.00 0.00 70.33 66.64 2g34 n THR 114 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2g34 h VAL 115 N 0.00 0.00 0.00 2.28 2.07 0.52 -2.81 116.25 118.31 2g34 h VAL 115 Ca 0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.76 2g34 h VAL 115 Cb 0.37 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 2g34 h VAL 115 CO -0.51 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.26 2g34 n LEU 116 N -4.64 0.00 0.00 2.57 4.77 0.12 0.02 117.00 119.84 2g34 n LEU 116 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2g34 n LEU 116 Cb 0.24 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2g34 n LEU 116 CO -0.01 0.00 0.46 1.21 -1.33 0.00 0.00 177.39 177.71 2g34 n GLU 117 N -3.02 0.00 -0.49 3.23 2.13 -1.06 0.47 120.64 121.91 2g34 n GLU 117 Ca 0.00 0.91 0.41 0.00 0.66 0.00 0.00 57.16 59.15 2g34 n GLU 117 Cb 0.00 -1.40 0.64 0.00 0.27 0.00 0.00 31.44 30.94 2g34 n GLU 117 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 2g34 n TYR 118 N -2.73 0.00 0.00 4.31 9.36 0.10 0.30 117.16 128.50 2g34 n TYR 118 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2g34 n TYR 118 Cb 0.00 -0.38 0.00 0.00 -0.63 0.00 0.00 39.34 38.33 2g34 n TYR 118 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2g34 n LEU 119 N -3.57 1.62 -0.30 2.98 4.77 0.18 -3.00 117.00 119.68 2g34 n LEU 119 Ca 0.35 0.11 -0.09 0.00 -0.03 0.00 0.00 56.01 56.34 2g34 n LEU 119 Cb 1.77 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.81 2g34 n LEU 119 CO 0.35 0.00 0.53 0.58 -1.33 0.00 0.00 177.39 177.52 2g34 h VAL 120 N 0.00 0.03 -0.20 4.08 2.07 -0.60 -0.54 116.25 121.08 2g34 h VAL 120 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2g34 h VAL 120 Cb 0.00 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.77 2g34 h VAL 120 CO 0.00 0.00 -0.12 -1.54 0.02 0.00 0.00 177.57 175.93 2g34 n SER 121 N -5.36 -0.21 -0.25 0.57 3.41 0.15 0.16 113.62 112.09 2g34 n SER 121 Ca 0.03 1.01 0.05 0.00 -0.26 0.00 0.00 58.87 59.69 2g34 n SER 121 Cb 0.33 -0.37 0.15 0.00 -0.26 0.00 0.00 64.21 64.06 2g34 n SER 121 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2g34 h PHE 122 N 0.00 0.01 -0.99 7.33 3.57 -1.22 0.74 116.94 126.38 2g34 h PHE 122 Ca 0.03 0.05 0.37 0.00 3.53 0.00 0.00 57.97 61.95 2g34 h PHE 122 Cb 0.08 0.11 -0.18 0.00 2.79 0.00 0.00 35.95 38.76 2g34 h PHE 122 CO -0.82 -0.20 0.40 0.78 -2.23 0.00 0.00 178.31 176.25 2g34 h GLY 123 N 0.13 1.97 0.63 2.40 0.00 0.32 1.19 103.07 109.71 2g34 h GLY 123 Ca 0.40 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.63 2g34 h GLY 123 CO -0.61 -0.69 -0.20 -2.08 0.00 0.00 0.00 176.54 172.95 2g34 h VAL 124 N 0.04 0.45 -0.10 4.60 2.07 0.19 -2.86 116.25 120.64 2g34 h VAL 124 Ca 0.77 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.74 2g34 h VAL 124 Cb 1.90 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 2g34 h VAL 124 CO -0.79 0.08 -0.06 -0.25 0.02 0.00 0.00 177.57 176.57 2g34 h TRP 125 N -0.94 -0.20 0.00 1.57 7.01 0.19 0.63 115.95 124.21 2g34 h TRP 125 Ca -0.06 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.96 2g34 h TRP 125 Cb 0.56 0.10 0.00 0.00 -2.10 0.00 0.00 29.16 27.72 2g34 h TRP 125 CO 0.02 -0.04 0.00 1.51 -2.79 0.00 0.00 178.44 177.14 2g34 n ILE 126 N -3.21 0.00 -0.13 2.65 0.13 0.86 -1.76 119.36 117.90 2g34 n ILE 126 Ca 0.00 0.56 0.10 0.00 -1.10 0.00 0.00 62.75 62.31 2g34 n ILE 126 Cb 0.03 -1.14 0.18 0.00 -0.84 0.00 0.00 39.64 37.87 2g34 n ILE 126 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 2g34 n ARG 127 N -0.11 -0.03 -1.74 9.51 1.74 -1.08 -4.16 116.66 120.80 2g34 n ARG 127 Ca 0.00 0.58 -0.42 0.00 -0.77 0.00 0.00 57.85 57.23 2g34 n ARG 127 Cb 0.00 -0.98 -0.03 0.00 -1.02 0.00 0.00 32.46 30.43 2g34 n ARG 127 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2g34 s THR 128 N -4.87 2.91 0.40 0.55 2.01 0.21 -4.91 115.64 111.93 2g34 s THR 128 Ca -0.04 0.13 -0.19 0.00 0.31 0.00 0.00 61.69 61.90 2g34 s THR 128 Cb 0.13 -3.09 -0.14 0.00 0.01 0.00 0.00 72.50 69.41 2g34 s THR 128 CO 0.31 -0.01 0.03 -2.65 -0.69 0.00 0.00 174.62 171.61 2g34 n PRO 129 N 6.71 0.00 -0.13 4.92 -0.02 -1.26 -4.62 135.00 140.60 2g34 n PRO 129 Ca 0.19 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.60 2g34 n PRO 129 Cb 0.40 -0.93 -0.00 0.00 -0.02 0.00 0.00 33.50 32.95 2g34 n PRO 129 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2g34 h PRO 130 N 0.21 -0.21 -0.00 0.52 0.11 -1.90 -2.61 132.00 128.12 2g34 h PRO 130 Ca -0.35 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.76 2g34 h PRO 130 Cb 1.35 0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.50 2g34 h PRO 130 CO 0.42 -0.14 -0.06 0.00 -0.21 0.00 0.00 178.00 178.01 2g34 h ALA 131 N 0.88 1.89 0.00 -0.75 0.00 -2.03 -3.37 119.26 115.89 2g34 h ALA 131 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2g34 h ALA 131 Cb 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2g34 h ALA 131 CO -0.55 0.08 -0.30 0.66 0.00 0.00 0.00 179.25 179.14 2g34 n TYR 132 N -4.46 0.11 -1.38 0.00 0.53 -1.17 -4.90 117.16 105.89 2g34 n TYR 132 Ca -0.03 0.05 -0.50 0.00 -1.02 0.00 0.00 57.90 56.40 2g34 n TYR 132 Cb 0.14 -0.27 -0.13 0.00 -1.03 0.00 0.00 39.34 38.06 2g34 n TYR 132 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 2g34 n ARG 133 N -3.17 0.08 -1.68 -0.72 1.85 -0.99 -4.81 116.66 107.22 2g34 n ARG 133 Ca -0.04 0.02 -0.44 0.00 -1.00 0.00 0.00 57.85 56.38 2g34 n ARG 133 Cb 0.16 -1.60 -0.04 0.00 -1.05 0.00 0.00 32.46 29.93 2g34 n ARG 133 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2g34 n PRO 134 N 8.03 2.50 0.29 2.89 -0.02 -1.26 -4.81 135.00 142.62 2g34 n PRO 134 Ca 0.59 0.91 0.04 0.00 -2.02 0.00 0.00 63.50 63.02 2g34 n PRO 134 Cb 0.02 -2.76 0.23 0.00 -0.02 0.00 0.00 33.50 30.97 2g34 n PRO 134 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2g34 h PRO 135 N 7.85 0.00 -5.61 0.52 0.11 -1.92 -3.31 132.00 129.63 2g34 h PRO 135 Ca -0.46 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.26 2g34 h PRO 135 Cb 1.24 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.30 2g34 h PRO 135 CO 0.93 0.00 1.18 1.21 -0.21 0.00 0.00 178.00 181.12 2g34 s ASN 136 N -3.29 5.39 0.93 -2.05 2.47 -1.26 -4.93 114.94 112.20 2g34 s ASN 136 Ca -0.01 -1.56 -0.12 0.00 0.42 0.00 0.00 52.86 51.59 2g34 s ASN 136 Cb 0.02 -2.58 0.15 0.00 -1.45 0.00 0.00 41.25 37.39 2g34 s ASN 136 CO 0.08 -2.66 1.12 0.00 -3.72 0.00 0.00 177.10 171.92 2g34 s ALA 137 N 9.54 1.55 0.48 1.71 0.00 -1.25 -5.02 121.76 128.78 2g34 s ALA 137 Ca 0.65 -0.48 -0.23 0.00 0.00 0.00 0.00 51.96 51.91 2g34 s ALA 137 Cb -0.01 -3.06 -0.07 0.00 0.00 0.00 0.00 23.12 19.98 2g34 s ALA 137 CO 0.08 -2.43 1.23 -2.14 0.00 0.00 0.00 175.76 172.50 2g34 s PRO 138 N -5.19 3.59 -0.00 0.00 0.02 -1.26 -5.05 135.00 127.11 2g34 s PRO 138 Ca 0.64 1.93 -0.02 0.00 0.02 0.00 0.00 61.00 63.57 2g34 s PRO 138 Cb -0.16 -2.39 -0.00 0.00 0.02 0.00 0.00 34.50 31.97 2g34 s PRO 138 CO 0.54 -0.73 0.05 0.42 -0.33 0.00 0.00 177.00 176.95 2g34 s ILE 139 N -1.46 0.05 -0.29 2.83 1.01 -1.26 -5.06 121.20 117.03 2g34 s ILE 139 Ca 0.65 -0.42 -0.37 0.00 0.00 0.00 0.00 60.65 60.51 2g34 s ILE 139 Cb -0.33 -0.21 -0.13 0.00 0.01 0.00 0.00 42.46 41.80 2g34 s ILE 139 CO 0.39 -0.23 1.98 0.18 0.00 0.00 0.00 174.94 177.26 2g34 n LEU 140 N 2.28 2.37 0.00 2.97 4.77 -1.26 -4.89 117.00 123.25 2g34 n LEU 140 Ca -0.18 0.75 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 2g34 n LEU 140 Cb 0.57 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 2g34 n LEU 140 CO 0.22 -0.52 0.00 -1.54 -1.33 0.00 0.00 177.39 174.23 2g34 n SER 141 N 7.66 0.00 -1.00 -1.43 3.41 -1.26 -5.16 113.62 115.84 2g34 n SER 141 Ca 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 2g34 n SER 141 Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 2g34 n SER 141 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2g34 n THR 142 N 0.00 0.00 -0.09 6.66 -1.04 -1.26 -5.10 114.28 113.45 2g34 n THR 142 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 2g34 n THR 142 Cb 0.00 -0.51 -0.04 0.00 -1.82 0.00 0.00 70.33 67.96 2g34 n THR 142 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2g34 n LEU 143 N 0.00 1.89 0.00 -4.42 4.77 -1.26 -5.11 117.00 112.87 2g34 n LEU 143 Ca 0.00 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 2g34 n LEU 143 Cb 0.00 -0.81 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 2g34 n LEU 143 CO 0.00 -0.21 0.17 -2.65 -1.33 0.00 0.00 177.39 173.38