#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c34 s SER -1 N 0.00 -0.01 -0.21 1.61 0.01 -1.26 -5.14 113.70 108.70 2c34 s SER -1 Ca 0.00 0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.29 2c34 s SER -1 Cb 0.00 0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.29 2c34 s SER -1 CO 0.00 -0.01 -0.15 -1.00 0.41 0.00 0.00 173.24 172.49 2c34 s HIS 0 N -0.03 2.94 0.05 2.43 3.76 -1.26 -5.06 115.29 118.13 2c34 s HIS 0 Ca -0.00 -1.72 0.00 0.00 -0.15 0.00 0.00 55.06 53.18 2c34 s HIS 0 Cb -0.00 -1.96 0.00 0.00 1.11 0.00 0.00 32.58 31.73 2c34 s HIS 0 CO 0.00 -0.79 0.00 -1.33 -0.85 0.00 0.00 174.74 171.77 2c34 n MET 1 N 4.60 -0.44 0.03 1.40 0.00 -1.26 -4.48 117.12 116.97 2c34 n MET 1 Ca -0.19 0.29 -0.22 0.00 0.00 0.00 0.00 57.70 57.58 2c34 n MET 1 Cb 0.48 -0.54 -0.14 0.00 0.00 0.00 0.00 33.22 33.02 2c34 n MET 1 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 2c34 h ILE 2 N -0.20 0.82 -5.28 2.02 5.03 -2.05 -3.50 117.51 114.34 2c34 h ILE 2 Ca 0.00 -2.41 -0.00 0.00 -0.12 0.00 0.00 64.86 62.33 2c34 h ILE 2 Cb 0.20 2.64 0.00 0.00 -3.03 0.00 0.00 36.82 36.63 2c34 h ILE 2 CO 0.00 0.84 -0.97 0.00 -0.68 0.00 0.00 178.15 177.34 2c34 n ALA 3 N -2.95 -3.31 -1.69 1.87 0.00 -1.26 -4.85 120.51 108.32 2c34 n ALA 3 Ca -0.28 0.49 -0.44 0.00 0.00 0.00 0.00 53.44 53.20 2c34 n ALA 3 Cb 1.03 -1.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.33 2c34 n ALA 3 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2c34 n PRO 4 N 0.71 2.52 0.07 0.00 -0.02 -1.26 -4.85 135.00 132.17 2c34 n PRO 4 Ca 0.01 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2c34 n PRO 4 Cb 0.08 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 30.80 2c34 n PRO 4 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2c34 n LEU 5 N 4.93 0.10 0.00 2.45 4.77 -1.26 -5.02 117.00 122.96 2c34 n LEU 5 Ca 0.18 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 2c34 n LEU 5 Cb 0.33 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2c34 n LEU 5 CO 0.66 -0.66 0.00 -1.20 -1.33 0.00 0.00 177.39 174.86 2c34 n SER 6 N -3.04 0.00 -4.75 -1.43 7.64 -1.26 -5.10 113.62 105.67 2c34 n SER 6 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 2c34 n SER 6 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 2c34 n SER 6 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2c34 s VAL 7 N 0.00 5.23 0.00 0.44 1.01 -1.26 -4.94 120.40 120.88 2c34 s VAL 7 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 61.98 62.70 2c34 s VAL 7 Cb 0.00 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2c34 s VAL 7 CO 0.00 0.41 0.00 0.29 0.00 0.00 0.00 175.10 175.80 2c34 n LYS 8 N 3.24 0.00 -4.01 2.72 4.76 -1.26 -4.95 118.16 118.67 2c34 n LYS 8 Ca -0.11 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.02 2c34 n LYS 8 Cb 0.52 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.56 2c34 n LYS 8 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2c34 s ASP 9 N 0.81 4.27 0.00 4.39 2.15 -1.26 -4.99 116.67 122.04 2c34 s ASP 9 Ca 0.00 -1.43 0.00 0.00 0.43 0.00 0.00 52.55 51.55 2c34 s ASP 9 Cb 0.00 -1.41 0.00 0.00 -0.30 0.00 0.00 42.92 41.21 2c34 s ASP 9 CO 0.00 -0.24 0.00 -0.46 -0.17 0.00 0.00 175.17 174.30 2c34 n ASN 10 N 4.51 0.00 -2.19 -0.34 6.94 -1.26 -5.04 115.26 117.87 2c34 n ASN 10 Ca -0.11 0.00 -0.27 0.00 -0.02 0.00 0.00 54.58 54.18 2c34 n ASN 10 Cb 0.43 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.78 2c34 n ASN 10 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2c34 n ASP 11 N -0.27 0.30 -4.38 0.53 5.68 -1.26 -4.65 116.55 112.51 2c34 n ASP 11 Ca 0.00 0.26 -0.45 0.00 -0.50 0.00 0.00 54.79 54.10 2c34 n ASP 11 Cb 0.00 -0.46 -0.05 0.00 -1.14 0.00 0.00 41.12 39.47 2c34 n ASP 11 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2c34 s LYS 12 N 3.55 3.05 -0.65 0.11 2.20 -0.87 -4.88 119.74 122.24 2c34 s LYS 12 Ca 0.63 -1.29 -0.25 0.00 -0.36 0.00 0.00 55.97 54.71 2c34 s LYS 12 Cb -0.72 -4.24 0.05 0.00 -1.51 0.00 0.00 37.83 31.41 2c34 s LYS 12 CO 0.30 -1.46 1.08 -1.58 -0.36 0.00 0.00 175.35 173.34 2c34 s TRP 13 N 2.55 2.57 0.00 4.03 0.52 -1.26 -0.13 118.94 127.22 2c34 s TRP 13 Ca 0.11 -0.15 0.00 0.00 0.02 0.00 0.00 56.10 56.08 2c34 s TRP 13 Cb -0.24 -4.37 0.00 0.00 -1.15 0.00 0.00 33.47 27.71 2c34 s TRP 13 CO 0.07 -1.71 0.00 1.33 0.02 0.00 0.00 176.95 176.66 2c34 n VAL 14 N 6.22 0.00 -4.19 4.03 0.24 -0.95 -4.99 118.33 118.69 2c34 n VAL 14 Ca 0.01 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.04 2c34 n VAL 14 Cb 0.47 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.82 2c34 n VAL 14 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2c34 n ASP 15 N -2.00 2.94 -1.73 -1.34 5.75 -1.26 0.36 116.55 119.26 2c34 n ASP 15 Ca 0.00 -2.94 0.00 0.00 -0.01 0.00 0.00 54.79 51.84 2c34 n ASP 15 Cb 0.00 0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2c34 n ASP 15 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2c34 n THR 16 N -1.55 0.00 -3.17 2.12 5.66 -1.26 -4.61 114.28 111.46 2c34 n THR 16 Ca -0.09 -0.06 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 2c34 n THR 16 Cb 0.61 0.16 0.00 0.00 -1.55 0.00 0.00 70.33 69.55 2c34 n THR 16 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2c34 n HIS 17 N -0.24 -0.23 -3.47 1.09 8.25 -1.26 -1.72 115.22 117.65 2c34 n HIS 17 Ca 0.01 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.09 2c34 n HIS 17 Cb 0.16 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.20 2c34 n HIS 17 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2c34 s VAL 18 N 0.53 5.08 -0.90 1.59 1.01 -1.26 -4.16 120.40 122.29 2c34 s VAL 18 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 61.98 62.82 2c34 s VAL 18 Cb 0.00 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2c34 s VAL 18 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 2c34 n GLY 19 N 2.23 0.81 3.58 4.51 0.00 -0.04 -4.82 105.19 111.45 2c34 n GLY 19 Ca -0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 2c34 n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2c34 s LYS 20 N -2.53 1.73 -0.82 1.61 2.47 -1.26 -4.63 119.74 116.32 2c34 s LYS 20 Ca 0.00 -0.53 -0.27 0.00 -1.56 0.00 0.00 55.97 53.61 2c34 s LYS 20 Cb 0.00 -5.04 -0.18 0.00 -1.46 0.00 0.00 37.83 31.15 2c34 s LYS 20 CO 0.00 -4.75 2.53 2.41 0.16 0.00 0.00 175.35 175.69 2c34 n THR 21 N 8.54 -0.03 -2.99 3.43 -1.04 -1.26 -4.57 114.28 116.36 2c34 n THR 21 Ca 0.43 -0.35 -0.44 0.00 -2.04 0.00 0.00 64.05 61.65 2c34 n THR 21 Cb 0.46 -1.29 -0.04 0.00 -1.82 0.00 0.00 70.33 67.64 2c34 n THR 21 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2c34 s THR 22 N 9.46 4.59 -0.01 12.58 2.01 -0.95 -4.85 115.64 138.47 2c34 s THR 22 Ca 1.20 -0.72 -0.28 0.00 0.31 0.00 0.00 61.69 62.20 2c34 s THR 22 Cb -0.78 -4.59 -0.03 0.00 0.01 0.00 0.00 72.50 67.11 2c34 s THR 22 CO 0.40 -1.29 0.91 -0.70 -0.69 0.00 0.00 174.62 173.25 2c34 s GLU 23 N 3.31 4.54 -0.25 4.92 2.12 -1.25 -2.42 118.70 129.66 2c34 s GLU 23 Ca 0.17 1.29 -0.02 0.00 0.36 0.00 0.00 54.97 56.76 2c34 s GLU 23 Cb -0.21 -3.45 0.08 0.00 0.26 0.00 0.00 34.13 30.81 2c34 s GLU 23 CO 0.08 -0.01 0.07 0.42 -0.54 0.00 0.00 175.26 175.28 2c34 s ILE 24 N 0.90 0.58 -0.78 -3.70 1.01 -0.56 -4.96 121.20 113.69 2c34 s ILE 24 Ca 0.48 -0.91 -0.23 0.00 0.00 0.00 0.00 60.65 60.00 2c34 s ILE 24 Cb -0.20 -1.27 0.07 0.00 0.01 0.00 0.00 42.46 41.07 2c34 s ILE 24 CO 0.26 -0.46 1.12 -1.00 0.00 0.00 0.00 174.94 174.86 2c34 s HIS 25 N 1.80 2.68 0.12 3.97 3.76 -1.26 -2.37 115.29 123.99 2c34 s HIS 25 Ca 0.04 -0.68 -0.12 0.00 -0.15 0.00 0.00 55.06 54.15 2c34 s HIS 25 Cb -0.17 -4.40 -0.06 0.00 1.11 0.00 0.00 32.58 29.05 2c34 s HIS 25 CO -0.19 -1.73 0.49 -0.51 -0.85 0.00 0.00 174.74 171.96 2c34 s LEU 26 N 4.18 4.34 0.30 0.89 1.43 -0.98 -4.87 118.68 123.96 2c34 s LEU 26 Ca 0.30 0.97 0.06 0.00 -1.03 0.00 0.00 54.13 54.42 2c34 s LEU 26 Cb -0.11 -3.18 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 2c34 s LEU 26 CO 0.04 0.12 0.40 -0.54 0.23 0.00 0.00 176.35 176.60 2c34 s LYS 27 N -1.97 3.18 0.00 1.70 1.02 -1.26 -1.22 119.74 121.19 2c34 s LYS 27 Ca 0.36 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.40 2c34 s LYS 27 Cb -0.14 -2.80 0.00 0.00 -0.52 0.00 0.00 37.83 34.37 2c34 s LYS 27 CO 0.19 0.21 0.00 0.41 -0.92 0.00 0.00 175.35 175.24 2c34 n GLY 28 N -1.51 -1.00 2.95 -3.33 0.00 -1.26 -4.93 105.19 96.11 2c34 n GLY 28 Ca -0.04 -0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.01 2c34 n GLY 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2c34 s ASN 29 N -4.00 -0.43 0.39 1.61 2.47 -1.26 -4.73 114.94 108.99 2c34 s ASN 29 Ca 0.00 -0.10 0.18 0.00 0.42 0.00 0.00 52.86 53.37 2c34 s ASN 29 Cb 0.00 0.86 0.99 0.00 -1.45 0.00 0.00 41.25 41.65 2c34 s ASN 29 CO 0.00 -0.06 1.49 -0.65 -3.72 0.00 0.00 177.10 174.16 2c34 h PRO 30 N 6.30 0.00 -0.45 0.43 0.11 -1.86 0.17 132.00 136.70 2c34 h PRO 30 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2c34 h PRO 30 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2c34 h PRO 30 CO -0.07 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.97 2c34 n THR 31 N -2.25 0.51 -0.09 -1.15 -2.24 -1.26 -4.09 114.28 103.70 2c34 n THR 31 Ca -0.01 -0.36 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 2c34 n THR 31 Cb 0.27 -0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.43 2c34 n THR 31 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2c34 n THR 32 N 0.20 1.47 0.00 4.28 -2.24 0.05 -5.05 114.28 112.99 2c34 n THR 32 Ca 0.08 0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 2c34 n THR 32 Cb 0.32 -2.31 0.00 0.00 -2.10 0.00 0.00 70.33 66.24 2c34 n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c34 n GLY 33 N 1.50 0.73 2.58 3.38 0.00 -1.26 -5.15 105.19 106.98 2c34 n GLY 33 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 2c34 n GLY 33 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2c34 n TYR 34 N 0.00 -2.72 -3.77 1.61 4.02 -1.26 -4.43 117.16 110.61 2c34 n TYR 34 Ca 0.00 -1.32 -0.12 0.00 -0.01 0.00 0.00 57.90 56.44 2c34 n TYR 34 Cb 0.00 -0.40 -0.08 0.00 -0.02 0.00 0.00 39.34 38.83 2c34 n TYR 34 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 176.86 177.26 2c34 s MET 35 N -3.89 0.70 -0.81 -0.72 -2.45 0.46 -4.75 119.30 107.84 2c34 s MET 35 Ca 0.41 -0.32 -0.07 0.00 -1.25 0.00 0.00 55.69 54.46 2c34 s MET 35 Cb -0.03 0.30 0.21 0.00 1.25 0.00 0.00 34.83 36.56 2c34 s MET 35 CO 0.27 -0.20 0.70 -1.58 1.05 0.00 0.00 175.02 175.26 2c34 s TRP 36 N -1.76 3.73 0.00 4.11 0.23 -1.26 -1.50 118.94 122.49 2c34 s TRP 36 Ca -0.11 -2.54 0.00 0.00 -2.03 0.00 0.00 56.10 51.43 2c34 s TRP 36 Cb -0.04 -3.50 0.00 0.00 0.03 0.00 0.00 33.47 29.97 2c34 s TRP 36 CO 0.01 -0.88 0.00 -2.37 0.96 0.00 0.00 176.95 174.67 2c34 n THR 37 N 3.31 0.00 -3.28 2.01 5.66 -1.06 -4.91 114.28 116.01 2c34 n THR 37 Ca 0.15 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.83 2c34 n THR 37 Cb 0.41 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.13 2c34 n THR 37 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2c34 s ARG 38 N -1.22 3.88 0.15 1.09 0.52 -1.26 -0.78 118.95 121.34 2c34 s ARG 38 Ca 0.00 0.44 -0.31 0.00 -0.52 0.00 0.00 55.73 55.35 2c34 s ARG 38 Cb 0.00 -2.54 -0.08 0.00 0.52 0.00 0.00 34.95 32.84 2c34 s ARG 38 CO 0.00 0.23 1.34 0.08 0.02 0.00 0.00 175.30 176.98 2c34 s VAL 39 N -1.91 3.30 0.00 3.52 1.01 0.76 -2.51 120.40 124.57 2c34 s VAL 39 Ca 0.50 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.47 2c34 s VAL 39 Cb -0.11 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.64 2c34 s VAL 39 CO 0.20 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.02 2c34 n GLY 40 N 2.99 0.69 0.00 4.51 0.00 -1.26 -4.80 105.19 107.32 2c34 n GLY 40 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2c34 n GLY 40 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c34 n PHE 41 N -2.58 0.00 -1.53 1.61 3.72 -1.04 -4.95 117.46 112.68 2c34 n PHE 41 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.99 2c34 n PHE 41 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 2c34 n PHE 41 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2c34 n VAL 42 N -0.03 0.04 0.00 -4.37 0.31 -1.13 -0.19 118.33 112.96 2c34 n VAL 42 Ca 0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 2c34 n VAL 42 Cb 0.12 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 30.87 2c34 n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c34 n GLY 43 N 6.16 1.96 3.49 2.92 0.00 -1.26 -4.90 105.19 113.55 2c34 n GLY 43 Ca 0.41 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 2c34 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c34 s LYS 44 N -0.06 -1.14 -0.04 1.61 1.02 0.73 -4.98 119.74 116.88 2c34 s LYS 44 Ca 0.00 0.54 -0.20 0.00 0.02 0.00 0.00 55.97 56.33 2c34 s LYS 44 Cb 0.00 -1.55 -0.14 0.00 -0.52 0.00 0.00 37.83 35.62 2c34 s LYS 44 CO 0.00 -3.80 0.87 0.22 -0.92 0.00 0.00 175.35 171.73 2c34 h ASP 45 N -2.66 -0.29 -4.24 2.83 3.58 -1.98 -3.45 116.42 110.20 2c34 h ASP 45 Ca -0.56 -0.23 -0.69 0.00 0.42 0.00 0.00 57.03 55.96 2c34 h ASP 45 Cb 1.34 0.07 -0.26 0.00 1.72 0.00 0.00 39.33 42.20 2c34 h ASP 45 CO 0.47 0.21 -0.84 -0.69 -2.88 0.00 0.00 179.24 175.51 2c34 s VAL 46 N -3.61 2.50 -0.15 2.25 1.01 -1.26 -5.03 120.40 116.10 2c34 s VAL 46 Ca -0.12 -1.11 -0.18 0.00 0.00 0.00 0.00 61.98 60.57 2c34 s VAL 46 Cb 0.01 -1.97 -0.24 0.00 0.00 0.00 0.00 36.38 34.18 2c34 s VAL 46 CO 0.43 0.47 0.41 -0.07 0.00 0.00 0.00 175.10 176.33 2c34 h LEU 47 N 5.04 0.19 0.00 3.92 3.38 -1.88 -3.47 115.31 122.49 2c34 h LEU 47 Ca -0.46 -0.74 -0.31 0.00 0.09 0.00 0.00 57.88 56.47 2c34 h LEU 47 Cb 1.14 -0.06 0.18 0.00 0.09 0.00 0.00 40.66 42.02 2c34 h LEU 47 CO 0.47 1.54 -0.15 -0.24 0.09 0.00 0.00 178.44 180.15 2c34 n SER 48 N -4.14 -3.89 0.00 -0.43 2.88 -1.24 -4.92 113.62 101.88 2c34 n SER 48 Ca -0.27 -0.75 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 2c34 n SER 48 Cb 0.79 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 63.32 2c34 n SER 48 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2c34 n ASP 49 N -4.54 0.00 0.00 -3.46 9.92 -1.25 -4.95 116.55 112.26 2c34 n ASP 49 Ca 0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.38 2c34 n ASP 49 Cb 0.51 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 2c34 n ASP 49 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 2c34 n GLU 50 N -0.13 0.47 0.00 -1.24 0.28 -1.26 -4.94 120.64 113.82 2c34 n GLU 50 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2c34 n GLU 50 Cb 0.00 -0.75 0.00 0.00 1.43 0.00 0.00 31.44 32.12 2c34 n GLU 50 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2c34 n ILE 51 N -1.81 0.00 -4.26 3.84 2.08 -1.26 -4.28 119.36 113.66 2c34 n ILE 51 Ca 0.00 0.98 -0.34 0.00 0.56 0.00 0.00 62.75 63.95 2c34 n ILE 51 Cb 0.25 -1.88 -0.13 0.00 -0.75 0.00 0.00 39.64 37.12 2c34 n ILE 51 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2c34 s LEU 52 N -1.78 2.99 -0.77 1.39 1.43 -1.26 -1.23 118.68 119.45 2c34 s LEU 52 Ca 0.00 -0.28 -0.23 0.00 -1.03 0.00 0.00 54.13 52.58 2c34 s LEU 52 Cb 0.00 -1.73 -0.17 0.00 0.03 0.00 0.00 46.19 44.31 2c34 s LEU 52 CO 0.00 0.08 1.89 -0.62 0.23 0.00 0.00 176.35 177.93 2c34 n GLU 53 N 4.10 1.29 -2.36 1.70 -0.58 0.84 -3.97 120.64 121.66 2c34 n GLU 53 Ca -0.18 -1.86 -0.36 0.00 -0.42 0.00 0.00 57.16 54.34 2c34 n GLU 53 Cb 0.52 -3.06 -0.03 0.00 -0.57 0.00 0.00 31.44 28.29 2c34 n GLU 53 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2c34 s VAL 54 N 6.86 3.79 -1.13 2.62 1.01 -1.25 -1.92 120.40 130.38 2c34 s VAL 54 Ca 0.62 -0.99 -0.18 0.00 0.00 0.00 0.00 61.98 61.43 2c34 s VAL 54 Cb 0.11 -4.76 0.11 0.00 0.00 0.00 0.00 36.38 31.83 2c34 s VAL 54 CO 0.15 -1.56 1.45 -0.69 0.00 0.00 0.00 175.10 174.46 2c34 s VAL 55 N 7.05 4.46 0.04 2.92 1.01 0.22 -3.61 120.40 132.49 2c34 s VAL 55 Ca 0.58 -1.78 -0.02 0.00 0.00 0.00 0.00 61.98 60.76 2c34 s VAL 55 Cb -0.01 -5.00 -0.04 0.00 0.00 0.00 0.00 36.38 31.34 2c34 s VAL 55 CO 0.01 -1.78 0.21 0.00 0.00 0.00 0.00 175.10 173.54 2c34 s LYS 57 N -2.25 0.26 -0.63 0.00 1.02 0.58 -4.98 119.74 113.75 2c34 s LYS 57 Ca 0.32 -0.14 -0.27 0.00 0.02 0.00 0.00 55.97 55.89 2c34 s LYS 57 Cb -0.13 -1.78 0.01 0.00 -0.52 0.00 0.00 37.83 35.41 2c34 s LYS 57 CO 0.23 -0.62 1.44 -0.47 -0.92 0.00 0.00 175.35 175.02 2c34 s TYR 58 N 2.05 2.18 -0.41 3.18 6.14 -1.26 -2.28 117.35 126.94 2c34 s TYR 58 Ca 0.01 0.36 -0.15 0.00 0.64 0.00 0.00 57.07 57.94 2c34 s TYR 58 Cb -0.16 -4.42 0.03 0.00 0.42 0.00 0.00 41.96 37.83 2c34 s TYR 58 CO -0.08 -2.06 0.30 0.99 0.64 0.00 0.00 175.55 175.34 2c34 s THR 59 N 6.45 5.17 -0.65 4.34 2.01 -0.98 -5.02 115.64 126.96 2c34 s THR 59 Ca 0.49 -0.73 -0.15 0.00 0.31 0.00 0.00 61.69 61.61 2c34 s THR 59 Cb -0.10 -3.91 0.16 0.00 0.01 0.00 0.00 72.50 68.67 2c34 s THR 59 CO 0.21 -0.33 0.59 -2.16 -0.69 0.00 0.00 174.62 172.24 2c34 s PRO 60 N 1.66 3.20 0.29 4.92 0.04 -1.26 -0.33 135.00 143.52 2c34 s PRO 60 Ca 0.05 -2.01 -0.29 0.00 0.04 0.00 0.00 61.00 58.79 2c34 s PRO 60 Cb -0.20 -4.33 -0.09 0.00 0.04 0.00 0.00 34.50 29.92 2c34 s PRO 60 CO 0.09 -1.31 1.05 0.99 0.04 0.00 0.00 177.00 177.87 2c34 s THR 61 N 1.02 3.67 1.26 1.26 2.01 -1.06 -4.80 115.64 119.00 2c34 s THR 61 Ca 0.09 1.61 -0.21 0.00 0.31 0.00 0.00 61.69 63.49 2c34 s THR 61 Cb -0.22 -3.99 0.32 0.00 0.01 0.00 0.00 72.50 68.62 2c34 s THR 61 CO -0.02 0.33 0.87 -2.65 -0.69 0.00 0.00 174.62 172.46 2c34 n PRO 62 N 1.04 -3.99 -3.89 4.92 -0.02 -1.26 -0.09 135.00 131.71 2c34 n PRO 62 Ca -0.00 -1.43 -0.09 0.00 -2.02 0.00 0.00 63.50 59.95 2c34 n PRO 62 Cb 0.46 -1.63 -0.06 0.00 -0.02 0.00 0.00 33.50 32.25 2c34 n PRO 62 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2c34 s SER 63 N -3.47 -0.07 0.57 2.55 0.15 -1.20 -4.35 113.70 107.88 2c34 s SER 63 Ca 0.62 -0.75 0.27 0.00 0.70 0.00 0.00 55.95 56.80 2c34 s SER 63 Cb -0.09 0.49 1.53 0.00 -1.71 0.00 0.00 66.02 66.25 2c34 s SER 63 CO 0.50 -0.97 2.04 0.77 1.20 0.00 0.00 173.24 176.79 2c34 h SER 64 N 2.41 0.00 -4.15 5.45 4.64 -1.98 -3.42 113.55 116.49 2c34 h SER 64 Ca -0.30 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.51 2c34 h SER 64 Cb 1.24 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 63.52 2c34 h SER 64 CO 0.44 0.00 0.21 0.42 -0.87 0.00 0.00 176.83 177.02 2c34 s THR 65 N -4.76 2.17 0.00 2.95 -4.23 -1.26 -5.03 115.64 105.48 2c34 s THR 65 Ca -0.05 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 2c34 s THR 65 Cb 0.17 -2.13 0.00 0.00 1.34 0.00 0.00 72.50 71.88 2c34 s THR 65 CO 0.60 -0.07 0.00 -0.81 -0.54 0.00 0.00 174.62 173.80 2c34 n PRO 66 N -4.26 1.99 0.21 3.99 -0.04 -1.26 -4.71 135.00 130.92 2c34 n PRO 66 Ca 0.10 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.66 2c34 n PRO 66 Cb 0.52 0.00 0.53 0.00 -0.04 0.00 0.00 33.50 34.51 2c34 n PRO 66 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2c34 h MET 67 N 0.00 0.00 -4.22 0.54 2.86 -1.96 -3.33 114.93 108.82 2c34 h MET 67 Ca 0.00 0.00 -0.74 0.00 -2.06 0.00 0.00 59.70 56.90 2c34 h MET 67 Cb 0.00 0.00 -0.27 0.00 0.06 0.00 0.00 31.60 31.39 2c34 h MET 67 CO 0.00 0.00 -0.33 0.08 1.06 0.00 0.00 176.91 177.72 2c34 s VAL 68 N -3.57 4.59 0.00 -2.22 1.01 -1.26 -4.90 120.40 114.06 2c34 s VAL 68 Ca -0.02 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.29 2c34 s VAL 68 Cb 0.06 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.45 2c34 s VAL 68 CO 0.18 -0.81 0.00 0.61 0.00 0.00 0.00 175.10 175.08 2c34 n GLY 69 N 5.04 2.92 2.79 4.51 0.00 -1.25 -4.78 105.19 114.42 2c34 n GLY 69 Ca -0.10 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 2c34 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c34 s VAL 70 N 0.00 -0.47 -0.13 1.61 0.11 -1.26 -3.26 120.40 116.99 2c34 s VAL 70 Ca 0.00 -1.07 -0.13 0.00 -2.93 0.00 0.00 61.98 57.85 2c34 s VAL 70 Cb 0.00 -0.51 -0.05 0.00 -1.53 0.00 0.00 36.38 34.30 2c34 s VAL 70 CO 0.00 -0.47 0.29 -0.83 -3.33 0.00 0.00 175.10 170.76 2c34 s GLY 71 N 1.18 2.24 0.00 6.54 0.00 0.87 -4.21 107.32 113.95 2c34 s GLY 71 Ca 0.22 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.49 2c34 s GLY 71 CO -0.06 0.28 0.00 0.61 0.00 0.00 0.00 173.10 173.93 2c34 n GLY 72 N 2.98 5.20 0.00 0.20 0.00 -1.26 -2.56 105.19 109.75 2c34 n GLY 72 Ca -0.13 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2c34 n GLY 72 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2c34 n ILE 73 N 0.00 0.00 -3.62 -0.61 -5.35 0.55 -4.04 119.36 106.30 2c34 n ILE 73 Ca 0.00 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.19 2c34 n ILE 73 Cb 0.00 0.00 -0.15 0.00 -1.74 0.00 0.00 39.64 37.75 2c34 n ILE 73 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2c34 s TYR 74 N -3.53 0.89 -0.61 4.28 1.51 -0.36 -2.31 117.35 117.23 2c34 s TYR 74 Ca 0.00 -1.23 -0.25 0.00 -1.01 0.00 0.00 57.07 54.59 2c34 s TYR 74 Cb 0.00 -1.23 0.05 0.00 -0.11 0.00 0.00 41.96 40.66 2c34 s TYR 74 CO 0.00 -0.85 1.02 0.08 -1.11 0.00 0.00 175.55 174.70 2c34 s VAL 75 N 1.90 4.23 -0.26 0.71 1.01 -0.97 -2.32 120.40 124.71 2c34 s VAL 75 Ca 0.09 0.19 -0.08 0.00 0.00 0.00 0.00 61.98 62.19 2c34 s VAL 75 Cb -0.17 -4.65 -0.02 0.00 0.00 0.00 0.00 36.38 31.54 2c34 s VAL 75 CO -0.32 -1.34 0.08 -0.69 0.00 0.00 0.00 175.10 172.83 2c34 s VAL 76 N 4.35 4.33 -0.47 2.92 1.01 -1.00 -0.30 120.40 131.24 2c34 s VAL 76 Ca 0.30 -0.22 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 2c34 s VAL 76 Cb -0.12 -3.06 0.12 0.00 0.00 0.00 0.00 36.38 33.32 2c34 s VAL 76 CO 0.17 0.30 0.31 -0.76 0.00 0.00 0.00 175.10 175.12 2c34 s LEU 77 N 1.61 5.53 -0.52 3.92 1.43 -0.71 -1.50 118.68 128.45 2c34 s LEU 77 Ca 0.06 -2.05 -0.18 0.00 -1.03 0.00 0.00 54.13 50.92 2c34 s LEU 77 Cb -0.15 -1.94 0.07 0.00 0.03 0.00 0.00 46.19 44.20 2c34 s LEU 77 CO 0.04 -0.61 0.59 -0.69 0.23 0.00 0.00 176.35 175.91 2c34 s VAL 78 N 1.14 4.95 -0.49 -1.59 1.01 -1.02 0.70 120.40 125.10 2c34 s VAL 78 Ca 0.08 -0.76 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 2c34 s VAL 78 Cb -0.24 -4.31 0.11 0.00 0.00 0.00 0.00 36.38 31.94 2c34 s VAL 78 CO -0.02 -0.83 0.40 -0.54 0.00 0.00 0.00 175.10 174.11 2c34 s LYS 79 N 2.40 2.79 -0.84 2.72 1.02 -0.81 -2.24 119.74 124.78 2c34 s LYS 79 Ca 0.12 -1.62 -0.27 0.00 0.02 0.00 0.00 55.97 54.21 2c34 s LYS 79 Cb -0.22 -4.09 -0.18 0.00 -0.52 0.00 0.00 37.83 32.82 2c34 s LYS 79 CO 0.09 -1.18 2.54 -2.30 -0.92 0.00 0.00 175.35 173.58 2c34 n PRO 80 N 5.10 0.34 0.05 -1.68 -0.02 -1.26 -0.12 135.00 137.40 2c34 n PRO 80 Ca -0.11 -0.06 -0.13 0.00 -2.02 0.00 0.00 63.50 61.18 2c34 n PRO 80 Cb 0.41 -2.15 -0.02 0.00 -0.02 0.00 0.00 33.50 31.73 2c34 n PRO 80 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c34 h ARG 81 N 14.17 0.48 -5.91 -0.52 3.08 -1.42 -0.08 114.38 124.19 2c34 h ARG 81 Ca -0.09 -0.44 -0.56 0.00 0.07 0.00 0.00 59.98 58.96 2c34 h ARG 81 Cb 1.26 0.11 -0.07 0.00 0.08 0.00 0.00 29.97 31.34 2c34 h ARG 81 CO 1.33 1.08 -0.44 0.15 -1.07 0.00 0.00 179.97 181.01 2c34 s LYS 82 N -3.49 2.28 -0.17 0.04 1.02 -0.79 -4.94 119.74 113.68 2c34 s LYS 82 Ca -0.07 -1.86 0.01 0.00 0.02 0.00 0.00 55.97 54.08 2c34 s LYS 82 Cb 0.09 -2.04 0.01 0.00 -0.52 0.00 0.00 37.83 35.38 2c34 s LYS 82 CO 0.86 -0.23 -0.19 1.03 -0.92 0.00 0.00 175.35 175.90 2c34 s ARG 83 N -4.01 3.04 0.00 1.68 0.52 -1.26 -4.92 118.95 114.00 2c34 s ARG 83 Ca 0.39 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.78 2c34 s ARG 83 Cb 0.02 -2.56 0.00 0.00 0.52 0.00 0.00 34.95 32.93 2c34 s ARG 83 CO 0.22 -0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.81 2c34 n GLY 84 N 4.43 0.72 3.55 -3.53 0.00 0.46 -4.97 105.19 105.86 2c34 n GLY 84 Ca -0.20 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 2c34 n GLY 84 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c34 s HIS 85 N -3.98 1.45 0.11 1.61 3.76 -1.26 -2.40 115.29 114.57 2c34 s HIS 85 Ca 0.00 1.11 0.04 0.00 -0.15 0.00 0.00 55.06 56.06 2c34 s HIS 85 Cb 0.00 -3.87 -0.04 0.00 1.11 0.00 0.00 32.58 29.78 2c34 s HIS 85 CO 0.00 -2.26 -0.10 -1.01 -0.85 0.00 0.00 174.74 170.52 2c34 s HIS 86 N 10.62 1.08 0.07 1.40 4.02 -0.91 -5.03 115.29 126.53 2c34 s HIS 86 Ca 0.79 -0.69 -0.25 0.00 1.02 0.00 0.00 55.06 55.93 2c34 s HIS 86 Cb -0.13 -0.59 0.06 0.00 -1.02 0.00 0.00 32.58 30.90 2c34 s HIS 86 CO 0.19 0.00 0.60 0.99 1.02 0.00 0.00 174.74 177.54 2c34 s THR 87 N -2.67 0.01 -0.65 1.30 2.01 -1.26 -0.35 115.64 114.03 2c34 s THR 87 Ca 0.08 -0.08 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 2c34 s THR 87 Cb -0.01 -1.00 0.17 0.00 0.01 0.00 0.00 72.50 71.67 2c34 s THR 87 CO -0.00 -0.04 0.55 -0.22 -0.69 0.00 0.00 174.62 174.22 2c34 s LEU 88 N -2.08 6.07 -0.76 4.42 2.96 -0.16 -4.88 118.68 124.25 2c34 s LEU 88 Ca -0.04 -2.40 -0.26 0.00 -0.22 0.00 0.00 54.13 51.21 2c34 s LEU 88 Cb -0.01 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 2c34 s LEU 88 CO -0.03 -0.60 1.69 -1.61 -1.32 0.00 0.00 176.35 174.48 2c34 s GLU 89 N 0.62 2.86 -0.10 1.98 2.02 -1.26 -1.54 118.70 123.28 2c34 s GLU 89 Ca 0.12 -0.01 0.00 0.00 0.02 0.00 0.00 54.97 55.11 2c34 s GLU 89 Cb -0.19 -4.61 -0.02 0.00 0.10 0.00 0.00 34.13 29.40 2c34 s GLU 89 CO -0.04 -2.68 -0.10 -0.51 0.02 0.00 0.00 175.26 171.95 2c34 s LEU 90 N 8.02 2.95 0.04 1.80 1.43 -0.68 -0.17 118.68 132.06 2c34 s LEU 90 Ca 0.58 -0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 53.47 2c34 s LEU 90 Cb -0.09 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 2c34 s LEU 90 CO 0.11 0.27 0.05 0.54 0.23 0.00 0.00 176.35 177.55 2c34 s VAL 91 N -0.27 0.14 -0.88 -1.59 0.11 0.04 -0.29 120.40 117.67 2c34 s VAL 91 Ca 0.03 -1.17 -0.14 0.00 -2.93 0.00 0.00 61.98 57.77 2c34 s VAL 91 Cb -0.13 -0.87 0.21 0.00 -1.53 0.00 0.00 36.38 34.06 2c34 s VAL 91 CO 0.03 -0.64 0.86 -0.47 -3.33 0.00 0.00 175.10 171.55 2c34 s TYR 92 N -2.59 3.72 0.44 1.54 5.04 -0.97 -2.57 117.35 121.97 2c34 s TYR 92 Ca -0.05 -1.98 0.06 0.00 -2.44 0.00 0.00 57.07 52.65 2c34 s TYR 92 Cb -0.01 -3.90 -0.05 0.00 0.35 0.00 0.00 41.96 38.35 2c34 s TYR 92 CO -0.05 -1.06 0.08 -0.08 -1.34 0.00 0.00 175.55 173.10 2c34 s THR 93 N 0.39 1.85 -0.70 4.34 -1.32 -0.56 -3.91 115.64 115.73 2c34 s THR 93 Ca 0.22 -1.89 -0.12 0.00 -1.21 0.00 0.00 61.69 58.69 2c34 s THR 93 Cb -0.09 -2.74 0.18 0.00 -1.51 0.00 0.00 72.50 68.34 2c34 s THR 93 CO -0.09 0.00 0.61 -0.13 -2.21 0.00 0.00 174.62 172.81 2c34 s ARG 94 N -3.84 3.19 0.44 7.08 0.52 -1.09 0.17 118.95 125.41 2c34 s ARG 94 Ca 0.29 -2.26 0.29 0.00 -0.52 0.00 0.00 55.73 53.53 2c34 s ARG 94 Cb 0.06 -4.23 1.38 0.00 0.52 0.00 0.00 34.95 32.67 2c34 s ARG 94 CO 0.16 -1.27 1.66 -1.35 0.02 0.00 0.00 175.30 174.52 2c34 h PRO 95 N 7.93 0.13 -0.24 3.54 0.11 -1.85 0.78 132.00 142.41 2c34 h PRO 95 Ca -0.02 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.88 2c34 h PRO 95 Cb 1.04 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2c34 h PRO 95 CO 0.81 0.09 -0.61 0.35 -0.21 0.00 0.00 178.00 178.42 2c34 h PHE 96 N 0.14 1.07 0.00 0.65 3.57 -1.92 -3.41 116.94 117.04 2c34 h PHE 96 Ca 0.77 -0.41 0.00 0.00 3.53 0.00 0.00 57.97 61.86 2c34 h PHE 96 Cb 2.39 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 40.94 2c34 h PHE 96 CO -0.00 1.23 0.00 -1.91 -2.23 0.00 0.00 178.31 175.40 2c34 n GLU 97 N -3.98 0.00 0.00 1.11 4.07 0.16 -5.14 120.64 116.85 2c34 n GLU 97 Ca -0.05 0.06 0.00 0.00 -0.06 0.00 0.00 57.16 57.11 2c34 n GLU 97 Cb 0.66 -0.44 0.00 0.00 -0.06 0.00 0.00 31.44 31.60 2c34 n GLU 97 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2c34 n GLY 98 N 1.84 -0.42 3.86 8.31 0.00 0.22 -5.00 105.19 114.00 2c34 n GLY 98 Ca 0.00 -1.24 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 2c34 n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c34 s ILE 99 N -2.00 4.92 0.15 -0.61 1.01 -1.26 -2.69 121.20 120.71 2c34 s ILE 99 Ca 0.00 0.59 0.02 0.00 0.00 0.00 0.00 60.65 61.26 2c34 s ILE 99 Cb 0.00 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 2c34 s ILE 99 CO 0.00 0.06 -0.04 -0.54 0.00 0.00 0.00 174.94 174.43 2c34 s LYS 100 N -2.45 1.02 0.13 2.79 1.02 -1.26 -5.03 119.74 115.95 2c34 s LYS 100 Ca 0.43 -1.46 -0.12 0.00 0.02 0.00 0.00 55.97 54.84 2c34 s LYS 100 Cb -0.13 -0.31 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 2c34 s LYS 100 CO 0.20 -0.06 1.48 -1.00 -0.92 0.00 0.00 175.35 175.05 2c34 h PRO 101 N 2.79 0.88 0.00 -1.68 0.13 -1.98 -2.95 132.00 129.18 2c34 h PRO 101 Ca -0.36 -0.43 -0.03 0.00 -0.87 0.00 0.00 66.00 64.31 2c34 h PRO 101 Cb 1.19 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2c34 h PRO 101 CO 0.64 1.08 -0.13 1.05 -0.23 0.00 0.00 178.00 180.40 2c34 h GLU 102 N 0.69 0.00 -6.73 0.86 4.11 -1.97 -3.44 114.58 108.10 2c34 h GLU 102 Ca 0.07 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.93 2c34 h GLU 102 Cb 0.88 0.00 0.16 0.00 0.50 0.00 0.00 28.75 30.29 2c34 h GLU 102 CO 0.08 0.13 -0.03 0.09 0.07 0.00 0.00 179.01 179.35 2c34 n ASN 103 N -3.76 0.22 -4.52 3.06 5.03 -1.12 -4.93 115.26 109.25 2c34 n ASN 103 Ca -0.02 0.79 -0.32 0.00 0.87 0.00 0.00 54.58 55.90 2c34 n ASN 103 Cb 0.24 -1.32 0.15 0.00 -1.02 0.00 0.00 39.78 37.83 2c34 n ASN 103 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 2c34 n GLU 104 N -0.69 -0.58 -4.28 3.52 2.13 -1.25 -4.81 120.64 114.67 2c34 n GLU 104 Ca 0.13 -0.12 -0.15 0.00 0.66 0.00 0.00 57.16 57.68 2c34 n GLU 104 Cb 0.47 -2.09 -0.10 0.00 0.27 0.00 0.00 31.44 29.99 2c34 n GLU 104 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2c34 s ARG 105 N -4.10 1.19 -0.37 5.31 6.06 -1.26 -2.30 118.95 123.48 2c34 s ARG 105 Ca 0.62 -1.57 -0.01 0.00 -2.50 0.00 0.00 55.73 52.27 2c34 s ARG 105 Cb -0.22 -0.52 0.26 0.00 0.06 0.00 0.00 34.95 34.54 2c34 s ARG 105 CO 0.63 -0.05 1.14 0.98 -2.50 0.00 0.00 175.30 175.50 2c34 n TYR 106 N -0.30 -1.23 -3.14 5.12 9.36 0.60 -4.61 117.16 122.95 2c34 n TYR 106 Ca -0.07 -0.94 -0.46 0.00 3.32 0.00 0.00 57.90 59.76 2c34 n TYR 106 Cb 0.63 1.20 -0.02 0.00 -0.63 0.00 0.00 39.34 40.52 2c34 n TYR 106 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2c34 s THR 107 N 0.33 5.19 -0.90 2.97 2.01 -1.25 -1.69 115.64 122.30 2c34 s THR 107 Ca 0.27 -2.03 -0.25 0.00 0.31 0.00 0.00 61.69 60.00 2c34 s THR 107 Cb 0.20 -4.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.06 2c34 s THR 107 CO -0.12 -1.25 1.89 -0.22 -0.69 0.00 0.00 174.62 174.23 2c34 s LEU 108 N 1.37 3.21 0.43 4.42 2.96 -0.59 -2.06 118.68 128.42 2c34 s LEU 108 Ca 0.24 -0.70 -0.24 0.00 -0.22 0.00 0.00 54.13 53.22 2c34 s LEU 108 Cb -0.08 -2.56 -0.08 0.00 0.50 0.00 0.00 46.19 43.97 2c34 s LEU 108 CO -0.09 -2.60 1.12 -1.00 -1.32 0.00 0.00 176.35 172.47 2c34 s HIS 109 N 9.49 3.06 -0.16 5.38 3.76 0.82 -0.99 115.29 136.64 2c34 s HIS 109 Ca 0.67 1.58 -0.04 0.00 -0.15 0.00 0.00 55.06 57.12 2c34 s HIS 109 Cb -0.06 -3.28 0.08 0.00 1.11 0.00 0.00 32.58 30.42 2c34 s HIS 109 CO -0.00 -1.13 0.25 -0.51 -0.85 0.00 0.00 174.74 172.50 2c34 s LEU 110 N -2.80 -0.26 -0.32 0.89 1.43 0.53 -2.24 118.68 115.91 2c34 s LEU 110 Ca 0.60 0.29 -0.06 0.00 -1.03 0.00 0.00 54.13 53.94 2c34 s LEU 110 Cb -0.26 0.62 -0.13 0.00 0.03 0.00 0.00 46.19 46.44 2c34 s LEU 110 CO 0.32 -0.27 3.25 -3.20 0.23 0.00 0.00 176.35 176.68 2c34 n ASN 111 N 5.34 6.01 -3.78 2.29 5.15 0.16 -2.15 115.26 128.27 2c34 n ASN 111 Ca -0.06 -2.75 -0.53 0.00 -0.60 0.00 0.00 54.58 50.64 2c34 n ASN 111 Cb 0.50 -1.37 -0.08 0.00 -0.53 0.00 0.00 39.78 38.30 2c34 n ASN 111 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2c34 n VAL 112 N 2.00 0.00 0.36 3.44 0.31 -1.01 -4.19 118.33 119.24 2c34 n VAL 112 Ca 0.48 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.84 2c34 n VAL 112 Cb 0.72 -0.34 0.17 0.00 -0.91 0.00 0.00 33.84 33.48 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80