#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c34 n SER -1 N 0.00 0.00 -2.09 1.61 2.88 -1.26 -5.01 113.62 109.76 2c34 n SER -1 Ca 0.00 -1.00 -0.20 0.00 -1.33 0.00 0.00 58.87 56.34 2c34 n SER -1 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 2c34 n SER -1 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2c34 n HIS 0 N 0.00 -0.69 -0.56 0.66 8.25 -1.26 -4.95 115.22 116.68 2c34 n HIS 0 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 2c34 n HIS 0 Cb 0.33 -3.63 0.24 0.00 1.12 0.00 0.00 29.99 28.04 2c34 n HIS 0 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2c34 s MET 1 N -4.53 -0.69 0.24 -0.41 1.00 -1.26 -4.93 119.30 108.71 2c34 s MET 1 Ca 0.00 0.95 0.11 0.00 0.00 0.00 0.00 55.69 56.75 2c34 s MET 1 Cb 0.00 -1.57 0.15 0.00 0.00 0.00 0.00 34.83 33.41 2c34 s MET 1 CO 0.00 -3.61 1.48 -0.84 0.00 0.00 0.00 175.02 172.06 2c34 h ILE 2 N -2.54 1.34 -5.31 2.53 3.07 -1.92 -3.49 117.51 111.18 2c34 h ILE 2 Ca -0.59 -2.51 0.00 0.00 1.55 0.00 0.00 64.86 63.31 2c34 h ILE 2 Cb 1.32 2.42 -0.00 0.00 -0.27 0.00 0.00 36.82 40.29 2c34 h ILE 2 CO 0.49 0.68 -1.02 0.00 -1.05 0.00 0.00 178.15 177.25 2c34 n ALA 3 N -2.34 -3.28 -1.53 0.16 0.00 -1.26 -4.77 120.51 107.50 2c34 n ALA 3 Ca -0.00 0.49 -0.47 0.00 0.00 0.00 0.00 53.44 53.46 2c34 n ALA 3 Cb 0.74 -1.06 -0.05 0.00 0.00 0.00 0.00 19.45 19.08 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 0.84 1.53 0.00 0.00 -0.02 -1.26 -4.36 135.00 131.73 2c34 n PRO 4 Ca -0.01 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2c34 n PRO 4 Cb 0.09 -2.81 0.00 0.00 -0.02 0.00 0.00 33.50 30.76 2c34 n PRO 4 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2c34 n LEU 5 N 10.46 0.00 0.00 2.45 7.94 -1.26 -5.02 117.00 131.57 2c34 n LEU 5 Ca 0.35 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.25 2c34 n LEU 5 Cb 0.33 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.28 2c34 n LEU 5 CO 0.71 0.00 -0.09 -1.20 -1.11 0.00 0.00 177.39 175.71 2c34 n SER 6 N -0.63 0.05 -3.81 1.96 7.64 -1.26 -5.05 113.62 112.52 2c34 n SER 6 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.59 2c34 n SER 6 Cb 0.00 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.04 2c34 n SER 6 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2c34 s VAL 7 N -1.94 1.02 -0.34 0.44 0.11 -1.26 -4.94 120.40 113.49 2c34 s VAL 7 Ca 0.00 -1.14 0.10 0.00 -2.93 0.00 0.00 61.98 58.01 2c34 s VAL 7 Cb 0.00 -1.56 -0.13 0.00 -1.53 0.00 0.00 36.38 33.17 2c34 s VAL 7 CO 0.00 -0.37 0.37 2.29 -3.33 0.00 0.00 175.10 174.06 2c34 n LYS 8 N 4.83 2.66 -2.45 1.54 0.00 -1.26 -4.78 118.16 118.70 2c34 n LYS 8 Ca -0.07 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.31 58.20 2c34 n LYS 8 Cb 0.44 -1.06 -0.01 0.00 -0.00 0.00 0.00 35.03 34.40 2c34 n LYS 8 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2c34 n ASP 9 N -1.42 -5.17 0.00 -5.58 2.03 -1.26 -5.06 116.55 100.09 2c34 n ASP 9 Ca 0.01 1.49 0.00 0.00 0.52 0.00 0.00 54.79 56.81 2c34 n ASP 9 Cb 0.19 -4.22 0.00 0.00 -0.72 0.00 0.00 41.12 36.37 2c34 n ASP 9 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2c34 n ASN 10 N 1.92 0.00 -3.69 1.67 6.94 -1.26 -5.01 115.26 115.83 2c34 n ASN 10 Ca -0.12 0.00 -0.40 0.00 -0.02 0.00 0.00 54.58 54.04 2c34 n ASN 10 Cb 0.19 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.49 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 -0.33 0.38 -4.43 0.53 5.68 -1.26 -4.54 116.55 112.58 2c34 n ASP 11 Ca 0.00 0.30 -0.44 0.00 -0.50 0.00 0.00 54.79 54.16 2c34 n ASP 11 Cb 0.00 -0.76 -0.04 0.00 -1.14 0.00 0.00 41.12 39.18 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 6.60 3.10 -0.58 0.11 2.20 -0.76 -4.86 119.74 125.55 2c34 s LYS 12 Ca 1.09 -0.98 -0.26 0.00 -0.36 0.00 0.00 55.97 55.45 2c34 s LYS 12 Cb -1.13 -4.23 0.04 0.00 -1.51 0.00 0.00 37.83 31.00 2c34 s LYS 12 CO 0.46 -1.68 1.09 -1.58 -0.36 0.00 0.00 175.35 173.28 2c34 s TRP 13 N 3.50 2.66 0.33 4.03 0.52 -1.26 -0.13 118.94 128.60 2c34 s TRP 13 Ca 0.18 0.18 -0.10 0.00 0.02 0.00 0.00 56.10 56.39 2c34 s TRP 13 Cb -0.19 -4.33 0.02 0.00 -1.15 0.00 0.00 33.47 27.81 2c34 s TRP 13 CO 0.09 -1.52 0.59 0.54 0.02 0.00 0.00 176.95 176.67 2c34 s VAL 14 N 4.56 0.00 0.48 4.03 0.11 -0.94 -4.99 120.40 123.66 2c34 s VAL 14 Ca 0.37 -1.33 0.02 0.00 -2.93 0.00 0.00 61.98 58.10 2c34 s VAL 14 Cb -0.10 -2.59 0.09 0.00 -1.53 0.00 0.00 36.38 32.25 2c34 s VAL 14 CO 0.22 0.00 0.66 0.47 -3.33 0.00 0.00 175.10 173.11 2c34 n ASP 15 N -1.15 1.07 -2.44 3.54 9.92 -1.26 0.22 116.55 126.44 2c34 n ASP 15 Ca -0.03 -1.86 0.00 0.00 -0.53 0.00 0.00 54.79 52.38 2c34 n ASP 15 Cb 0.61 -0.41 0.01 0.00 -0.64 0.00 0.00 41.12 40.69 2c34 n ASP 15 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 2c34 n THR 16 N -2.26 0.00 -3.16 -3.53 5.66 -1.24 -4.45 114.28 105.30 2c34 n THR 16 Ca 0.11 -0.16 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 2c34 n THR 16 Cb 0.41 0.35 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 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 -0.46 -0.16 -3.54 1.09 8.25 -1.26 -2.37 115.22 116.76 2c34 n HIS 17 Ca 0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.10 2c34 n HIS 17 Cb 0.31 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.34 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 0.57 5.29 -0.11 1.59 1.01 -1.26 -4.22 120.40 123.27 2c34 s VAL 18 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.44 2c34 s VAL 18 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2c34 s VAL 18 CO 0.00 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.04 2c34 n GLY 19 N 3.88 0.16 3.57 4.51 0.00 0.11 -4.84 105.19 112.58 2c34 n GLY 19 Ca -0.12 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.86 1.74 -0.85 1.61 2.47 -1.26 -4.61 119.74 116.98 2c34 s LYS 20 Ca 0.00 -0.17 -0.27 0.00 -1.56 0.00 0.00 55.97 53.97 2c34 s LYS 20 Cb 0.00 -4.96 -0.19 0.00 -1.46 0.00 0.00 37.83 31.22 2c34 s LYS 20 CO 0.00 -4.56 2.54 2.41 0.16 0.00 0.00 175.35 175.91 2c34 n THR 21 N 8.59 -0.02 -2.97 3.43 -1.04 -1.26 -4.62 114.28 116.38 2c34 n THR 21 Ca 0.44 -0.31 -0.44 0.00 -2.04 0.00 0.00 64.05 61.70 2c34 n THR 21 Cb 0.45 -1.16 -0.03 0.00 -1.82 0.00 0.00 70.33 67.78 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 9.19 4.69 -0.07 12.58 2.01 -0.98 -4.85 115.64 138.22 2c34 s THR 22 Ca 1.23 -1.18 -0.26 0.00 0.31 0.00 0.00 61.69 61.78 2c34 s THR 22 Cb -0.85 -4.67 -0.03 0.00 0.01 0.00 0.00 72.50 66.95 2c34 s THR 22 CO 0.41 -1.39 0.83 -0.70 -0.69 0.00 0.00 174.62 173.09 2c34 s GLU 23 N 2.90 4.44 -0.27 4.92 2.12 -1.22 -2.46 118.70 129.12 2c34 s GLU 23 Ca 0.24 1.10 -0.02 0.00 0.36 0.00 0.00 54.97 56.66 2c34 s GLU 23 Cb -0.12 -3.48 0.09 0.00 0.26 0.00 0.00 34.13 30.87 2c34 s GLU 23 CO -0.01 -0.08 0.08 0.42 -0.54 0.00 0.00 175.26 175.13 2c34 s ILE 24 N 1.23 0.67 -0.27 -3.70 1.01 -0.67 -4.91 121.20 114.57 2c34 s ILE 24 Ca 0.43 -1.05 -0.22 0.00 0.00 0.00 0.00 60.65 59.80 2c34 s ILE 24 Cb -0.18 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.89 2c34 s ILE 24 CO 0.20 -0.52 0.71 -1.00 0.00 0.00 0.00 174.94 174.33 2c34 s HIS 25 N 1.75 3.26 0.15 3.97 3.76 -1.25 -1.95 115.29 124.99 2c34 s HIS 25 Ca 0.06 0.87 0.10 0.00 -0.15 0.00 0.00 55.06 55.94 2c34 s HIS 25 Cb -0.17 -2.99 -0.04 0.00 1.11 0.00 0.00 32.58 30.49 2c34 s HIS 25 CO -0.21 -0.41 -0.22 -0.51 -0.85 0.00 0.00 174.74 172.53 2c34 s LEU 26 N 2.70 2.50 0.19 0.89 1.43 0.20 -4.85 118.68 121.74 2c34 s LEU 26 Ca 0.30 -0.73 0.08 0.00 -1.03 0.00 0.00 54.13 52.75 2c34 s LEU 26 Cb -0.15 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2c34 s LEU 26 CO 0.09 0.15 -0.16 -0.54 0.23 0.00 0.00 176.35 176.13 2c34 s LYS 27 N -2.33 1.32 0.00 1.70 1.02 -1.26 0.84 119.74 121.02 2c34 s LYS 27 Ca 0.18 -1.52 0.00 0.00 0.02 0.00 0.00 55.97 54.65 2c34 s LYS 27 Cb -0.09 -1.24 0.00 0.00 -0.52 0.00 0.00 37.83 35.97 2c34 s LYS 27 CO 0.09 0.23 0.00 0.41 -0.92 0.00 0.00 175.35 175.16 2c34 n GLY 28 N -0.10 1.41 2.59 -3.33 0.00 -1.26 -5.01 105.19 99.49 2c34 n GLY 28 Ca -0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.81 2c34 n GLY 28 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2c34 n ASN 29 N 0.00 -4.33 -3.60 1.61 6.94 -1.26 -4.99 115.26 109.63 2c34 n ASN 29 Ca 0.00 1.24 0.00 0.00 -0.02 0.00 0.00 54.58 55.80 2c34 n ASN 29 Cb 0.00 -3.20 0.00 0.00 -2.36 0.00 0.00 39.78 34.22 2c34 n ASN 29 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2c34 n PRO 30 N 2.09 2.13 0.00 -0.53 -0.04 -1.26 -4.69 135.00 132.70 2c34 n PRO 30 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2c34 n PRO 30 Cb 0.18 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.64 2c34 n PRO 30 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2c34 n THR 31 N -0.12 0.24 -1.83 0.52 -2.24 -1.26 -4.68 114.28 104.91 2c34 n THR 31 Ca 0.00 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.60 2c34 n THR 31 Cb 0.00 -0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 67.66 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 0.32 -0.32 0.00 4.28 -2.24 -1.26 -4.75 114.28 110.31 2c34 n THR 32 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2c34 n THR 32 Cb 0.23 -2.08 0.00 0.00 -2.10 0.00 0.00 70.33 66.38 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 -0.89 0.00 0.00 3.38 0.00 -1.26 -5.10 105.19 101.32 2c34 n GLY 33 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.35 -2.47 -3.52 1.61 4.02 -1.26 -4.30 117.16 109.89 2c34 n TYR 34 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.72 2c34 n TYR 34 Cb 0.17 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.43 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 -2.03 1.00 -0.87 -0.72 -2.45 0.53 -4.73 119.30 110.03 2c34 s MET 35 Ca 0.00 0.21 -0.06 0.00 -1.25 0.00 0.00 55.69 54.58 2c34 s MET 35 Cb 0.00 0.47 0.22 0.00 1.25 0.00 0.00 34.83 36.77 2c34 s MET 35 CO 0.00 -0.32 0.77 -1.58 1.05 0.00 0.00 175.02 174.94 2c34 s TRP 36 N -1.31 3.83 0.00 4.11 0.23 -1.25 -1.09 118.94 123.46 2c34 s TRP 36 Ca -0.09 -2.66 0.00 0.00 -2.03 0.00 0.00 56.10 51.31 2c34 s TRP 36 Cb -0.00 -3.48 0.00 0.00 0.03 0.00 0.00 33.47 30.01 2c34 s TRP 36 CO 0.08 -0.86 0.00 -2.37 0.96 0.00 0.00 176.95 174.76 2c34 n THR 37 N 3.02 0.00 -2.84 2.01 5.66 -1.02 -4.90 114.28 116.21 2c34 n THR 37 Ca 0.17 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.88 2c34 n THR 37 Cb 0.40 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.15 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 -0.76 3.73 0.13 1.09 0.52 -1.26 -0.73 118.95 121.67 2c34 s ARG 38 Ca 0.00 0.40 -0.30 0.00 -0.52 0.00 0.00 55.73 55.30 2c34 s ARG 38 Cb 0.00 -2.40 -0.07 0.00 0.52 0.00 0.00 34.95 33.00 2c34 s ARG 38 CO 0.00 -0.05 1.22 0.08 0.02 0.00 0.00 175.30 176.57 2c34 s VAL 39 N -2.42 3.72 -0.00 3.52 1.01 0.03 -2.86 120.40 123.38 2c34 s VAL 39 Ca 0.50 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.81 2c34 s VAL 39 Cb -0.10 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2c34 s VAL 39 CO 0.34 0.15 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2c34 n GLY 40 N 2.77 0.48 0.00 4.51 0.00 -1.26 -4.80 105.19 106.89 2c34 n GLY 40 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.98 0.00 -1.52 1.61 3.72 -1.14 -4.98 117.46 112.18 2c34 n PHE 41 Ca -0.00 0.00 -0.49 0.00 -0.05 0.00 0.00 57.45 56.91 2c34 n PHE 41 Cb 0.01 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.50 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 -0.17 0.28 0.00 -4.37 0.31 -1.16 -0.05 118.33 113.17 2c34 n VAL 42 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 2c34 n VAL 42 Cb 0.08 -1.89 0.00 0.00 -0.91 0.00 0.00 33.84 31.12 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 6.00 2.56 3.60 2.92 0.00 -1.26 -4.80 105.19 114.20 2c34 n GLY 43 Ca 0.36 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.09 -0.72 -0.04 1.61 1.02 0.93 -5.02 119.74 117.42 2c34 s LYS 44 Ca 0.00 0.22 -0.03 0.00 0.02 0.00 0.00 55.97 56.18 2c34 s LYS 44 Cb 0.00 -1.63 -0.02 0.00 -0.52 0.00 0.00 37.83 35.66 2c34 s LYS 44 CO 0.00 -3.44 0.19 -0.44 -0.92 0.00 0.00 175.35 170.75 2c34 h ASP 45 N -2.39 -0.10 -2.74 2.83 5.19 -1.98 -3.46 116.42 113.77 2c34 h ASP 45 Ca -0.50 0.00 -0.65 0.00 -0.62 0.00 0.00 57.03 55.26 2c34 h ASP 45 Cb 1.32 0.03 -0.06 0.00 0.18 0.00 0.00 39.33 40.79 2c34 h ASP 45 CO 0.44 0.18 -0.45 0.54 -3.12 0.00 0.00 179.24 176.83 2c34 s VAL 46 N -1.82 5.43 -0.21 -1.35 0.11 -1.26 -5.02 120.40 116.28 2c34 s VAL 46 Ca -0.02 0.15 -0.18 0.00 -2.93 0.00 0.00 61.98 59.00 2c34 s VAL 46 Cb 0.00 -3.48 -0.15 0.00 -1.53 0.00 0.00 36.38 31.22 2c34 s VAL 46 CO 0.05 0.51 0.03 0.18 -3.33 0.00 0.00 175.10 172.54 2c34 n LEU 47 N 1.58 1.87 0.00 2.54 4.77 -1.26 -4.91 117.00 121.60 2c34 n LEU 47 Ca -0.16 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 2c34 n LEU 47 Cb 0.54 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2c34 n LEU 47 CO 0.36 0.21 0.00 -1.54 -1.33 0.00 0.00 177.39 175.09 2c34 n SER 48 N -4.42 -1.07 0.00 -1.43 3.41 -1.26 -4.88 113.62 103.96 2c34 n SER 48 Ca -0.33 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 2c34 n SER 48 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 2c34 n SER 48 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2c34 n ASP 49 N -2.58 0.00 0.00 4.04 8.00 -1.26 -4.96 116.55 119.79 2c34 n ASP 49 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2c34 n ASP 49 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2c34 n ASP 49 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2c34 n GLU 50 N -0.38 1.01 0.00 -1.24 0.28 -1.26 -4.96 120.64 114.09 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 -0.65 0.00 0.00 1.43 0.00 0.00 31.44 32.22 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 -1.05 0.00 -3.41 3.84 2.08 -1.26 -4.47 119.36 115.08 2c34 n ILE 51 Ca 0.00 0.31 -0.44 0.00 0.56 0.00 0.00 62.75 63.18 2c34 n ILE 51 Cb 0.15 -0.70 -0.09 0.00 -0.75 0.00 0.00 39.64 38.25 2c34 n ILE 51 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2c34 s LEU 52 N -0.63 5.43 0.45 1.39 0.20 -1.26 -1.36 118.68 122.90 2c34 s LEU 52 Ca 0.00 -1.16 -0.25 0.00 0.69 0.00 0.00 54.13 53.41 2c34 s LEU 52 Cb 0.00 -2.18 -0.08 0.00 -0.43 0.00 0.00 46.19 43.50 2c34 s LEU 52 CO 0.00 -0.57 1.43 -0.70 -0.29 0.00 0.00 176.35 176.22 2c34 s GLU 53 N 1.66 3.66 -0.40 1.98 2.12 0.91 -4.27 118.70 124.37 2c34 s GLU 53 Ca 0.05 2.43 0.03 0.00 0.36 0.00 0.00 54.97 57.83 2c34 s GLU 53 Cb -0.22 -2.64 0.16 0.00 0.26 0.00 0.00 34.13 31.69 2c34 s GLU 53 CO 0.08 -0.84 0.37 0.08 -0.54 0.00 0.00 175.26 174.41 2c34 s VAL 54 N -1.20 -0.06 -1.15 3.70 1.01 -1.24 0.42 120.40 121.89 2c34 s VAL 54 Ca 0.61 -1.78 -0.17 0.00 0.00 0.00 0.00 61.98 60.65 2c34 s VAL 54 Cb -0.44 -0.90 0.12 0.00 0.00 0.00 0.00 36.38 35.16 2c34 s VAL 54 CO 0.56 -0.85 1.44 -0.69 0.00 0.00 0.00 175.10 175.56 2c34 s VAL 55 N 0.76 4.60 -0.16 2.92 1.01 0.15 -4.24 120.40 125.44 2c34 s VAL 55 Ca 0.25 -2.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.16 2c34 s VAL 55 Cb -0.08 -4.97 -0.04 0.00 0.00 0.00 0.00 36.38 31.29 2c34 s VAL 55 CO -0.09 -1.74 0.09 0.00 0.00 0.00 0.00 175.10 173.37 2c34 s LYS 57 N -0.11 3.18 -0.76 0.00 1.02 0.93 -4.97 119.74 119.02 2c34 s LYS 57 Ca 0.08 -0.73 -0.20 0.00 0.02 0.00 0.00 55.97 55.14 2c34 s LYS 57 Cb -0.12 -2.76 0.11 0.00 -0.52 0.00 0.00 37.83 34.54 2c34 s LYS 57 CO 0.01 -0.17 0.96 -0.47 -0.92 0.00 0.00 175.35 174.76 2c34 s TYR 58 N 1.29 2.99 -0.46 3.18 6.14 -1.26 -2.48 117.35 126.76 2c34 s TYR 58 Ca 0.04 -1.07 -0.18 0.00 0.64 0.00 0.00 57.07 56.50 2c34 s TYR 58 Cb -0.14 -4.20 0.04 0.00 0.42 0.00 0.00 41.96 38.08 2c34 s TYR 58 CO -0.07 -1.47 0.52 0.99 0.64 0.00 0.00 175.55 176.16 2c34 s THR 59 N 2.96 5.00 -1.02 4.34 2.01 -1.22 -5.00 115.64 122.70 2c34 s THR 59 Ca 0.24 -0.41 -0.09 0.00 0.31 0.00 0.00 61.69 61.74 2c34 s THR 59 Cb -0.13 -4.15 0.26 0.00 0.01 0.00 0.00 72.50 68.48 2c34 s THR 59 CO 0.00 -0.58 1.00 -2.16 -0.69 0.00 0.00 174.62 172.18 2c34 s PRO 60 N 2.33 3.96 0.31 4.92 0.04 -1.26 -0.07 135.00 145.24 2c34 s PRO 60 Ca 0.14 -3.05 -0.29 0.00 0.04 0.00 0.00 61.00 57.84 2c34 s PRO 60 Cb -0.18 -4.46 -0.13 0.00 0.04 0.00 0.00 34.50 29.77 2c34 s PRO 60 CO 0.13 -1.25 1.23 2.41 0.04 0.00 0.00 177.00 179.56 2c34 n THR 61 N 2.95 1.83 -3.22 1.26 -1.04 -1.21 -4.72 114.28 110.13 2c34 n THR 61 Ca 0.21 -0.46 -0.29 0.00 -2.04 0.00 0.00 64.05 61.47 2c34 n THR 61 Cb 0.41 -1.39 -0.03 0.00 -1.82 0.00 0.00 70.33 67.49 2c34 n THR 61 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2c34 s PRO 62 N -1.56 3.70 0.00 -2.82 0.04 -1.26 -2.90 135.00 130.20 2c34 s PRO 62 Ca 0.58 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.79 2c34 s PRO 62 Cb -0.62 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.34 2c34 s PRO 62 CO 0.60 0.16 0.00 -1.13 0.04 0.00 0.00 177.00 176.67 2c34 n SER 63 N -0.92 0.08 0.00 6.66 3.41 -1.23 -4.98 113.62 116.64 2c34 n SER 63 Ca -0.00 -0.99 0.00 0.00 -0.26 0.00 0.00 58.87 57.62 2c34 n SER 63 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2c34 n SER 63 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2c34 n SER 64 N -2.89 0.00 0.04 4.04 7.64 -1.26 -4.97 113.62 116.21 2c34 n SER 64 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2c34 n SER 64 Cb 0.00 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 2c34 n SER 64 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2c34 n THR 65 N -2.10 0.00 -0.38 0.44 -1.04 -1.26 -4.89 114.28 105.05 2c34 n THR 65 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 2c34 n THR 65 Cb 0.00 -0.08 0.04 0.00 -1.82 0.00 0.00 70.33 68.47 2c34 n THR 65 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2c34 n PRO 66 N -2.66 1.48 -0.71 -2.82 -0.05 -1.26 -3.36 135.00 125.62 2c34 n PRO 66 Ca 0.00 -1.00 -0.01 0.00 -0.05 0.00 0.00 63.50 62.44 2c34 n PRO 66 Cb 0.00 -1.39 -0.01 0.00 -0.05 0.00 0.00 33.50 32.05 2c34 n PRO 66 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 175.50 175.33 2c34 n MET 67 N 0.47 0.02 -1.44 0.54 0.00 -1.26 -5.14 117.12 110.31 2c34 n MET 67 Ca 0.19 -0.15 -0.50 0.00 0.00 0.00 0.00 57.70 57.24 2c34 n MET 67 Cb 0.66 0.45 -0.04 0.00 0.00 0.00 0.00 33.22 34.29 2c34 n MET 67 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 175.97 177.52 2c34 n VAL 68 N -0.03 1.54 0.00 1.12 3.14 -1.22 -4.67 118.33 118.22 2c34 n VAL 68 Ca -0.04 -0.38 0.00 0.00 -2.96 0.00 0.00 64.34 60.96 2c34 n VAL 68 Cb 0.35 -0.10 0.00 0.00 -1.06 0.00 0.00 33.84 33.02 2c34 n VAL 68 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2c34 n GLY 69 N 1.85 3.76 0.83 7.55 0.00 -1.26 -4.96 105.19 112.96 2c34 n GLY 69 Ca 0.18 -0.48 -0.01 0.00 0.00 0.00 0.00 46.02 45.71 2c34 n GLY 69 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2c34 n VAL 70 N 0.00 0.65 -1.82 1.61 3.14 -1.26 -3.50 118.33 117.16 2c34 n VAL 70 Ca 0.00 -0.12 -0.42 0.00 -2.96 0.00 0.00 64.34 60.84 2c34 n VAL 70 Cb 0.00 -0.71 -0.03 0.00 -1.06 0.00 0.00 33.84 32.04 2c34 n VAL 70 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 2c34 s GLY 71 N 0.37 1.42 0.00 7.55 0.00 -1.14 -3.29 107.32 112.23 2c34 s GLY 71 Ca 0.04 1.50 0.00 0.00 0.00 0.00 0.00 44.72 46.26 2c34 s GLY 71 CO 0.01 2.75 0.00 0.61 0.00 0.00 0.00 173.10 176.47 2c34 n GLY 72 N 3.76 4.24 0.00 0.20 0.00 -1.25 -3.38 105.19 108.76 2c34 n GLY 72 Ca 0.14 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.42 -0.61 -6.64 0.90 -4.33 119.36 105.26 2c34 n ILE 73 Ca 0.00 0.00 -0.21 0.00 -1.77 0.00 0.00 62.75 60.77 2c34 n ILE 73 Cb 0.00 0.00 -0.10 0.00 -1.44 0.00 0.00 39.64 38.10 2c34 n ILE 73 CO 0.00 0.00 0.00 -0.31 -1.77 0.00 0.00 176.55 174.47 2c34 s TYR 74 N -1.56 -0.09 -0.22 4.28 2.02 0.25 -3.42 117.35 118.61 2c34 s TYR 74 Ca 0.00 -0.73 -0.12 0.00 -0.37 0.00 0.00 57.07 55.85 2c34 s TYR 74 Cb 0.00 -0.59 -0.05 0.00 -0.40 0.00 0.00 41.96 40.92 2c34 s TYR 74 CO 0.00 -0.91 0.24 0.54 -1.57 0.00 0.00 175.55 173.85 2c34 s VAL 75 N 1.82 5.31 -0.14 0.71 0.11 -1.04 -0.63 120.40 126.55 2c34 s VAL 75 Ca 0.13 0.37 0.01 0.00 -2.93 0.00 0.00 61.98 59.57 2c34 s VAL 75 Cb -0.16 -3.58 0.02 0.00 -1.53 0.00 0.00 36.38 31.13 2c34 s VAL 75 CO -0.19 0.34 -0.17 -0.69 -3.33 0.00 0.00 175.10 171.05 2c34 s VAL 76 N 0.98 1.73 -0.64 2.04 1.01 -0.82 -0.05 120.40 124.65 2c34 s VAL 76 Ca 0.12 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.24 2c34 s VAL 76 Cb -0.13 -1.58 0.16 0.00 0.00 0.00 0.00 36.38 34.83 2c34 s VAL 76 CO 0.05 0.49 0.53 -0.76 0.00 0.00 0.00 175.10 175.40 2c34 s LEU 77 N 1.16 5.99 -0.59 3.92 1.43 -0.56 -1.67 118.68 128.35 2c34 s LEU 77 Ca -0.01 -2.40 -0.20 0.00 -1.03 0.00 0.00 54.13 50.48 2c34 s LEU 77 Cb -0.14 -2.06 0.08 0.00 0.03 0.00 0.00 46.19 44.10 2c34 s LEU 77 CO -0.06 -0.59 0.76 -0.69 0.23 0.00 0.00 176.35 176.00 2c34 s VAL 78 N 0.62 4.69 -0.49 -1.59 1.01 -1.03 0.29 120.40 123.91 2c34 s VAL 78 Ca 0.12 -0.67 -0.14 0.00 0.00 0.00 0.00 61.98 61.30 2c34 s VAL 78 Cb -0.20 -4.49 0.10 0.00 0.00 0.00 0.00 36.38 31.79 2c34 s VAL 78 CO -0.04 -1.13 0.40 -0.54 0.00 0.00 0.00 175.10 173.79 2c34 s LYS 79 N 3.06 2.85 -0.70 2.72 1.02 0.17 -2.31 119.74 126.55 2c34 s LYS 79 Ca 0.16 -1.55 -0.25 0.00 0.02 0.00 0.00 55.97 54.35 2c34 s LYS 79 Cb -0.21 -4.10 -0.14 0.00 -0.52 0.00 0.00 37.83 32.87 2c34 s LYS 79 CO 0.09 -1.14 2.43 -2.30 -0.92 0.00 0.00 175.35 173.50 2c34 n PRO 80 N 5.13 0.66 0.21 -1.68 -0.02 -1.26 -0.06 135.00 137.97 2c34 n PRO 80 Ca -0.12 -0.32 0.05 0.00 -2.02 0.00 0.00 63.50 61.09 2c34 n PRO 80 Cb 0.42 -3.13 0.45 0.00 -0.02 0.00 0.00 33.50 31.22 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 15.54 0.00 -5.13 -0.52 3.08 -1.47 0.31 114.38 126.19 2c34 h ARG 81 Ca -0.11 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.44 2c34 h ARG 81 Cb 1.16 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 31.08 2c34 h ARG 81 CO 1.17 0.30 -0.57 0.15 -1.07 0.00 0.00 179.97 179.95 2c34 s LYS 82 N -4.12 1.76 -0.07 0.04 1.02 -1.03 -4.90 119.74 112.45 2c34 s LYS 82 Ca -0.02 -2.02 0.02 0.00 0.02 0.00 0.00 55.97 53.97 2c34 s LYS 82 Cb 0.14 -0.76 -0.02 0.00 -0.52 0.00 0.00 37.83 36.66 2c34 s LYS 82 CO 0.69 -0.31 -0.13 -0.98 -0.92 0.00 0.00 175.35 173.70 2c34 s ARG 83 N -3.83 2.73 0.00 1.68 1.70 -1.26 -4.87 118.95 115.09 2c34 s ARG 83 Ca 0.31 -0.67 0.00 0.00 -0.47 0.00 0.00 55.73 54.90 2c34 s ARG 83 Cb 0.06 -2.47 0.00 0.00 -0.57 0.00 0.00 34.95 31.97 2c34 s ARG 83 CO 0.15 0.55 0.00 0.41 -1.08 0.00 0.00 175.30 175.32 2c34 n GLY 84 N 2.55 0.23 3.33 3.88 0.00 0.96 -5.00 105.19 111.14 2c34 n GLY 84 Ca -0.17 -0.96 -0.47 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.68 3.64 0.33 1.61 3.76 -1.26 -1.29 115.29 119.40 2c34 s HIS 85 Ca 0.00 -1.84 0.08 0.00 -0.15 0.00 0.00 55.06 53.15 2c34 s HIS 85 Cb 0.00 -3.85 -0.04 0.00 1.11 0.00 0.00 32.58 29.80 2c34 s HIS 85 CO 0.00 -1.03 0.14 -1.01 -0.85 0.00 0.00 174.74 171.99 2c34 s HIS 86 N 0.55 2.73 0.11 1.40 3.76 -1.02 -5.01 115.29 117.82 2c34 s HIS 86 Ca 0.16 -0.35 -0.23 0.00 -0.15 0.00 0.00 55.06 54.49 2c34 s HIS 86 Cb -0.13 -1.60 0.06 0.00 1.11 0.00 0.00 32.58 32.02 2c34 s HIS 86 CO -0.07 0.36 0.58 0.99 -0.85 0.00 0.00 174.74 175.75 2c34 s THR 87 N -2.40 0.01 -0.51 1.30 2.01 -1.26 -2.01 115.64 112.77 2c34 s THR 87 Ca 0.37 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.30 2c34 s THR 87 Cb -0.03 -1.02 0.14 0.00 0.01 0.00 0.00 72.50 71.60 2c34 s THR 87 CO 0.23 -0.06 0.28 -0.22 -0.69 0.00 0.00 174.62 174.16 2c34 s LEU 88 N -2.45 3.72 -0.63 4.42 2.96 0.48 -4.89 118.68 122.28 2c34 s LEU 88 Ca -0.01 -2.98 -0.27 0.00 -0.22 0.00 0.00 54.13 50.65 2c34 s LEU 88 Cb -0.00 -1.39 0.00 0.00 0.50 0.00 0.00 46.19 45.30 2c34 s LEU 88 CO -0.08 -0.22 1.59 -1.61 -1.32 0.00 0.00 176.35 174.70 2c34 s GLU 89 N -0.20 2.96 -0.09 1.98 2.02 -1.26 -0.23 118.70 123.88 2c34 s GLU 89 Ca 0.19 0.33 -0.02 0.00 0.02 0.00 0.00 54.97 55.49 2c34 s GLU 89 Cb -0.22 -4.27 -0.03 0.00 0.10 0.00 0.00 34.13 29.71 2c34 s GLU 89 CO -0.02 -2.37 -0.01 -0.51 0.02 0.00 0.00 175.26 172.37 2c34 s LEU 90 N 7.37 3.52 0.15 1.80 1.43 -0.83 -0.79 118.68 131.32 2c34 s LEU 90 Ca 0.54 0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.75 2c34 s LEU 90 Cb -0.11 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2c34 s LEU 90 CO 0.20 0.36 0.06 0.68 0.23 0.00 0.00 176.35 177.88 2c34 s VAL 91 N -0.78 0.20 -0.88 -1.59 -7.23 0.09 -0.80 120.40 109.41 2c34 s VAL 91 Ca 0.12 -1.94 -0.06 0.00 -1.81 0.00 0.00 61.98 58.29 2c34 s VAL 91 Cb -0.11 -2.14 0.22 0.00 0.56 0.00 0.00 36.38 34.91 2c34 s VAL 91 CO 0.02 -0.39 0.79 -0.47 -0.31 0.00 0.00 175.10 174.75 2c34 s TYR 92 N -3.99 3.87 0.20 2.82 6.14 -0.91 -2.43 117.35 123.05 2c34 s TYR 92 Ca 0.27 -2.68 0.08 0.00 0.64 0.00 0.00 57.07 55.38 2c34 s TYR 92 Cb 0.07 -3.50 -0.05 0.00 0.42 0.00 0.00 41.96 38.91 2c34 s TYR 92 CO 0.04 -0.86 -0.14 -0.08 0.64 0.00 0.00 175.55 175.14 2c34 s THR 93 N -0.77 1.72 -0.59 4.34 -1.32 -0.25 -4.07 115.64 114.69 2c34 s THR 93 Ca 0.24 -2.20 -0.20 0.00 -1.21 0.00 0.00 61.69 58.33 2c34 s THR 93 Cb -0.11 -2.03 0.09 0.00 -1.51 0.00 0.00 72.50 68.94 2c34 s THR 93 CO -0.09 -0.59 0.75 -0.13 -2.21 0.00 0.00 174.62 172.35 2c34 s ARG 94 N -3.62 3.07 0.24 7.08 0.52 -1.18 0.20 118.95 125.26 2c34 s ARG 94 Ca 0.22 -1.16 0.09 0.00 -0.52 0.00 0.00 55.73 54.36 2c34 s ARG 94 Cb -0.01 -4.24 0.77 0.00 0.52 0.00 0.00 34.95 31.99 2c34 s ARG 94 CO 0.07 -1.56 1.11 -2.30 0.02 0.00 0.00 175.30 172.64 2c34 n PRO 95 N 6.60 -0.05 -0.07 3.54 -0.02 -1.26 -0.16 135.00 143.58 2c34 n PRO 95 Ca -0.08 1.01 -0.10 0.00 -2.02 0.00 0.00 63.50 62.31 2c34 n PRO 95 Cb 0.43 -1.72 -0.09 0.00 -0.02 0.00 0.00 33.50 32.10 2c34 n PRO 95 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2c34 h PHE 96 N 0.00 0.00 0.00 6.00 -5.15 -1.92 -3.30 116.94 112.58 2c34 h PHE 96 Ca 0.52 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.29 2c34 h PHE 96 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.44 2c34 h PHE 96 CO -0.17 0.73 0.00 0.39 -2.00 0.00 0.00 178.31 177.26 2c34 n GLU 97 N -4.65 0.53 0.00 6.09 -0.58 -0.17 -4.97 120.64 116.89 2c34 n GLU 97 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2c34 n GLU 97 Cb 0.35 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.97 2c34 n GLU 97 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c34 n GLY 98 N 0.04 -1.73 3.56 0.62 0.00 0.77 -4.90 105.19 103.55 2c34 n GLY 98 Ca 0.06 -1.31 -0.26 0.00 0.00 0.00 0.00 46.02 44.52 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 0.00 3.11 0.08 -0.61 1.01 -1.26 -3.11 121.20 120.41 2c34 s ILE 99 Ca 0.00 -1.78 -0.09 0.00 0.00 0.00 0.00 60.65 58.78 2c34 s ILE 99 Cb 0.00 -2.56 0.00 0.00 0.01 0.00 0.00 42.46 39.91 2c34 s ILE 99 CO 0.00 -0.17 0.19 -0.54 0.00 0.00 0.00 174.94 174.42 2c34 s LYS 100 N -2.99 0.81 0.38 2.79 1.02 -1.26 -5.06 119.74 115.43 2c34 s LYS 100 Ca 0.26 -0.88 0.05 0.00 0.02 0.00 0.00 55.97 55.43 2c34 s LYS 100 Cb -0.08 0.33 0.75 0.00 -0.52 0.00 0.00 37.83 38.31 2c34 s LYS 100 CO 0.15 -0.25 2.01 -1.00 -0.92 0.00 0.00 175.35 175.34 2c34 h PRO 101 N 2.91 0.60 0.00 -1.68 0.13 -2.00 -1.99 132.00 129.98 2c34 h PRO 101 Ca -0.34 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2c34 h PRO 101 Cb 1.20 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2c34 h PRO 101 CO 0.54 0.44 0.02 -0.85 -0.23 0.00 0.00 178.00 177.93 2c34 n GLU 102 N -4.42 0.05 -2.32 0.86 0.28 -1.26 -4.68 120.64 109.16 2c34 n GLU 102 Ca 0.03 0.54 -0.40 0.00 -0.16 0.00 0.00 57.16 57.17 2c34 n GLU 102 Cb 0.09 -1.70 -0.03 0.00 1.43 0.00 0.00 31.44 31.23 2c34 n GLU 102 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2c34 s ASN 103 N -3.35 6.99 0.98 -1.84 0.02 -0.75 -4.99 114.94 112.00 2c34 s ASN 103 Ca -0.01 2.44 -0.13 0.00 -1.02 0.00 0.00 52.86 54.14 2c34 s ASN 103 Cb 0.02 -2.63 0.10 0.00 0.02 0.00 0.00 41.25 38.76 2c34 s ASN 103 CO 0.07 -0.36 0.65 -0.62 0.02 0.00 0.00 177.10 176.87 2c34 n GLU 104 N 0.90 -0.71 -4.42 -0.60 4.71 -1.26 -4.68 120.64 114.58 2c34 n GLU 104 Ca -0.00 -0.16 -0.22 0.00 -0.01 0.00 0.00 57.16 56.77 2c34 n GLU 104 Cb 0.44 -2.03 -0.10 0.00 -1.01 0.00 0.00 31.44 28.74 2c34 n GLU 104 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 2c34 s ARG 105 N -4.00 1.54 -0.36 3.49 6.06 -1.26 -2.15 118.95 122.28 2c34 s ARG 105 Ca 0.61 -1.71 0.01 0.00 -2.50 0.00 0.00 55.73 52.14 2c34 s ARG 105 Cb -0.21 -1.47 0.29 0.00 0.06 0.00 0.00 34.95 33.61 2c34 s ARG 105 CO 0.64 0.24 1.23 0.98 -2.50 0.00 0.00 175.30 175.89 2c34 n TYR 106 N -0.53 -1.02 -2.83 5.12 4.19 0.02 -4.62 117.16 117.48 2c34 n TYR 106 Ca -0.06 -0.94 -0.43 0.00 3.31 0.00 0.00 57.90 59.78 2c34 n TYR 106 Cb 0.61 1.21 -0.03 0.00 0.49 0.00 0.00 39.34 41.62 2c34 n TYR 106 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 2c34 s THR 107 N 0.18 4.46 -0.80 2.97 2.01 -1.26 -1.96 115.64 121.24 2c34 s THR 107 Ca 0.25 -1.14 -0.25 0.00 0.31 0.00 0.00 61.69 60.86 2c34 s THR 107 Cb 0.24 -4.83 -0.02 0.00 0.01 0.00 0.00 72.50 67.90 2c34 s THR 107 CO -0.13 -1.60 1.78 -0.22 -0.69 0.00 0.00 174.62 173.76 2c34 s LEU 108 N 3.49 3.25 0.30 4.42 2.96 0.68 -1.82 118.68 131.97 2c34 s LEU 108 Ca 0.34 -0.41 -0.27 0.00 -0.22 0.00 0.00 54.13 53.56 2c34 s LEU 108 Cb -0.06 -2.55 -0.09 0.00 0.50 0.00 0.00 46.19 43.98 2c34 s LEU 108 CO -0.06 -2.36 0.98 -1.00 -1.32 0.00 0.00 176.35 172.60 2c34 s HIS 109 N 8.59 3.70 -0.20 5.38 3.76 0.82 -0.39 115.29 136.95 2c34 s HIS 109 Ca 0.62 1.79 -0.04 0.00 -0.15 0.00 0.00 55.06 57.28 2c34 s HIS 109 Cb -0.08 -3.02 0.08 0.00 1.11 0.00 0.00 32.58 30.67 2c34 s HIS 109 CO 0.07 0.06 0.16 -0.51 -0.85 0.00 0.00 174.74 173.67 2c34 s LEU 110 N -1.80 0.12 -1.47 0.89 1.43 -0.85 -2.20 118.68 114.79 2c34 s LEU 110 Ca 0.48 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 2c34 s LEU 110 Cb -0.23 0.08 0.03 0.00 0.03 0.00 0.00 46.19 46.09 2c34 s LEU 110 CO 0.29 -0.34 2.38 0.59 0.23 0.00 0.00 176.35 179.50 2c34 n ASN 111 N 5.30 5.49 -4.42 2.29 4.13 0.13 -2.42 115.26 125.75 2c34 n ASN 111 Ca -0.06 -2.82 -0.53 0.00 1.68 0.00 0.00 54.58 52.85 2c34 n ASN 111 Cb 0.49 -1.60 -0.08 0.00 -1.54 0.00 0.00 39.78 37.05 2c34 n ASN 111 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2c34 n VAL 112 N 4.31 0.16 1.12 2.41 0.31 -0.41 -3.60 118.33 122.63 2c34 n VAL 112 Ca 0.58 -0.19 0.12 0.00 -0.01 0.00 0.00 64.34 64.85 2c34 n VAL 112 Cb 0.34 -1.37 0.20 0.00 -0.91 0.00 0.00 33.84 32.10 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80