#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 -4.17 1.61 3.41 -1.26 -5.12 113.62 108.09 2c34 n SER -1 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 2c34 n SER -1 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 2c34 n SER -1 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2c34 s HIS 0 N -1.00 1.18 -1.92 7.33 4.02 -1.26 -5.03 115.29 118.61 2c34 s HIS 0 Ca 0.00 -0.49 0.27 0.00 1.02 0.00 0.00 55.06 55.86 2c34 s HIS 0 Cb 0.00 -0.66 0.92 0.00 -1.02 0.00 0.00 32.58 31.83 2c34 s HIS 0 CO 0.00 0.05 1.67 -1.33 1.02 0.00 0.00 174.74 176.15 2c34 n MET 1 N 1.15 1.01 -1.09 1.40 2.81 -1.26 -4.91 117.12 116.23 2c34 n MET 1 Ca -0.20 -0.55 -0.03 0.00 -1.81 0.00 0.00 57.70 55.10 2c34 n MET 1 Cb 0.55 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.55 2c34 n MET 1 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 2c34 n ILE 2 N -0.51 0.00 -3.82 2.02 2.08 -1.26 -4.95 119.36 112.92 2c34 n ILE 2 Ca 0.14 0.00 -0.34 0.00 0.56 0.00 0.00 62.75 63.11 2c34 n ILE 2 Cb 0.33 -1.14 -0.05 0.00 -0.75 0.00 0.00 39.64 38.04 2c34 n ILE 2 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2c34 s ALA 3 N -1.30 3.89 -0.18 -1.39 0.00 -1.26 -5.03 121.76 116.49 2c34 s ALA 3 Ca 0.00 -0.65 -0.28 0.00 0.00 0.00 0.00 51.96 51.02 2c34 s ALA 3 Cb 0.00 -1.99 -0.06 0.00 0.00 0.00 0.00 23.12 21.07 2c34 s ALA 3 CO 0.00 0.69 2.19 -2.14 0.00 0.00 0.00 175.76 176.50 2c34 s PRO 4 N -1.81 3.26 0.00 0.00 0.02 -1.26 -4.92 135.00 130.29 2c34 s PRO 4 Ca 0.27 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.40 2c34 s PRO 4 Cb -0.13 -4.35 0.00 0.00 0.02 0.00 0.00 34.50 30.04 2c34 s PRO 4 CO 0.17 -1.96 0.00 1.28 -0.33 0.00 0.00 177.00 176.15 2c34 n LEU 5 N 11.17 0.00 0.27 -5.54 4.77 -1.26 -5.02 117.00 121.39 2c34 n LEU 5 Ca 0.29 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.42 2c34 n LEU 5 Cb 0.44 0.00 0.90 0.00 -2.33 0.00 0.00 43.42 42.43 2c34 n LEU 5 CO 0.66 0.00 1.14 0.77 -1.33 0.00 0.00 177.39 178.63 2c34 h SER 6 N 0.00 0.00 -3.61 -1.43 4.64 -1.91 -3.41 113.55 107.83 2c34 h SER 6 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2c34 h SER 6 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2c34 h SER 6 CO 0.00 0.00 0.18 0.68 -0.87 0.00 0.00 176.83 176.82 2c34 s VAL 7 N -4.62 4.42 -0.29 0.95 -7.23 -1.26 -4.99 120.40 107.38 2c34 s VAL 7 Ca -0.05 1.55 -0.24 0.00 -1.81 0.00 0.00 61.98 61.43 2c34 s VAL 7 Cb 0.15 -4.00 0.18 0.00 0.56 0.00 0.00 36.38 33.27 2c34 s VAL 7 CO 0.54 0.32 1.33 -0.75 -0.31 0.00 0.00 175.10 176.24 2c34 s LYS 8 N -1.65 0.16 -0.52 4.82 2.47 -1.26 -4.97 119.74 118.79 2c34 s LYS 8 Ca 0.41 0.20 -0.28 0.00 -1.56 0.00 0.00 55.97 54.74 2c34 s LYS 8 Cb -0.20 0.08 0.02 0.00 -1.46 0.00 0.00 37.83 36.27 2c34 s LYS 8 CO 0.24 -0.02 1.35 -0.51 0.16 0.00 0.00 175.35 176.56 2c34 s ASP 9 N 0.17 6.29 0.00 1.43 1.11 -1.26 -4.82 116.67 119.59 2c34 s ASP 9 Ca 0.05 0.41 0.00 0.00 0.18 0.00 0.00 52.55 53.19 2c34 s ASP 9 Cb -0.05 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.40 2c34 s ASP 9 CO -0.13 -1.55 0.00 -0.46 1.18 0.00 0.00 175.17 174.20 2c34 n ASN 10 N 9.01 0.00 -2.90 0.27 6.94 -1.26 -5.01 115.26 122.31 2c34 n ASN 10 Ca 0.13 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.36 2c34 n ASN 10 Cb 0.49 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 37.82 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 -0.66 0.34 -4.45 0.53 5.68 -1.26 -4.56 116.55 112.17 2c34 n ASP 11 Ca 0.00 0.28 -0.43 0.00 -0.50 0.00 0.00 54.79 54.13 2c34 n ASP 11 Cb 0.00 -0.60 -0.03 0.00 -1.14 0.00 0.00 41.12 39.34 2c34 n ASP 11 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2c34 s LYS 12 N 5.02 3.26 -0.72 0.11 -0.14 -0.49 -4.85 119.74 121.93 2c34 s LYS 12 Ca 0.85 -1.17 -0.27 0.00 -1.36 0.00 0.00 55.97 54.02 2c34 s LYS 12 Cb -0.91 -4.46 0.03 0.00 -1.68 0.00 0.00 37.83 30.80 2c34 s LYS 12 CO 0.38 -1.79 1.29 -1.58 -0.76 0.00 0.00 175.35 172.89 2c34 s TRP 13 N 3.53 2.30 0.06 3.18 0.52 -1.26 -0.04 118.94 127.24 2c34 s TRP 13 Ca 0.25 0.03 0.00 0.00 0.02 0.00 0.00 56.10 56.40 2c34 s TRP 13 Cb -0.14 -4.60 0.00 0.00 -1.15 0.00 0.00 33.47 27.58 2c34 s TRP 13 CO 0.03 -2.03 0.08 1.33 0.02 0.00 0.00 176.95 176.38 2c34 n VAL 14 N 6.44 0.00 -3.57 4.03 0.24 -0.90 -4.99 118.33 119.58 2c34 n VAL 14 Ca 0.04 -0.34 -0.18 0.00 -2.04 0.00 0.00 64.34 61.82 2c34 n VAL 14 Cb 0.49 0.20 0.01 0.00 -1.47 0.00 0.00 33.84 33.08 2c34 n VAL 14 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2c34 n ASP 15 N -2.21 2.08 -2.60 -1.34 9.92 -1.26 0.25 116.55 121.39 2c34 n ASP 15 Ca 0.00 -2.32 0.01 0.00 -0.53 0.00 0.00 54.79 51.96 2c34 n ASP 15 Cb 0.11 -0.11 0.01 0.00 -0.64 0.00 0.00 41.12 40.48 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 -1.59 0.00 -3.43 -3.53 5.66 -1.25 -4.50 114.28 105.64 2c34 n THR 16 Ca 0.02 -0.14 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 2c34 n THR 16 Cb 0.45 0.36 0.00 0.00 -1.55 0.00 0.00 70.33 69.59 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 -0.52 -0.17 -3.16 1.09 8.25 -1.26 -2.33 115.22 117.12 2c34 n HIS 17 Ca 0.02 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.09 2c34 n HIS 17 Cb 0.34 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.40 2c34 n HIS 17 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2c34 s VAL 18 N 0.09 4.98 -1.42 1.59 0.11 -1.26 -4.02 120.40 120.47 2c34 s VAL 18 Ca 0.00 1.28 0.00 0.00 -2.93 0.00 0.00 61.98 60.33 2c34 s VAL 18 Cb 0.00 -3.95 0.00 0.00 -1.53 0.00 0.00 36.38 30.90 2c34 s VAL 18 CO 0.00 0.35 0.00 0.61 -3.33 0.00 0.00 175.10 172.73 2c34 n GLY 19 N 2.76 1.27 3.57 6.54 0.00 0.28 -4.80 105.19 114.80 2c34 n GLY 19 Ca -0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.10 1.70 -0.80 1.61 2.47 -1.26 -4.69 119.74 115.68 2c34 s LYS 20 Ca 0.00 -0.18 -0.25 0.00 -1.56 0.00 0.00 55.97 53.98 2c34 s LYS 20 Cb 0.00 -4.96 -0.18 0.00 -1.46 0.00 0.00 37.83 31.23 2c34 s LYS 20 CO 0.00 -4.62 2.47 2.41 0.16 0.00 0.00 175.35 175.77 2c34 n THR 21 N 8.62 -0.03 -3.11 3.43 -1.04 -1.25 -4.55 114.28 116.35 2c34 n THR 21 Ca 0.44 -0.43 -0.45 0.00 -2.04 0.00 0.00 64.05 61.57 2c34 n THR 21 Cb 0.45 -1.42 -0.04 0.00 -1.82 0.00 0.00 70.33 67.50 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 9.53 4.82 0.10 12.58 2.01 -0.91 -4.85 115.64 138.93 2c34 s THR 22 Ca 1.16 -1.02 -0.30 0.00 0.31 0.00 0.00 61.69 61.84 2c34 s THR 22 Cb -0.65 -4.50 -0.06 0.00 0.01 0.00 0.00 72.50 67.30 2c34 s THR 22 CO 0.36 -1.13 1.10 -0.70 -0.69 0.00 0.00 174.62 173.56 2c34 s GLU 23 N 2.67 4.54 -0.31 4.92 2.12 -1.26 -2.39 118.70 128.99 2c34 s GLU 23 Ca 0.12 1.66 -0.01 0.00 0.36 0.00 0.00 54.97 57.10 2c34 s GLU 23 Cb -0.24 -3.34 0.10 0.00 0.26 0.00 0.00 34.13 30.91 2c34 s GLU 23 CO 0.06 -0.04 0.11 0.42 -0.54 0.00 0.00 175.26 175.26 2c34 s ILE 24 N 0.41 0.77 -0.75 -3.70 1.01 -0.47 -4.96 121.20 113.51 2c34 s ILE 24 Ca 0.53 -1.36 -0.24 0.00 0.00 0.00 0.00 60.65 59.58 2c34 s ILE 24 Cb -0.27 -1.59 0.06 0.00 0.01 0.00 0.00 42.46 40.67 2c34 s ILE 24 CO 0.31 -0.69 1.16 -1.00 0.00 0.00 0.00 174.94 174.72 2c34 s HIS 25 N 1.64 2.53 0.15 3.97 3.76 -1.26 -2.29 115.29 123.79 2c34 s HIS 25 Ca 0.10 -0.44 -0.08 0.00 -0.15 0.00 0.00 55.06 54.49 2c34 s HIS 25 Cb -0.17 -4.47 -0.06 0.00 1.11 0.00 0.00 32.58 28.98 2c34 s HIS 25 CO -0.26 -1.85 0.45 -0.51 -0.85 0.00 0.00 174.74 171.72 2c34 s LEU 26 N 4.75 4.26 0.28 0.89 1.43 -0.97 -4.89 118.68 124.43 2c34 s LEU 26 Ca 0.31 0.78 0.06 0.00 -1.03 0.00 0.00 54.13 54.25 2c34 s LEU 26 Cb -0.11 -3.33 -0.02 0.00 0.03 0.00 0.00 46.19 42.76 2c34 s LEU 26 CO 0.09 0.05 0.35 -0.54 0.23 0.00 0.00 176.35 176.53 2c34 s LYS 27 N -2.45 3.15 0.00 1.70 1.02 -1.26 -1.82 119.74 120.08 2c34 s LYS 27 Ca 0.40 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.43 2c34 s LYS 27 Cb -0.13 -2.75 0.00 0.00 -0.52 0.00 0.00 37.83 34.43 2c34 s LYS 27 CO 0.21 0.27 0.00 0.41 -0.92 0.00 0.00 175.35 175.32 2c34 n GLY 28 N -1.43 -0.84 2.98 -3.33 0.00 -1.26 -4.94 105.19 96.38 2c34 n GLY 28 Ca -0.05 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.46 0.60 1.61 2.47 -1.26 -4.91 114.94 108.99 2c34 s ASN 29 Ca 0.00 -0.08 0.28 0.00 0.42 0.00 0.00 52.86 53.47 2c34 s ASN 29 Cb 0.00 0.94 1.36 0.00 -1.45 0.00 0.00 41.25 42.10 2c34 s ASN 29 CO 0.00 -0.07 1.77 -0.65 -3.72 0.00 0.00 177.10 174.43 2c34 h PRO 30 N 6.45 0.00 -0.54 0.43 0.11 -1.83 0.72 132.00 137.34 2c34 h PRO 30 Ca -0.06 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.03 2c34 h PRO 30 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 2c34 h PRO 30 CO -0.07 0.00 0.23 1.15 -0.21 0.00 0.00 178.00 179.10 2c34 h THR 31 N 0.00 1.19 0.49 -1.15 2.02 -1.91 -3.14 112.91 110.41 2c34 h THR 31 Ca 0.23 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 2c34 h THR 31 Cb 1.45 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.37 2c34 h THR 31 CO -0.00 0.23 -0.50 0.71 0.37 0.00 0.00 175.52 176.33 2c34 h THR 32 N 0.76 0.00 0.00 3.16 1.35 -1.27 -3.47 112.91 113.44 2c34 h THR 32 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.05 2c34 h THR 32 Cb 0.12 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.54 2c34 h THR 32 CO -0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.86 2c34 n GLY 33 N -1.55 1.52 2.49 5.82 0.00 -1.19 -5.15 105.19 107.13 2c34 n GLY 33 Ca -0.12 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.81 -3.70 1.61 4.02 -1.26 -4.49 117.16 109.53 2c34 n TYR 34 Ca 0.00 -0.83 -0.13 0.00 -0.01 0.00 0.00 57.90 56.92 2c34 n TYR 34 Cb 0.00 -0.62 -0.07 0.00 -0.02 0.00 0.00 39.34 38.63 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 -4.72 0.83 -0.84 -0.72 -2.45 0.50 -4.66 119.30 107.24 2c34 s MET 35 Ca 0.47 -0.25 -0.06 0.00 -1.25 0.00 0.00 55.69 54.60 2c34 s MET 35 Cb -0.01 0.37 0.21 0.00 1.25 0.00 0.00 34.83 36.65 2c34 s MET 35 CO 0.33 -0.26 0.74 -1.58 1.05 0.00 0.00 175.02 175.30 2c34 s TRP 36 N -1.92 3.79 0.00 4.11 0.52 -1.26 -1.37 118.94 122.81 2c34 s TRP 36 Ca -0.09 -2.66 0.00 0.00 0.02 0.00 0.00 56.10 53.37 2c34 s TRP 36 Cb -0.02 -3.45 0.00 0.00 -1.15 0.00 0.00 33.47 28.84 2c34 s TRP 36 CO 0.01 -0.86 0.00 -2.37 0.02 0.00 0.00 176.95 173.76 2c34 n THR 37 N 3.07 0.00 -3.38 2.01 5.66 -1.04 -4.90 114.28 115.70 2c34 n THR 37 Ca 0.16 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.78 2c34 n THR 37 Cb 0.40 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.12 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 -0.08 4.07 0.21 1.09 0.52 -1.26 -0.68 118.95 122.82 2c34 s ARG 38 Ca 0.00 0.58 -0.32 0.00 -0.52 0.00 0.00 55.73 55.46 2c34 s ARG 38 Cb 0.00 -3.24 -0.14 0.00 0.52 0.00 0.00 34.95 32.09 2c34 s ARG 38 CO 0.00 0.64 1.42 0.28 0.02 0.00 0.00 175.30 177.66 2c34 n VAL 39 N 1.85 0.68 0.00 3.52 0.31 0.88 -1.72 118.33 123.85 2c34 n VAL 39 Ca -0.12 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2c34 n VAL 39 Cb 0.52 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 2c34 n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c34 n GLY 40 N 2.44 1.04 0.12 2.92 0.00 -1.26 -4.58 105.19 105.88 2c34 n GLY 40 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 0.03 -1.48 1.61 3.72 -0.78 -4.86 117.46 115.70 2c34 n PHE 41 Ca 0.00 -0.02 -0.49 0.00 -0.05 0.00 0.00 57.45 56.90 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 -0.59 0.23 0.00 -4.37 0.31 -0.70 -0.65 118.33 112.55 2c34 n VAL 42 Ca 0.16 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2c34 n VAL 42 Cb 0.13 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.18 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 6.36 1.86 0.00 2.92 0.00 -1.26 -4.93 105.19 110.13 2c34 n GLY 43 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.40 2c34 n GLY 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c34 n LYS 44 N -0.01 0.91 -0.00 1.61 5.02 0.17 -5.08 118.16 120.79 2c34 n LYS 44 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.25 2c34 n LYS 44 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 2c34 n LYS 44 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2c34 n ASP 45 N -0.98 1.12 0.06 4.39 -0.08 -1.26 -4.83 116.55 114.97 2c34 n ASP 45 Ca 0.00 0.17 -0.18 0.00 -1.51 0.00 0.00 54.79 53.26 2c34 n ASP 45 Cb 0.00 -0.39 -0.14 0.00 2.34 0.00 0.00 41.12 42.93 2c34 n ASP 45 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2c34 h VAL 46 N -0.27 1.04 0.00 5.18 2.07 -1.88 -3.37 116.25 119.02 2c34 h VAL 46 Ca -0.05 -2.68 0.00 0.00 0.82 0.00 0.00 66.70 64.79 2c34 h VAL 46 Cb 0.52 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 2c34 h VAL 46 CO -0.03 0.82 0.00 0.18 0.02 0.00 0.00 177.57 178.55 2c34 n LEU 47 N -3.47 0.00 0.00 2.57 4.77 -1.26 -4.12 117.00 115.49 2c34 n LEU 47 Ca -0.20 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.65 2c34 n LEU 47 Cb 1.05 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 42.28 2c34 n LEU 47 CO 0.50 0.00 0.15 -0.24 -1.33 0.00 0.00 177.39 176.47 2c34 n SER 48 N 2.01 -2.95 0.00 -1.43 2.88 -1.26 -4.87 113.62 108.00 2c34 n SER 48 Ca 0.00 -0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.15 2c34 n SER 48 Cb 0.00 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.01 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 -4.11 0.00 0.00 -3.46 9.92 -1.26 -4.97 116.55 112.67 2c34 n ASP 49 Ca 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.32 2c34 n ASP 49 Cb 0.27 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 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 -0.64 1.12 0.00 -1.24 0.28 -1.26 -4.99 120.64 113.91 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 -0.57 0.00 0.00 1.43 0.00 0.00 31.44 32.30 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 -0.66 0.00 -3.24 3.84 2.08 -1.26 -4.51 119.36 115.61 2c34 n ILE 51 Ca 0.00 0.13 -0.44 0.00 0.56 0.00 0.00 62.75 63.00 2c34 n ILE 51 Cb 0.06 -0.32 -0.07 0.00 -0.75 0.00 0.00 39.64 38.56 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 -0.34 5.14 0.54 1.39 0.20 -1.26 -0.31 118.68 124.04 2c34 s LEU 52 Ca 0.00 -1.00 -0.22 0.00 0.69 0.00 0.00 54.13 53.61 2c34 s LEU 52 Cb 0.00 -2.37 -0.06 0.00 -0.43 0.00 0.00 46.19 43.34 2c34 s LEU 52 CO 0.00 -0.78 1.25 1.21 -0.29 0.00 0.00 176.35 177.74 2c34 n GLU 53 N 5.82 1.52 -3.39 1.98 0.00 0.33 -4.39 120.64 122.51 2c34 n GLU 53 Ca -0.08 0.56 -0.21 0.00 0.00 0.00 0.00 57.16 57.43 2c34 n GLU 53 Cb 0.45 -2.44 -0.09 0.00 0.00 0.00 0.00 31.44 29.36 2c34 n GLU 53 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2c34 s VAL 54 N -1.32 -0.20 -1.12 6.31 1.01 -1.24 -0.11 120.40 123.73 2c34 s VAL 54 Ca 0.71 -1.16 -0.22 0.00 0.00 0.00 0.00 61.98 61.32 2c34 s VAL 54 Cb -0.43 -0.82 0.02 0.00 0.00 0.00 0.00 36.38 35.15 2c34 s VAL 54 CO 0.50 -0.69 1.69 -0.69 0.00 0.00 0.00 175.10 175.90 2c34 s VAL 55 N 1.39 3.86 0.04 2.92 1.01 0.14 -4.27 120.40 125.50 2c34 s VAL 55 Ca 0.17 -1.11 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 2c34 s VAL 55 Cb -0.17 -4.88 -0.05 0.00 0.00 0.00 0.00 36.38 31.28 2c34 s VAL 55 CO -0.04 -1.69 1.16 0.00 0.00 0.00 0.00 175.10 174.53 2c34 n LYS 57 N 4.01 1.63 -1.83 0.00 5.02 0.12 -4.82 118.16 122.29 2c34 n LYS 57 Ca 0.09 -3.92 -0.40 0.00 -2.02 0.00 0.00 58.31 52.06 2c34 n LYS 57 Cb 0.47 -1.74 -0.03 0.00 -0.02 0.00 0.00 35.03 33.71 2c34 n LYS 57 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2c34 s TYR 58 N -1.96 1.46 -0.32 2.13 6.14 -1.26 -2.31 117.35 121.23 2c34 s TYR 58 Ca 0.38 0.94 -0.09 0.00 0.64 0.00 0.00 57.07 58.95 2c34 s TYR 58 Cb 0.18 -3.93 0.00 0.00 0.42 0.00 0.00 41.96 38.64 2c34 s TYR 58 CO -0.07 -2.78 0.14 0.99 0.64 0.00 0.00 175.55 174.47 2c34 s THR 59 N 9.34 4.39 -0.63 4.34 2.01 -0.69 -4.98 115.64 129.43 2c34 s THR 59 Ca 0.84 -0.59 -0.02 0.00 0.31 0.00 0.00 61.69 62.22 2c34 s THR 59 Cb -0.19 -3.29 0.38 0.00 0.01 0.00 0.00 72.50 69.40 2c34 s THR 59 CO 0.27 0.01 2.07 -0.81 -0.69 0.00 0.00 174.62 175.47 2c34 n PRO 60 N 4.95 2.54 -1.26 4.92 -0.04 -1.26 0.42 135.00 145.26 2c34 n PRO 60 Ca -0.14 -3.00 -0.43 0.00 -0.04 0.00 0.00 63.50 59.89 2c34 n PRO 60 Cb 0.48 -2.17 -0.03 0.00 -0.04 0.00 0.00 33.50 31.74 2c34 n PRO 60 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2c34 n THR 61 N -0.57 1.76 -1.55 0.52 -1.04 -1.26 -1.94 114.28 110.20 2c34 n THR 61 Ca 0.56 -0.44 -0.42 0.00 -2.04 0.00 0.00 64.05 61.71 2c34 n THR 61 Cb 0.57 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 69.09 2c34 n THR 61 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2c34 n PRO 62 N 0.91 1.06 -2.56 -2.82 -0.02 -1.26 -0.61 135.00 129.69 2c34 n PRO 62 Ca 0.16 0.38 -0.23 0.00 -2.02 0.00 0.00 63.50 61.80 2c34 n PRO 62 Cb 0.22 -1.82 0.07 0.00 -0.02 0.00 0.00 33.50 31.94 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 -0.80 4.88 -0.16 2.55 0.15 -0.38 -4.64 113.70 115.30 2c34 s SER 63 Ca 0.63 -0.07 0.11 0.00 0.70 0.00 0.00 55.95 57.32 2c34 s SER 63 Cb -0.60 -0.61 0.58 0.00 -1.71 0.00 0.00 66.02 63.69 2c34 s SER 63 CO 0.57 -1.46 1.40 -1.20 1.20 0.00 0.00 173.24 173.75 2c34 n SER 64 N -2.60 4.30 -4.64 5.45 7.64 -1.26 -4.68 113.62 117.84 2c34 n SER 64 Ca 0.10 -2.62 -0.34 0.00 1.01 0.00 0.00 58.87 57.02 2c34 n SER 64 Cb 0.60 -0.61 0.11 0.00 -1.01 0.00 0.00 64.21 63.29 2c34 n SER 64 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2c34 n THR 65 N 0.50 2.30 1.41 0.44 -2.24 -1.26 -4.85 114.28 110.58 2c34 n THR 65 Ca 0.20 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2c34 n THR 65 Cb 0.90 -1.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 2c34 n THR 65 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2c34 n PRO 66 N -2.49 0.76 0.00 -0.78 -0.04 -1.26 -4.69 135.00 126.50 2c34 n PRO 66 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2c34 n PRO 66 Cb 0.50 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 2c34 n PRO 66 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c34 n MET 67 N -0.41 0.00 -3.86 0.54 0.00 -1.26 -5.13 117.12 107.00 2c34 n MET 67 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 57.70 57.34 2c34 n MET 67 Cb 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 33.22 33.14 2c34 n MET 67 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 2c34 s VAL 68 N 2.44 4.58 -0.07 3.17 1.01 -1.26 -5.07 120.40 125.19 2c34 s VAL 68 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 2c34 s VAL 68 Cb 0.00 -3.11 0.03 0.00 0.00 0.00 0.00 36.38 33.30 2c34 s VAL 68 CO 0.00 0.38 0.18 -0.83 0.00 0.00 0.00 175.10 174.83 2c34 s GLY 69 N 1.13 -0.09 -0.41 4.51 0.00 -1.26 -4.94 107.32 106.26 2c34 s GLY 69 Ca 0.05 0.70 0.05 0.00 0.00 0.00 0.00 44.72 45.52 2c34 s GLY 69 CO 0.03 0.90 0.38 -0.62 0.00 0.00 0.00 173.10 173.80 2c34 n VAL 70 N 3.87 -1.05 -3.71 1.40 0.31 -1.26 -1.25 118.33 116.64 2c34 n VAL 70 Ca -0.22 -3.58 -0.15 0.00 -0.01 0.00 0.00 64.34 60.38 2c34 n VAL 70 Cb 0.54 -1.73 -0.15 0.00 -0.91 0.00 0.00 33.84 31.59 2c34 n VAL 70 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2c34 s GLY 71 N -0.25 -0.01 0.00 2.92 0.00 0.22 -4.62 107.32 105.57 2c34 s GLY 71 Ca 0.33 0.67 0.00 0.00 0.00 0.00 0.00 44.72 45.73 2c34 s GLY 71 CO -0.18 1.36 0.00 0.61 0.00 0.00 0.00 173.10 174.89 2c34 n GLY 72 N 4.74 1.85 0.00 0.20 0.00 -1.10 -4.21 105.19 106.68 2c34 n GLY 72 Ca -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.67 -0.61 -5.35 0.17 -4.34 119.36 105.56 2c34 n ILE 73 Ca 0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.18 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 -1.96 1.35 -0.68 4.28 1.51 -0.76 -1.70 117.35 119.39 2c34 s TYR 74 Ca 0.00 -1.59 -0.24 0.00 -1.01 0.00 0.00 57.07 54.23 2c34 s TYR 74 Cb 0.00 -1.49 0.06 0.00 -0.11 0.00 0.00 41.96 40.42 2c34 s TYR 74 CO 0.00 -0.86 1.05 0.08 -1.11 0.00 0.00 175.55 174.72 2c34 s VAL 75 N 1.58 4.15 -0.31 0.71 1.01 -0.98 -2.30 120.40 124.27 2c34 s VAL 75 Ca 0.11 -0.14 -0.10 0.00 0.00 0.00 0.00 61.98 61.84 2c34 s VAL 75 Cb -0.18 -4.75 -0.01 0.00 0.00 0.00 0.00 36.38 31.43 2c34 s VAL 75 CO -0.24 -1.57 0.16 -0.69 0.00 0.00 0.00 175.10 172.76 2c34 s VAL 76 N 4.54 4.73 -0.40 2.92 1.01 -0.97 0.11 120.40 132.33 2c34 s VAL 76 Ca 0.26 -0.32 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 2c34 s VAL 76 Cb -0.14 -3.38 0.04 0.00 0.00 0.00 0.00 36.38 32.90 2c34 s VAL 76 CO 0.12 0.10 0.26 -0.76 0.00 0.00 0.00 175.10 174.81 2c34 s LEU 77 N 1.64 4.99 -0.42 3.92 1.43 -0.91 -1.37 118.68 127.95 2c34 s LEU 77 Ca 0.05 -1.08 -0.15 0.00 -1.03 0.00 0.00 54.13 51.92 2c34 s LEU 77 Cb -0.17 -2.07 0.03 0.00 0.03 0.00 0.00 46.19 44.01 2c34 s LEU 77 CO 0.07 -0.45 0.33 -0.69 0.23 0.00 0.00 176.35 175.83 2c34 s VAL 78 N 1.58 5.25 -0.48 -1.59 1.01 -1.01 0.28 120.40 125.44 2c34 s VAL 78 Ca 0.03 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 2c34 s VAL 78 Cb -0.20 -3.98 0.13 0.00 0.00 0.00 0.00 36.38 32.33 2c34 s VAL 78 CO 0.07 -0.38 0.27 -0.54 0.00 0.00 0.00 175.10 174.53 2c34 s LYS 79 N 1.69 2.14 -0.44 2.72 1.02 0.85 -2.14 119.74 125.58 2c34 s LYS 79 Ca 0.05 -2.13 -0.31 0.00 0.02 0.00 0.00 55.97 53.59 2c34 s LYS 79 Cb -0.20 -3.58 -0.10 0.00 -0.52 0.00 0.00 37.83 33.43 2c34 s LYS 79 CO 0.09 -1.10 2.31 -0.35 -0.92 0.00 0.00 175.35 175.39 2c34 n PRO 80 N 4.06 1.09 0.16 -1.68 -0.04 -1.26 -0.51 135.00 136.82 2c34 n PRO 80 Ca 0.02 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 2c34 n PRO 80 Cb 0.39 -2.72 0.26 0.00 -0.04 0.00 0.00 33.50 31.39 2c34 n PRO 80 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c34 h ARG 81 N 14.59 0.02 0.00 0.54 3.08 -0.91 0.82 114.38 132.52 2c34 h ARG 81 Ca -0.26 -0.01 -0.46 0.00 0.07 0.00 0.00 59.98 59.32 2c34 h ARG 81 Cb 1.29 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.25 2c34 h ARG 81 CO 1.09 0.51 -0.35 1.63 -1.07 0.00 0.00 179.97 181.78 2c34 n LYS 82 N -3.96 0.96 -4.75 0.04 5.02 -1.15 -4.90 118.16 109.43 2c34 n LYS 82 Ca -0.02 -2.64 -0.31 0.00 -2.02 0.00 0.00 58.31 53.33 2c34 n LYS 82 Cb 0.51 0.94 -0.13 0.00 -0.02 0.00 0.00 35.03 36.32 2c34 n LYS 82 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2c34 s ARG 83 N -3.27 1.99 0.00 1.97 0.52 -1.26 -4.85 118.95 114.05 2c34 s ARG 83 Ca 0.05 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 2c34 s ARG 83 Cb 0.00 -2.12 0.00 0.00 0.52 0.00 0.00 34.95 33.35 2c34 s ARG 83 CO 0.04 0.53 0.00 0.41 0.02 0.00 0.00 175.30 176.30 2c34 n GLY 84 N 1.65 0.55 3.22 -3.53 0.00 0.63 -4.99 105.19 102.71 2c34 n GLY 84 Ca -0.16 -1.02 -0.42 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 0.00 3.56 0.32 1.61 3.76 -1.26 -0.59 115.29 122.70 2c34 s HIS 85 Ca 0.00 -2.25 0.08 0.00 -0.15 0.00 0.00 55.06 52.73 2c34 s HIS 85 Cb 0.00 -3.53 -0.03 0.00 1.11 0.00 0.00 32.58 30.13 2c34 s HIS 85 CO 0.00 -0.93 0.23 -1.01 -0.85 0.00 0.00 174.74 172.18 2c34 s HIS 86 N 0.25 2.87 0.10 1.40 3.76 -0.70 -4.99 115.29 117.99 2c34 s HIS 86 Ca 0.16 -0.29 -0.25 0.00 -0.15 0.00 0.00 55.06 54.52 2c34 s HIS 86 Cb -0.17 -1.68 0.07 0.00 1.11 0.00 0.00 32.58 31.91 2c34 s HIS 86 CO -0.05 0.28 0.63 0.99 -0.85 0.00 0.00 174.74 175.74 2c34 s THR 87 N -2.31 0.00 -0.58 1.30 2.01 -1.26 -1.21 115.64 113.58 2c34 s THR 87 Ca 0.39 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.42 2c34 s THR 87 Cb -0.05 -1.00 0.14 0.00 0.01 0.00 0.00 72.50 71.60 2c34 s THR 87 CO 0.25 0.00 0.34 -0.22 -0.69 0.00 0.00 174.62 174.31 2c34 s LEU 88 N -2.31 4.55 -0.73 4.42 2.96 0.35 -4.85 118.68 123.07 2c34 s LEU 88 Ca -0.02 -3.21 -0.26 0.00 -0.22 0.00 0.00 54.13 50.43 2c34 s LEU 88 Cb -0.01 -1.67 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 2c34 s LEU 88 CO -0.07 -0.21 1.91 -1.61 -1.32 0.00 0.00 176.35 175.06 2c34 s GLU 89 N -0.56 2.57 -0.18 1.98 2.02 -1.26 -1.37 118.70 121.91 2c34 s GLU 89 Ca 0.19 0.26 -0.05 0.00 0.02 0.00 0.00 54.97 55.40 2c34 s GLU 89 Cb -0.20 -4.67 -0.03 0.00 0.10 0.00 0.00 34.13 29.33 2c34 s GLU 89 CO -0.04 -3.03 -0.01 -0.51 0.02 0.00 0.00 175.26 171.69 2c34 s LEU 90 N 9.62 3.28 0.11 1.80 1.43 -0.68 -0.09 118.68 134.15 2c34 s LEU 90 Ca 0.69 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 2c34 s LEU 90 Cb -0.10 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2c34 s LEU 90 CO 0.12 0.12 -0.09 0.54 0.23 0.00 0.00 176.35 177.26 2c34 s VAL 91 N 0.68 0.95 -0.87 -1.59 0.11 0.14 -0.07 120.40 119.75 2c34 s VAL 91 Ca -0.01 -1.78 -0.14 0.00 -2.93 0.00 0.00 61.98 57.13 2c34 s VAL 91 Cb -0.14 -1.51 0.22 0.00 -1.53 0.00 0.00 36.38 33.42 2c34 s VAL 91 CO 0.02 -0.65 0.84 -0.47 -3.33 0.00 0.00 175.10 171.51 2c34 s TYR 92 N -2.82 3.78 0.39 1.54 5.04 -0.98 -2.50 117.35 121.80 2c34 s TYR 92 Ca 0.09 -2.03 0.07 0.00 -2.44 0.00 0.00 57.07 52.75 2c34 s TYR 92 Cb -0.00 -3.86 -0.08 0.00 0.35 0.00 0.00 41.96 38.37 2c34 s TYR 92 CO -0.01 -1.03 0.01 -0.08 -1.34 0.00 0.00 175.55 173.10 2c34 s THR 93 N 0.19 1.89 -0.64 4.34 -1.32 -0.47 -3.93 115.64 115.70 2c34 s THR 93 Ca 0.21 -2.02 -0.14 0.00 -1.21 0.00 0.00 61.69 58.53 2c34 s THR 93 Cb -0.10 -2.92 0.16 0.00 -1.51 0.00 0.00 72.50 68.14 2c34 s THR 93 CO -0.09 -0.03 0.57 -0.13 -2.21 0.00 0.00 174.62 172.74 2c34 s ARG 94 N -3.73 3.13 0.54 7.08 0.52 -1.22 0.19 118.95 125.46 2c34 s ARG 94 Ca 0.35 -2.03 0.42 0.00 -0.52 0.00 0.00 55.73 53.94 2c34 s ARG 94 Cb 0.09 -4.27 1.61 0.00 0.52 0.00 0.00 34.95 32.90 2c34 s ARG 94 CO 0.17 -1.29 1.69 -1.35 0.02 0.00 0.00 175.30 174.54 2c34 h PRO 95 N 8.34 0.02 -0.13 3.54 0.11 -1.88 0.65 132.00 142.65 2c34 h PRO 95 Ca -0.13 -0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.77 2c34 h PRO 95 Cb 1.07 -0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.18 2c34 h PRO 95 CO 0.90 0.01 -0.76 0.74 -0.21 0.00 0.00 178.00 178.68 2c34 h PHE 96 N 0.02 1.02 0.00 0.65 -1.00 -1.91 -3.42 116.94 112.30 2c34 h PHE 96 Ca 0.75 -0.46 0.00 0.00 2.81 0.00 0.00 57.97 61.07 2c34 h PHE 96 Cb 2.92 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 42.33 2c34 h PHE 96 CO -0.00 1.29 0.00 0.39 -1.61 0.00 0.00 178.31 178.38 2c34 n GLU 97 N -3.98 0.00 0.00 1.51 -0.58 0.19 -5.14 120.64 112.64 2c34 n GLU 97 Ca -0.08 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2c34 n GLU 97 Cb 0.74 -0.27 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 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 2.14 0.94 3.86 0.62 0.00 0.85 -5.00 105.19 108.59 2c34 n GLY 98 Ca 0.00 -1.13 -0.32 0.00 0.00 0.00 0.00 46.02 44.57 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 4.72 0.17 -0.61 1.01 -1.26 -3.39 121.20 119.84 2c34 s ILE 99 Ca 0.00 0.82 -0.06 0.00 0.00 0.00 0.00 60.65 61.40 2c34 s ILE 99 Cb 0.00 -3.65 -0.02 0.00 0.01 0.00 0.00 42.46 38.80 2c34 s ILE 99 CO 0.00 -0.31 0.22 -0.54 0.00 0.00 0.00 174.94 174.32 2c34 s LYS 100 N -3.30 1.14 0.12 2.79 1.02 -1.26 -5.05 119.74 115.19 2c34 s LYS 100 Ca 0.53 -1.30 -0.18 0.00 0.02 0.00 0.00 55.97 55.04 2c34 s LYS 100 Cb -0.10 0.34 -0.05 0.00 -0.52 0.00 0.00 37.83 37.50 2c34 s LYS 100 CO 0.23 -0.40 1.68 -1.35 -0.92 0.00 0.00 175.35 174.59 2c34 h PRO 101 N 2.61 0.43 -0.18 -1.68 0.11 -1.99 -2.65 132.00 128.66 2c34 h PRO 101 Ca -0.33 -0.07 0.05 0.00 0.11 0.00 0.00 66.00 65.77 2c34 h PRO 101 Cb 1.22 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2c34 h PRO 101 CO 0.50 0.43 0.13 1.05 -0.21 0.00 0.00 178.00 179.90 2c34 h GLU 102 N 0.34 0.00 -6.72 1.05 4.11 -1.97 -3.43 114.58 107.95 2c34 h GLU 102 Ca 0.10 0.00 -0.58 0.00 0.07 0.00 0.00 59.36 58.95 2c34 h GLU 102 Cb 0.15 0.00 0.14 0.00 0.50 0.00 0.00 28.75 29.54 2c34 h GLU 102 CO -0.01 0.00 0.15 0.09 0.07 0.00 0.00 179.01 179.31 2c34 n ASN 103 N -4.45 1.08 -4.59 3.06 5.03 -1.00 -4.93 115.26 109.46 2c34 n ASN 103 Ca 0.01 0.94 -0.30 0.00 0.87 0.00 0.00 54.58 56.11 2c34 n ASN 103 Cb 0.27 -1.37 0.21 0.00 -1.02 0.00 0.00 39.78 37.86 2c34 n ASN 103 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2c34 s GLU 104 N -2.30 0.09 0.19 3.52 8.01 -1.25 -4.82 118.70 122.14 2c34 s GLU 104 Ca 0.68 1.22 0.04 0.00 0.01 0.00 0.00 54.97 56.92 2c34 s GLU 104 Cb -0.49 -1.64 -0.05 0.00 -4.31 0.00 0.00 34.13 27.63 2c34 s GLU 104 CO 0.53 -3.16 -0.05 0.50 0.01 0.00 0.00 175.26 173.10 2c34 s ARG 105 N -4.56 1.20 -0.36 1.61 6.06 -1.26 -2.32 118.95 119.32 2c34 s ARG 105 Ca 0.68 -1.56 -0.02 0.00 -2.50 0.00 0.00 55.73 52.32 2c34 s ARG 105 Cb -0.24 -0.59 0.26 0.00 0.06 0.00 0.00 34.95 34.44 2c34 s ARG 105 CO 0.61 -0.02 1.17 0.98 -2.50 0.00 0.00 175.30 175.54 2c34 n TYR 106 N -0.31 -0.98 -3.02 5.12 9.36 0.90 -4.65 117.16 123.59 2c34 n TYR 106 Ca -0.07 -0.85 -0.45 0.00 3.32 0.00 0.00 57.90 59.85 2c34 n TYR 106 Cb 0.62 1.16 -0.03 0.00 -0.63 0.00 0.00 39.34 40.47 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 0.28 4.91 -0.82 2.97 2.01 -1.26 -1.69 115.64 122.04 2c34 s THR 107 Ca 0.27 -1.69 -0.25 0.00 0.31 0.00 0.00 61.69 60.32 2c34 s THR 107 Cb 0.20 -4.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.00 2c34 s THR 107 CO -0.11 -1.38 1.79 -0.22 -0.69 0.00 0.00 174.62 174.01 2c34 s LEU 108 N 2.19 3.25 0.35 4.42 2.96 -0.47 -1.39 118.68 129.99 2c34 s LEU 108 Ca 0.28 -0.48 -0.25 0.00 -0.22 0.00 0.00 54.13 53.45 2c34 s LEU 108 Cb -0.07 -2.55 -0.10 0.00 0.50 0.00 0.00 46.19 43.96 2c34 s LEU 108 CO -0.08 -2.38 0.97 -1.00 -1.32 0.00 0.00 176.35 172.54 2c34 s HIS 109 N 8.66 3.56 -0.21 5.38 3.76 0.95 -0.50 115.29 136.90 2c34 s HIS 109 Ca 0.63 1.73 -0.04 0.00 -0.15 0.00 0.00 55.06 57.23 2c34 s HIS 109 Cb -0.07 -2.96 0.10 0.00 1.11 0.00 0.00 32.58 30.75 2c34 s HIS 109 CO 0.05 -0.00 0.24 -0.51 -0.85 0.00 0.00 174.74 173.67 2c34 s LEU 110 N -2.29 -0.17 -1.43 0.89 1.43 -0.35 -2.13 118.68 114.62 2c34 s LEU 110 Ca 0.53 -0.17 -0.13 0.00 -1.03 0.00 0.00 54.13 53.33 2c34 s LEU 110 Cb -0.18 0.47 0.06 0.00 0.03 0.00 0.00 46.19 46.57 2c34 s LEU 110 CO 0.23 -0.32 2.20 -3.20 0.23 0.00 0.00 176.35 175.50 2c34 n ASN 111 N 5.32 4.45 -4.65 2.29 4.05 0.14 -1.72 115.26 125.15 2c34 n ASN 111 Ca -0.05 -2.88 -0.56 0.00 0.45 0.00 0.00 54.58 51.53 2c34 n ASN 111 Cb 0.50 -1.61 -0.07 0.00 1.23 0.00 0.00 39.78 39.82 2c34 n ASN 111 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 2c34 n VAL 112 N 4.61 0.29 1.80 3.44 0.31 0.25 -3.79 118.33 125.23 2c34 n VAL 112 Ca 0.51 -0.09 0.15 0.00 -0.01 0.00 0.00 64.34 64.91 2c34 n VAL 112 Cb 0.37 -1.28 0.78 0.00 -0.91 0.00 0.00 33.84 32.80 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80