#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 -4.63 1.61 2.88 -1.26 -5.08 113.62 107.15 2c34 n SER -1 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 2c34 n SER -1 Cb 0.00 0.08 -0.05 0.00 -0.75 0.00 0.00 64.21 63.49 2c34 n SER -1 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2c34 s HIS 0 N -1.38 3.26 0.49 0.66 2.46 -1.26 -5.05 115.29 114.47 2c34 s HIS 0 Ca 0.00 0.94 0.06 0.00 0.47 0.00 0.00 55.06 56.53 2c34 s HIS 0 Cb 0.00 -3.08 0.00 0.00 -0.13 0.00 0.00 32.58 29.37 2c34 s HIS 0 CO 0.00 -0.46 0.32 -1.64 -2.47 0.00 0.00 174.74 170.50 2c34 s MET 1 N 2.82 2.29 0.00 2.88 1.00 -1.26 -5.05 119.30 121.99 2c34 s MET 1 Ca 0.32 -1.91 0.07 0.00 0.00 0.00 0.00 55.69 54.17 2c34 s MET 1 Cb -0.15 -2.09 0.12 0.00 0.00 0.00 0.00 34.83 32.72 2c34 s MET 1 CO 0.10 -0.41 0.93 0.44 0.00 0.00 0.00 175.02 176.08 2c34 n ILE 2 N -1.57 0.46 -1.63 2.53 -5.35 -1.26 -5.01 119.36 107.53 2c34 n ILE 2 Ca -0.02 -0.73 -0.46 0.00 -0.27 0.00 0.00 62.75 61.28 2c34 n ILE 2 Cb 0.64 0.85 -0.04 0.00 -1.74 0.00 0.00 39.64 39.35 2c34 n ILE 2 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c34 n ALA 3 N 0.29 1.31 -1.49 -1.28 0.00 -1.26 -4.84 120.51 113.23 2c34 n ALA 3 Ca 0.06 0.09 -0.49 0.00 0.00 0.00 0.00 53.44 53.09 2c34 n ALA 3 Cb 0.26 -2.66 -0.06 0.00 0.00 0.00 0.00 19.45 16.99 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 7.61 1.31 0.00 0.00 -0.02 -1.26 -4.63 135.00 138.02 2c34 n PRO 4 Ca 0.26 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2c34 n PRO 4 Cb 0.35 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2c34 n PRO 4 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 2c34 n LEU 5 N 10.04 0.00 0.00 2.45 -0.00 -1.26 -4.91 117.00 123.32 2c34 n LEU 5 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.39 2c34 n LEU 5 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.70 2c34 n LEU 5 CO 0.74 0.08 0.00 -0.24 -0.00 0.00 0.00 177.39 177.97 2c34 n SER 6 N 0.00 0.00 0.01 1.45 2.88 -1.26 -4.58 113.62 112.12 2c34 n SER 6 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 2c34 n SER 6 Cb 0.15 0.00 0.58 0.00 -0.75 0.00 0.00 64.21 64.19 2c34 n SER 6 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2c34 n VAL 7 N 0.00 0.06 0.40 2.46 0.31 -1.26 -2.95 118.33 117.35 2c34 n VAL 7 Ca 0.00 -0.03 0.05 0.00 -0.01 0.00 0.00 64.34 64.35 2c34 n VAL 7 Cb 0.00 -0.47 0.04 0.00 -0.91 0.00 0.00 33.84 32.50 2c34 n VAL 7 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2c34 n LYS 8 N -1.58 0.34 -2.83 5.55 4.76 -1.26 -5.06 118.16 118.08 2c34 n LYS 8 Ca 0.07 -1.07 -0.02 0.00 -2.87 0.00 0.00 58.31 54.41 2c34 n LYS 8 Cb 0.35 -1.18 -0.02 0.00 -1.84 0.00 0.00 35.03 32.34 2c34 n LYS 8 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2c34 n ASP 9 N 0.54 -5.12 0.00 4.39 2.03 -1.15 -5.04 116.55 112.19 2c34 n ASP 9 Ca 0.06 1.14 0.00 0.00 0.52 0.00 0.00 54.79 56.51 2c34 n ASP 9 Cb 0.24 -3.95 0.00 0.00 -0.72 0.00 0.00 41.12 36.69 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 1.50 0.00 -4.54 1.67 6.94 -1.26 -4.90 115.26 114.67 2c34 n ASN 10 Ca -0.15 0.00 -0.32 0.00 -0.02 0.00 0.00 54.58 54.10 2c34 n ASN 10 Cb 0.31 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.66 2c34 n ASN 10 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2c34 n ASP 11 N 0.00 1.64 -4.32 0.53 9.92 -1.26 -3.82 116.55 119.24 2c34 n ASP 11 Ca 0.00 -0.57 -0.46 0.00 -0.53 0.00 0.00 54.79 53.22 2c34 n ASP 11 Cb 0.00 -1.42 -0.04 0.00 -0.64 0.00 0.00 41.12 39.02 2c34 n ASP 11 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2c34 s LYS 12 N 8.47 3.28 -0.65 -1.24 2.20 -0.59 -4.92 119.74 126.30 2c34 s LYS 12 Ca 1.06 -2.04 -0.25 0.00 -0.36 0.00 0.00 55.97 54.37 2c34 s LYS 12 Cb -0.40 -4.37 0.04 0.00 -1.51 0.00 0.00 37.83 31.60 2c34 s LYS 12 CO 0.29 -1.33 1.11 -1.58 -0.36 0.00 0.00 175.35 173.48 2c34 s TRP 13 N 1.00 2.55 0.01 4.03 0.52 -1.26 -0.22 118.94 125.56 2c34 s TRP 13 Ca 0.11 -0.09 -0.00 0.00 0.02 0.00 0.00 56.10 56.13 2c34 s TRP 13 Cb -0.20 -4.40 0.00 0.00 -1.15 0.00 0.00 33.47 27.72 2c34 s TRP 13 CO -0.03 -1.72 0.01 1.33 0.02 0.00 0.00 176.95 176.56 2c34 n VAL 14 N 6.27 0.00 -3.32 4.03 0.24 -0.92 -4.99 118.33 119.64 2c34 n VAL 14 Ca 0.02 -0.04 -0.14 0.00 -2.04 0.00 0.00 64.34 62.14 2c34 n VAL 14 Cb 0.48 0.02 0.03 0.00 -1.47 0.00 0.00 33.84 32.89 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 -2.25 1.66 -2.51 -1.34 9.92 -1.26 0.30 116.55 121.07 2c34 n ASP 15 Ca 0.00 -2.07 0.00 0.00 -0.53 0.00 0.00 54.79 52.19 2c34 n ASP 15 Cb 0.01 -0.17 0.01 0.00 -0.64 0.00 0.00 41.12 40.33 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 -1.61 0.00 -3.13 -3.53 5.66 -1.26 -4.49 114.28 105.92 2c34 n THR 16 Ca 0.06 -0.17 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 2c34 n THR 16 Cb 0.39 0.37 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 -0.48 -0.16 -3.64 1.09 8.25 -1.26 -3.16 115.22 115.85 2c34 n HIS 17 Ca 0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.11 2c34 n HIS 17 Cb 0.33 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.36 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 0.61 5.36 -0.97 1.59 1.01 -1.26 -4.28 120.40 122.46 2c34 s VAL 18 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2c34 s VAL 18 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.84 2c34 s VAL 18 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2c34 n GLY 19 N 3.61 0.89 3.57 4.51 0.00 0.40 -4.84 105.19 113.34 2c34 n GLY 19 Ca -0.14 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.74 1.77 -0.73 1.61 2.47 -1.26 -4.65 119.74 116.21 2c34 s LYS 20 Ca 0.00 -0.42 -0.31 0.00 -1.56 0.00 0.00 55.97 53.67 2c34 s LYS 20 Cb 0.00 -5.02 -0.16 0.00 -1.46 0.00 0.00 37.83 31.19 2c34 s LYS 20 CO 0.00 -4.64 2.51 2.41 0.16 0.00 0.00 175.35 175.79 2c34 n THR 21 N 8.53 0.00 -3.17 3.43 -1.04 -1.26 -4.60 114.28 116.17 2c34 n THR 21 Ca 0.43 -0.27 -0.45 0.00 -2.04 0.00 0.00 64.05 61.73 2c34 n THR 21 Cb 0.46 -1.32 -0.05 0.00 -1.82 0.00 0.00 70.33 67.61 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 9.49 4.93 0.02 12.58 2.01 -0.93 -4.87 115.64 138.87 2c34 s THR 22 Ca 1.20 -1.12 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 2c34 s THR 22 Cb -0.91 -4.44 -0.04 0.00 0.01 0.00 0.00 72.50 67.11 2c34 s THR 22 CO 0.44 -1.05 0.92 -0.70 -0.69 0.00 0.00 174.62 173.54 2c34 s GLU 23 N 2.39 4.57 -0.25 4.92 2.12 -1.25 -2.42 118.70 128.78 2c34 s GLU 23 Ca 0.09 1.32 -0.03 0.00 0.36 0.00 0.00 54.97 56.71 2c34 s GLU 23 Cb -0.26 -3.43 0.08 0.00 0.26 0.00 0.00 34.13 30.79 2c34 s GLU 23 CO 0.05 0.06 0.09 0.42 -0.54 0.00 0.00 175.26 175.34 2c34 s ILE 24 N 0.66 0.38 -0.65 -3.70 1.01 -0.54 -4.96 121.20 113.40 2c34 s ILE 24 Ca 0.48 -0.80 -0.23 0.00 0.00 0.00 0.00 60.65 60.09 2c34 s ILE 24 Cb -0.21 -1.14 0.06 0.00 0.01 0.00 0.00 42.46 41.18 2c34 s ILE 24 CO 0.27 -0.49 1.00 -1.00 0.00 0.00 0.00 174.94 174.71 2c34 s HIS 25 N 1.89 2.64 0.10 3.97 3.76 -1.26 -2.37 115.29 124.03 2c34 s HIS 25 Ca 0.05 -0.40 -0.06 0.00 -0.15 0.00 0.00 55.06 54.50 2c34 s HIS 25 Cb -0.17 -4.30 -0.05 0.00 1.11 0.00 0.00 32.58 29.17 2c34 s HIS 25 CO -0.21 -1.66 0.36 -0.51 -0.85 0.00 0.00 174.74 171.88 2c34 s LEU 26 N 4.26 4.31 0.28 0.89 1.43 -0.97 -4.89 118.68 123.99 2c34 s LEU 26 Ca 0.25 0.64 0.06 0.00 -1.03 0.00 0.00 54.13 54.05 2c34 s LEU 26 Cb -0.15 -3.11 -0.03 0.00 0.03 0.00 0.00 46.19 42.94 2c34 s LEU 26 CO 0.12 0.12 0.35 -0.54 0.23 0.00 0.00 176.35 176.63 2c34 s LYS 27 N -2.30 3.16 0.00 1.70 1.02 -1.26 -1.53 119.74 120.54 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 -0.13 -2.76 0.00 0.00 -0.52 0.00 0.00 37.83 34.43 2c34 s LYS 27 CO 0.21 0.29 0.00 0.41 -0.92 0.00 0.00 175.35 175.34 2c34 n GLY 28 N -1.42 -0.78 3.15 -3.33 0.00 -1.26 -4.94 105.19 96.61 2c34 n GLY 28 Ca -0.06 -0.31 0.05 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.42 0.64 1.61 2.47 -1.26 -4.76 114.94 109.22 2c34 s ASN 29 Ca 0.00 0.08 0.35 0.00 0.42 0.00 0.00 52.86 53.72 2c34 s ASN 29 Cb 0.00 1.28 1.98 0.00 -1.45 0.00 0.00 41.25 43.06 2c34 s ASN 29 CO 0.00 -0.08 2.18 1.55 -3.72 0.00 0.00 177.10 177.04 2c34 h PRO 30 N 7.40 0.00 -0.05 0.43 0.13 -1.81 -1.02 132.00 137.07 2c34 h PRO 30 Ca -0.10 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.00 2c34 h PRO 30 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2c34 h PRO 30 CO -0.10 0.00 -0.10 1.15 -0.23 0.00 0.00 178.00 178.72 2c34 h THR 31 N 0.00 1.10 0.35 1.56 2.02 -1.84 -2.95 112.91 113.16 2c34 h THR 31 Ca 0.02 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.72 2c34 h THR 31 Cb 0.29 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2c34 h THR 31 CO -0.00 0.14 -0.17 0.71 0.37 0.00 0.00 175.52 176.57 2c34 h THR 32 N 0.08 0.67 0.00 3.16 1.35 -1.59 -3.48 112.91 113.10 2c34 h THR 32 Ca 0.02 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2c34 h THR 32 Cb 0.23 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 2c34 h THR 32 CO 0.01 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.94 2c34 n GLY 33 N -0.98 3.51 2.95 5.82 0.00 -1.11 -5.14 105.19 110.23 2c34 n GLY 33 Ca -0.10 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.90 -3.73 1.61 4.02 -1.26 -4.49 117.16 109.42 2c34 n TYR 34 Ca 0.00 -0.95 -0.13 0.00 -0.01 0.00 0.00 57.90 56.82 2c34 n TYR 34 Cb 0.00 -0.76 -0.07 0.00 -0.02 0.00 0.00 39.34 38.49 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 -5.14 0.80 -0.79 -0.72 -2.45 0.49 -4.56 119.30 106.94 2c34 s MET 35 Ca 0.57 -0.33 -0.06 0.00 -1.25 0.00 0.00 55.69 54.61 2c34 s MET 35 Cb -0.02 0.35 0.20 0.00 1.25 0.00 0.00 34.83 36.62 2c34 s MET 35 CO 0.40 -0.25 0.67 -1.58 1.05 0.00 0.00 175.02 175.31 2c34 s TRP 36 N -2.05 3.69 0.00 4.11 0.52 -1.26 -1.28 118.94 122.67 2c34 s TRP 36 Ca -0.08 -2.57 0.00 0.00 0.02 0.00 0.00 56.10 53.47 2c34 s TRP 36 Cb -0.02 -3.45 0.00 0.00 -1.15 0.00 0.00 33.47 28.85 2c34 s TRP 36 CO 0.00 -0.87 0.00 -2.37 0.02 0.00 0.00 176.95 173.73 2c34 n THR 37 N 3.31 0.00 -3.37 2.01 5.66 -1.05 -4.89 114.28 115.94 2c34 n THR 37 Ca 0.14 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.81 2c34 n THR 37 Cb 0.40 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 -0.97 3.88 0.25 1.09 0.52 -1.26 -0.90 118.95 121.57 2c34 s ARG 38 Ca 0.00 0.38 -0.30 0.00 -0.52 0.00 0.00 55.73 55.30 2c34 s ARG 38 Cb 0.00 -2.73 -0.10 0.00 0.52 0.00 0.00 34.95 32.64 2c34 s ARG 38 CO 0.00 0.36 1.33 0.08 0.02 0.00 0.00 175.30 177.09 2c34 s VAL 39 N -1.70 2.95 0.00 3.52 1.01 0.92 -2.41 120.40 124.69 2c34 s VAL 39 Ca 0.44 0.84 0.00 0.00 0.00 0.00 0.00 61.98 63.26 2c34 s VAL 39 Cb -0.12 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2c34 s VAL 39 CO 0.20 0.15 0.00 0.61 0.00 0.00 0.00 175.10 176.06 2c34 n GLY 40 N 1.86 0.91 0.00 4.51 0.00 -1.26 -4.76 105.19 106.45 2c34 n GLY 40 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.17 0.00 -1.52 1.61 3.72 -1.01 -4.98 117.46 113.11 2c34 n PHE 41 Ca 0.00 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.96 2c34 n PHE 41 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 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 -0.10 0.17 0.00 -4.37 0.31 -1.06 -0.27 118.33 113.01 2c34 n VAL 42 Ca 0.00 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2c34 n VAL 42 Cb 0.09 -2.13 0.00 0.00 -0.91 0.00 0.00 33.84 30.88 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 6.17 1.45 3.57 2.92 0.00 -1.26 -4.89 105.19 113.15 2c34 n GLY 43 Ca 0.38 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.03 -0.96 -0.05 1.61 1.02 0.63 -4.99 119.74 116.96 2c34 s LYS 44 Ca 0.00 0.19 -0.08 0.00 0.02 0.00 0.00 55.97 56.10 2c34 s LYS 44 Cb 0.00 -1.60 -0.29 0.00 -0.52 0.00 0.00 37.83 35.41 2c34 s LYS 44 CO 0.00 -3.59 0.65 -0.44 -0.92 0.00 0.00 175.35 171.05 2c34 h ASP 45 N -2.50 0.53 -3.62 2.83 3.32 -1.99 -3.46 116.42 111.53 2c34 h ASP 45 Ca -0.49 -0.84 -0.54 0.00 0.02 0.00 0.00 57.03 55.17 2c34 h ASP 45 Cb 1.32 -0.17 -0.32 0.00 0.22 0.00 0.00 39.33 40.37 2c34 h ASP 45 CO 0.42 1.72 -0.83 -0.69 -1.72 0.00 0.00 179.24 178.14 2c34 s VAL 46 N -2.58 1.31 -0.17 -1.35 1.01 -1.26 -5.04 120.40 112.32 2c34 s VAL 46 Ca -0.15 -0.61 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 2c34 s VAL 46 Cb 0.06 -1.15 -0.19 0.00 0.00 0.00 0.00 36.38 35.10 2c34 s VAL 46 CO 0.84 0.39 0.36 -0.07 0.00 0.00 0.00 175.10 176.62 2c34 h LEU 47 N 6.63 0.00 -9.32 3.92 3.38 -1.89 -3.48 115.31 114.55 2c34 h LEU 47 Ca -0.31 -0.60 -0.31 0.00 0.09 0.00 0.00 57.88 56.76 2c34 h LEU 47 Cb 1.19 0.00 0.17 0.00 0.09 0.00 0.00 40.66 42.11 2c34 h LEU 47 CO 0.48 1.17 -0.53 -0.24 0.09 0.00 0.00 178.44 179.41 2c34 n SER 48 N -4.54 -2.94 0.00 -0.43 2.88 -1.24 -4.94 113.62 102.41 2c34 n SER 48 Ca -0.20 -0.36 0.00 0.00 -1.33 0.00 0.00 58.87 56.98 2c34 n SER 48 Cb 0.52 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.14 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 -1.82 0.00 0.00 -3.46 8.00 -1.25 -4.94 116.55 113.07 2c34 n ASP 49 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.55 2c34 n ASP 49 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 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 0.00 1.34 0.00 -1.24 0.28 -1.26 -4.93 120.64 114.83 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 -0.73 0.00 0.00 1.43 0.00 0.00 31.44 32.14 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 -1.39 0.00 -3.64 3.84 2.08 -1.26 -4.47 119.36 114.52 2c34 n ILE 51 Ca 0.00 0.66 -0.39 0.00 0.56 0.00 0.00 62.75 63.58 2c34 n ILE 51 Cb 0.23 -1.32 -0.12 0.00 -0.75 0.00 0.00 39.64 37.68 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 -2.08 4.24 -0.67 1.39 1.43 -1.26 -1.07 118.68 120.66 2c34 s LEU 52 Ca 0.00 -0.62 -0.25 0.00 -1.03 0.00 0.00 54.13 52.23 2c34 s LEU 52 Cb 0.00 -2.01 -0.22 0.00 0.03 0.00 0.00 46.19 44.00 2c34 s LEU 52 CO 0.00 -0.23 1.85 -0.62 0.23 0.00 0.00 176.35 177.58 2c34 n GLU 53 N 4.98 0.96 -2.54 1.70 -0.58 0.89 -3.94 120.64 122.11 2c34 n GLU 53 Ca -0.13 -1.72 -0.41 0.00 -0.42 0.00 0.00 57.16 54.48 2c34 n GLU 53 Cb 0.48 -3.07 -0.02 0.00 -0.57 0.00 0.00 31.44 28.27 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 8.04 3.98 -1.20 2.62 1.01 -1.24 -1.59 120.40 132.02 2c34 s VAL 54 Ca 0.65 -1.23 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 2c34 s VAL 54 Cb 0.10 -5.07 0.07 0.00 0.00 0.00 0.00 36.38 31.48 2c34 s VAL 54 CO 0.19 -1.92 1.61 -0.69 0.00 0.00 0.00 175.10 174.29 2c34 s VAL 55 N 4.97 4.16 -0.09 2.92 1.01 0.22 -3.65 120.40 129.93 2c34 s VAL 55 Ca 0.51 -1.63 -0.09 0.00 0.00 0.00 0.00 61.98 60.77 2c34 s VAL 55 Cb 0.01 -5.12 -0.04 0.00 0.00 0.00 0.00 36.38 31.23 2c34 s VAL 55 CO -0.02 -1.95 0.21 0.00 0.00 0.00 0.00 175.10 173.34 2c34 s LYS 57 N -1.02 0.79 -0.66 0.00 1.02 0.49 -4.95 119.74 115.41 2c34 s LYS 57 Ca 0.17 -0.51 -0.27 0.00 0.02 0.00 0.00 55.97 55.38 2c34 s LYS 57 Cb -0.13 -2.19 0.01 0.00 -0.52 0.00 0.00 37.83 35.01 2c34 s LYS 57 CO 0.06 -0.64 1.44 -0.47 -0.92 0.00 0.00 175.35 174.83 2c34 s TYR 58 N 1.79 2.15 -0.43 3.18 6.14 -1.26 -2.31 117.35 126.60 2c34 s TYR 58 Ca -0.02 0.28 -0.17 0.00 0.64 0.00 0.00 57.07 57.81 2c34 s TYR 58 Cb -0.17 -4.45 0.03 0.00 0.42 0.00 0.00 41.96 37.79 2c34 s TYR 58 CO -0.08 -2.09 0.40 0.99 0.64 0.00 0.00 175.55 175.42 2c34 s THR 59 N 6.55 5.14 -0.61 4.34 2.01 -1.00 -5.02 115.64 127.06 2c34 s THR 59 Ca 0.47 -0.53 -0.15 0.00 0.31 0.00 0.00 61.69 61.80 2c34 s THR 59 Cb -0.10 -4.03 0.15 0.00 0.01 0.00 0.00 72.50 68.53 2c34 s THR 59 CO 0.19 -0.43 0.55 -2.16 -0.69 0.00 0.00 174.62 172.08 2c34 s PRO 60 N 1.98 3.09 0.27 4.92 0.04 -1.26 -0.38 135.00 143.66 2c34 s PRO 60 Ca 0.09 -1.92 -0.30 0.00 0.04 0.00 0.00 61.00 58.92 2c34 s PRO 60 Cb -0.19 -4.29 -0.09 0.00 0.04 0.00 0.00 34.50 29.97 2c34 s PRO 60 CO 0.12 -1.31 1.04 0.99 0.04 0.00 0.00 177.00 177.89 2c34 s THR 61 N 1.19 3.69 1.23 1.26 2.01 -1.16 -4.72 115.64 119.14 2c34 s THR 61 Ca 0.07 1.70 -0.21 0.00 0.31 0.00 0.00 61.69 63.56 2c34 s THR 61 Cb -0.25 -4.08 0.31 0.00 0.01 0.00 0.00 72.50 68.50 2c34 s THR 61 CO -0.00 0.40 0.92 -2.65 -0.69 0.00 0.00 174.62 172.60 2c34 n PRO 62 N 1.28 -3.69 -1.73 4.92 -0.02 -1.26 0.10 135.00 134.59 2c34 n PRO 62 Ca -0.01 -1.50 -0.21 0.00 -2.02 0.00 0.00 63.50 59.76 2c34 n PRO 62 Cb 0.46 -1.61 0.13 0.00 -0.02 0.00 0.00 33.50 32.46 2c34 n PRO 62 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2c34 n SER 63 N -5.10 0.46 -0.03 2.55 2.88 -1.26 -4.46 113.62 108.66 2c34 n SER 63 Ca 0.13 -1.57 -0.00 0.00 -1.33 0.00 0.00 58.87 56.10 2c34 n SER 63 Cb 0.55 -0.68 -0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2c34 n SER 63 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2c34 h SER 64 N -1.01 0.00 0.00 -3.46 0.87 -1.99 -3.45 113.55 104.51 2c34 h SER 64 Ca -0.30 0.00 -0.39 0.00 -1.23 0.00 0.00 61.79 59.87 2c34 h SER 64 Cb 0.93 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.83 2c34 h SER 64 CO 0.25 0.28 -2.31 0.41 -0.53 0.00 0.00 176.83 174.93 2c34 n THR 65 N -3.48 1.29 0.00 2.23 -1.04 -1.26 -5.03 114.28 106.99 2c34 n THR 65 Ca -0.00 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 2c34 n THR 65 Cb 0.01 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 2c34 n THR 65 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2c34 n PRO 66 N -3.92 1.33 -0.38 -2.82 -0.02 -1.26 -5.04 135.00 122.90 2c34 n PRO 66 Ca -0.45 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.03 2c34 n PRO 66 Cb 0.84 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.32 2c34 n PRO 66 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c34 n MET 67 N 0.00 0.00 -4.00 -0.52 0.00 -1.26 -4.56 117.12 106.79 2c34 n MET 67 Ca 0.00 -0.24 -0.34 0.00 0.00 0.00 0.00 57.70 57.12 2c34 n MET 67 Cb 0.00 -0.13 -0.15 0.00 0.00 0.00 0.00 33.22 32.94 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 0.00 2.77 0.00 3.17 1.01 -1.26 -4.77 120.40 121.32 2c34 s VAL 68 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.18 2c34 s VAL 68 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 34.11 2c34 s VAL 68 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2c34 n GLY 69 N 4.70 2.38 2.87 4.51 0.00 -1.26 -4.92 105.19 113.46 2c34 n GLY 69 Ca -0.19 -0.63 -0.00 0.00 0.00 0.00 0.00 46.02 45.21 2c34 n GLY 69 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2c34 n VAL 70 N 0.00 -8.88 -5.07 1.61 0.31 -1.26 -4.45 118.33 100.60 2c34 n VAL 70 Ca 0.00 1.44 -0.32 0.00 -0.01 0.00 0.00 64.34 65.45 2c34 n VAL 70 Cb 0.00 -5.67 -0.16 0.00 -0.91 0.00 0.00 33.84 27.10 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 -1.41 1.40 0.00 2.92 0.00 0.29 -4.56 107.32 105.97 2c34 s GLY 71 Ca -0.01 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.74 2c34 s GLY 71 CO 0.54 -0.47 0.00 0.61 0.00 0.00 0.00 173.10 173.77 2c34 n GLY 72 N 3.14 4.37 0.00 0.20 0.00 -1.24 -2.98 105.19 108.68 2c34 n GLY 72 Ca -0.18 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.66 -0.61 -5.35 0.49 -4.17 119.36 106.07 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 -2.29 1.12 -0.58 4.28 1.51 -0.58 -2.38 117.35 118.43 2c34 s TYR 74 Ca 0.00 -1.35 -0.24 0.00 -1.01 0.00 0.00 57.07 54.47 2c34 s TYR 74 Cb 0.00 -1.36 0.05 0.00 -0.11 0.00 0.00 41.96 40.54 2c34 s TYR 74 CO 0.00 -0.85 0.95 0.08 -1.11 0.00 0.00 175.55 174.62 2c34 s VAL 75 N 1.82 4.36 -0.24 0.71 1.01 -0.98 -2.29 120.40 124.79 2c34 s VAL 75 Ca 0.09 0.13 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 2c34 s VAL 75 Cb -0.17 -4.58 -0.03 0.00 0.00 0.00 0.00 36.38 31.61 2c34 s VAL 75 CO -0.29 -1.21 0.05 -0.69 0.00 0.00 0.00 175.10 172.96 2c34 s VAL 76 N 4.00 4.16 -0.43 2.92 1.01 -1.00 -0.38 120.40 130.69 2c34 s VAL 76 Ca 0.28 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 2c34 s VAL 76 Cb -0.13 -2.94 0.11 0.00 0.00 0.00 0.00 36.38 33.42 2c34 s VAL 76 CO 0.17 0.36 0.26 -0.76 0.00 0.00 0.00 175.10 175.13 2c34 s LEU 77 N 1.55 5.41 -0.47 3.92 1.43 -0.75 -1.47 118.68 128.30 2c34 s LEU 77 Ca 0.06 -1.95 -0.18 0.00 -1.03 0.00 0.00 54.13 51.02 2c34 s LEU 77 Cb -0.15 -1.91 0.05 0.00 0.03 0.00 0.00 46.19 44.21 2c34 s LEU 77 CO 0.02 -0.60 0.56 -0.69 0.23 0.00 0.00 176.35 175.87 2c34 s VAL 78 N 1.24 4.96 -0.41 -1.59 1.01 -1.02 0.69 120.40 125.29 2c34 s VAL 78 Ca 0.07 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 2c34 s VAL 78 Cb -0.24 -4.20 0.09 0.00 0.00 0.00 0.00 36.38 32.03 2c34 s VAL 78 CO -0.03 -0.65 0.22 -0.54 0.00 0.00 0.00 175.10 174.10 2c34 s LYS 79 N 2.43 2.40 -0.65 2.72 1.02 -0.62 -2.20 119.74 124.83 2c34 s LYS 79 Ca 0.14 -1.57 -0.29 0.00 0.02 0.00 0.00 55.97 54.27 2c34 s LYS 79 Cb -0.18 -3.67 -0.13 0.00 -0.52 0.00 0.00 37.83 33.33 2c34 s LYS 79 CO 0.13 -0.97 2.49 -2.30 -0.92 0.00 0.00 175.35 173.78 2c34 n PRO 80 N 4.79 0.68 -0.00 -1.68 -0.02 -1.26 -0.08 135.00 137.42 2c34 n PRO 80 Ca -0.08 0.04 -0.11 0.00 -2.02 0.00 0.00 63.50 61.32 2c34 n PRO 80 Cb 0.42 -2.62 0.02 0.00 -0.02 0.00 0.00 33.50 31.30 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 15.93 0.61 -5.46 -0.52 3.08 -1.35 0.11 114.38 126.80 2c34 h ARG 81 Ca -0.18 -0.42 -0.64 0.00 0.07 0.00 0.00 59.98 58.81 2c34 h ARG 81 Cb 1.29 0.06 -0.13 0.00 0.08 0.00 0.00 29.97 31.27 2c34 h ARG 81 CO 1.22 1.04 -0.57 0.15 -1.07 0.00 0.00 179.97 180.75 2c34 s LYS 82 N -3.92 2.04 -0.09 0.04 1.02 -1.17 -4.92 119.74 112.74 2c34 s LYS 82 Ca -0.08 -2.22 -0.00 0.00 0.02 0.00 0.00 55.97 53.68 2c34 s LYS 82 Cb 0.11 -1.56 -0.03 0.00 -0.52 0.00 0.00 37.83 35.83 2c34 s LYS 82 CO 0.86 -0.18 -0.06 1.03 -0.92 0.00 0.00 175.35 176.07 2c34 s ARG 83 N -3.78 2.99 0.00 1.68 0.52 -1.26 -4.92 118.95 114.17 2c34 s ARG 83 Ca 0.23 -0.54 0.00 0.00 -0.52 0.00 0.00 55.73 54.91 2c34 s ARG 83 Cb 0.07 -2.68 0.00 0.00 0.52 0.00 0.00 34.95 32.86 2c34 s ARG 83 CO 0.12 0.56 0.00 0.41 0.02 0.00 0.00 175.30 176.41 2c34 n GLY 84 N 2.55 0.61 3.17 -3.53 0.00 0.00 -4.98 105.19 103.01 2c34 n GLY 84 Ca -0.18 -0.57 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 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 3.50 0.23 1.61 3.76 -1.26 -1.27 115.29 121.86 2c34 s HIS 85 Ca 0.00 -2.14 0.11 0.00 -0.15 0.00 0.00 55.06 52.89 2c34 s HIS 85 Cb 0.00 -3.32 -0.05 0.00 1.11 0.00 0.00 32.58 30.33 2c34 s HIS 85 CO 0.00 -0.98 -0.21 -1.01 -0.85 0.00 0.00 174.74 171.70 2c34 s HIS 86 N 1.25 2.33 -0.09 1.40 3.76 -0.79 -5.00 115.29 118.14 2c34 s HIS 86 Ca 0.07 -0.34 -0.29 0.00 -0.15 0.00 0.00 55.06 54.35 2c34 s HIS 86 Cb -0.24 -1.10 0.07 0.00 1.11 0.00 0.00 32.58 32.42 2c34 s HIS 86 CO -0.02 0.58 0.68 0.99 -0.85 0.00 0.00 174.74 176.11 2c34 s THR 87 N -1.99 0.00 -0.75 1.30 2.01 -1.26 -0.85 115.64 114.10 2c34 s THR 87 Ca 0.25 -0.01 -0.10 0.00 0.31 0.00 0.00 61.69 62.13 2c34 s THR 87 Cb -0.07 -0.99 0.20 0.00 0.01 0.00 0.00 72.50 71.65 2c34 s THR 87 CO 0.12 -0.01 0.65 -0.22 -0.69 0.00 0.00 174.62 174.47 2c34 s LEU 88 N -0.87 6.19 -0.78 4.42 2.96 0.02 -4.92 118.68 125.69 2c34 s LEU 88 Ca -0.09 -2.76 -0.25 0.00 -0.22 0.00 0.00 54.13 50.80 2c34 s LEU 88 Cb -0.01 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2c34 s LEU 88 CO 0.08 -0.49 1.76 -1.61 -1.32 0.00 0.00 176.35 174.77 2c34 s GLU 89 N 0.06 2.80 -0.12 1.98 2.02 -1.26 -1.55 118.70 122.63 2c34 s GLU 89 Ca 0.18 -0.05 -0.02 0.00 0.02 0.00 0.00 54.97 55.10 2c34 s GLU 89 Cb -0.14 -4.73 -0.03 0.00 0.10 0.00 0.00 34.13 29.34 2c34 s GLU 89 CO -0.07 -2.82 -0.06 -0.51 0.02 0.00 0.00 175.26 171.83 2c34 s LEU 90 N 8.48 3.19 0.03 1.80 1.43 -0.68 -0.06 118.68 132.87 2c34 s LEU 90 Ca 0.61 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.61 2c34 s LEU 90 Cb -0.08 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 2c34 s LEU 90 CO 0.08 0.25 -0.02 0.54 0.23 0.00 0.00 176.35 177.43 2c34 s VAL 91 N -0.11 0.15 -1.01 -1.59 0.11 -0.08 -0.37 120.40 117.50 2c34 s VAL 91 Ca 0.02 -1.24 -0.12 0.00 -2.93 0.00 0.00 61.98 57.71 2c34 s VAL 91 Cb -0.13 -0.76 0.23 0.00 -1.53 0.00 0.00 36.38 34.19 2c34 s VAL 91 CO 0.03 -0.68 1.03 -0.47 -3.33 0.00 0.00 175.10 171.67 2c34 s TYR 92 N -2.42 3.90 0.38 1.54 5.04 -1.00 -2.54 117.35 122.25 2c34 s TYR 92 Ca -0.07 -2.26 0.08 0.00 -2.44 0.00 0.00 57.07 52.38 2c34 s TYR 92 Cb -0.03 -3.93 -0.06 0.00 0.35 0.00 0.00 41.96 38.29 2c34 s TYR 92 CO -0.04 -1.07 0.07 -0.08 -1.34 0.00 0.00 175.55 173.08 2c34 s THR 93 N -0.07 2.35 -0.69 4.34 -1.32 -0.41 -4.02 115.64 115.82 2c34 s THR 93 Ca 0.28 -1.89 -0.15 0.00 -1.21 0.00 0.00 61.69 58.72 2c34 s THR 93 Cb -0.09 -2.91 0.18 0.00 -1.51 0.00 0.00 72.50 68.17 2c34 s THR 93 CO -0.08 -0.08 0.64 -0.13 -2.21 0.00 0.00 174.62 172.76 2c34 s ARG 94 N -3.77 3.30 0.61 7.08 0.52 -1.03 0.19 118.95 125.85 2c34 s ARG 94 Ca 0.37 -2.13 0.25 0.00 -0.52 0.00 0.00 55.73 53.70 2c34 s ARG 94 Cb 0.04 -4.35 1.00 0.00 0.52 0.00 0.00 34.95 32.16 2c34 s ARG 94 CO 0.20 -1.30 1.44 -1.35 0.02 0.00 0.00 175.30 174.31 2c34 h PRO 95 N 8.25 0.00 0.02 3.54 0.11 -1.79 0.41 132.00 142.54 2c34 h PRO 95 Ca -0.08 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 2c34 h PRO 95 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2c34 h PRO 95 CO 0.88 0.00 -0.01 0.35 -0.21 0.00 0.00 178.00 179.01 2c34 h PHE 96 N 0.00 -0.03 -0.21 0.65 3.57 -1.91 -3.39 116.94 115.62 2c34 h PHE 96 Ca 0.36 -0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.67 2c34 h PHE 96 Cb 2.35 0.01 0.00 0.00 2.79 0.00 0.00 35.95 41.10 2c34 h PHE 96 CO 0.00 -0.02 -0.65 1.05 -2.23 0.00 0.00 178.31 176.47 2c34 h GLU 97 N -0.79 0.78 0.00 1.11 -0.00 -1.73 -3.50 114.58 110.46 2c34 h GLU 97 Ca -0.00 -0.55 0.00 0.00 -0.00 0.00 0.00 59.36 58.81 2c34 h GLU 97 Cb 0.02 0.09 0.00 0.00 -0.00 0.00 0.00 28.75 28.86 2c34 h GLU 97 CO 0.00 1.17 0.00 0.41 -0.00 0.00 0.00 179.01 180.60 2c34 n GLY 98 N 0.49 0.83 3.43 1.06 0.00 0.14 -5.06 105.19 106.08 2c34 n GLY 98 Ca -0.05 -2.00 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 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 -1.84 3.24 0.22 -0.61 1.01 -1.26 -2.45 121.20 119.51 2c34 s ILE 99 Ca 0.00 -0.61 0.11 0.00 0.00 0.00 0.00 60.65 60.15 2c34 s ILE 99 Cb 0.00 -2.35 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 2c34 s ILE 99 CO 0.00 0.54 -0.22 -0.54 0.00 0.00 0.00 174.94 174.72 2c34 s LYS 100 N 0.03 1.54 0.03 2.79 1.02 -1.26 -5.07 119.74 118.83 2c34 s LYS 100 Ca -0.03 -1.60 -0.22 0.00 0.02 0.00 0.00 55.97 54.15 2c34 s LYS 100 Cb -0.14 -1.76 -0.15 0.00 -0.52 0.00 0.00 37.83 35.26 2c34 s LYS 100 CO 0.04 0.36 1.38 -1.35 -0.92 0.00 0.00 175.35 174.86 2c34 h PRO 101 N 2.90 0.26 0.00 -1.68 0.11 -1.99 -3.04 132.00 128.55 2c34 h PRO 101 Ca -0.44 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2c34 h PRO 101 Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2c34 h PRO 101 CO 0.52 0.61 0.28 1.05 -0.21 0.00 0.00 178.00 180.25 2c34 h GLU 102 N -0.10 0.00 -7.24 1.05 4.11 -2.00 -3.43 114.58 106.98 2c34 h GLU 102 Ca 0.03 0.00 -0.52 0.00 0.07 0.00 0.00 59.36 58.93 2c34 h GLU 102 Cb 0.53 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.94 2c34 h GLU 102 CO 0.02 0.00 0.32 -0.80 0.07 0.00 0.00 179.01 178.62 2c34 s ASN 103 N -4.06 3.91 0.91 3.06 0.02 -1.15 -4.97 114.94 112.65 2c34 s ASN 103 Ca -0.03 2.17 -0.11 0.00 -1.02 0.00 0.00 52.86 53.87 2c34 s ASN 103 Cb 0.07 -2.57 0.10 0.00 0.02 0.00 0.00 41.25 38.87 2c34 s ASN 103 CO 0.22 -2.45 0.92 -0.62 0.02 0.00 0.00 177.10 175.19 2c34 n GLU 104 N -3.34 -0.30 -4.34 -0.60 4.71 -1.26 -4.84 120.64 110.67 2c34 n GLU 104 Ca 0.12 -0.03 -0.18 0.00 -0.01 0.00 0.00 57.16 57.06 2c34 n GLU 104 Cb 0.51 -2.22 -0.10 0.00 -1.01 0.00 0.00 31.44 28.62 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 -4.22 1.35 -0.35 3.49 6.06 -1.26 -2.37 118.95 121.65 2c34 s ARG 105 Ca 0.65 -1.67 -0.02 0.00 -2.50 0.00 0.00 55.73 52.19 2c34 s ARG 105 Cb -0.24 -0.77 0.26 0.00 0.06 0.00 0.00 34.95 34.26 2c34 s ARG 105 CO 0.60 -0.03 1.17 0.98 -2.50 0.00 0.00 175.30 175.52 2c34 n TYR 106 N -0.42 -0.89 -3.21 5.12 9.36 0.50 -4.51 117.16 123.11 2c34 n TYR 106 Ca -0.06 -0.80 -0.46 0.00 3.32 0.00 0.00 57.90 59.90 2c34 n TYR 106 Cb 0.63 1.14 -0.04 0.00 -0.63 0.00 0.00 39.34 40.45 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 0.35 5.14 -0.89 2.97 2.01 -1.25 -1.69 115.64 122.29 2c34 s THR 107 Ca 0.26 -1.62 -0.25 0.00 0.31 0.00 0.00 61.69 60.40 2c34 s THR 107 Cb 0.19 -4.48 0.02 0.00 0.01 0.00 0.00 72.50 68.24 2c34 s THR 107 CO -0.10 -1.07 1.58 -0.22 -0.69 0.00 0.00 174.62 174.11 2c34 s LEU 108 N 1.67 3.33 0.35 4.42 2.96 -0.60 -1.54 118.68 129.27 2c34 s LEU 108 Ca 0.13 -0.85 -0.25 0.00 -0.22 0.00 0.00 54.13 52.94 2c34 s LEU 108 Cb -0.19 -2.56 -0.10 0.00 0.50 0.00 0.00 46.19 43.84 2c34 s LEU 108 CO -0.01 -1.97 1.00 -1.00 -1.32 0.00 0.00 176.35 173.06 2c34 s HIS 109 N 6.80 3.49 -0.18 5.38 3.76 0.69 -0.80 115.29 134.43 2c34 s HIS 109 Ca 0.52 1.71 -0.04 0.00 -0.15 0.00 0.00 55.06 57.10 2c34 s HIS 109 Cb -0.05 -3.04 0.08 0.00 1.11 0.00 0.00 32.58 30.69 2c34 s HIS 109 CO 0.01 -0.21 0.23 -0.51 -0.85 0.00 0.00 174.74 173.41 2c34 s LEU 110 N -2.29 -0.18 -1.46 0.89 1.43 -0.03 -2.16 118.68 114.89 2c34 s LEU 110 Ca 0.53 0.05 -0.10 0.00 -1.03 0.00 0.00 54.13 53.57 2c34 s LEU 110 Cb -0.21 0.48 0.04 0.00 0.03 0.00 0.00 46.19 46.53 2c34 s LEU 110 CO 0.26 -0.30 2.42 -3.20 0.23 0.00 0.00 176.35 175.77 2c34 n ASN 111 N 5.33 6.31 -4.58 2.29 5.15 0.15 -1.89 115.26 128.01 2c34 n ASN 111 Ca -0.05 -2.85 -0.54 0.00 -0.60 0.00 0.00 54.58 50.53 2c34 n ASN 111 Cb 0.50 -1.55 -0.07 0.00 -0.53 0.00 0.00 39.78 38.13 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 3.75 0.02 0.76 3.44 0.31 -0.40 -4.03 118.33 122.19 2c34 n VAL 112 Ca 0.60 -0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.99 2c34 n VAL 112 Cb 0.31 -0.65 0.36 0.00 -0.91 0.00 0.00 33.84 32.95 2c34 n VAL 112 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80