#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ptu s ASP 5 N 0.00 4.69 0.18 3.54 1.01 -1.26 -4.90 116.67 119.92 2ptu s ASP 5 Ca 0.00 1.63 -0.17 0.00 0.71 0.00 0.00 52.55 54.71 2ptu s ASP 5 Cb 0.00 -2.39 0.03 0.00 1.01 0.00 0.00 42.92 41.57 2ptu s ASP 5 CO 0.00 -1.89 0.51 -0.94 0.21 0.00 0.00 175.17 173.06 2ptu s SER 6 N -3.62 -0.27 -0.10 0.27 1.04 -1.15 -5.04 113.70 104.83 2ptu s SER 6 Ca 0.60 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.60 2ptu s SER 6 Cb -0.16 0.56 0.02 0.00 0.10 0.00 0.00 66.02 66.55 2ptu s SER 6 CO 0.55 -1.02 -0.08 -0.44 0.98 0.00 0.00 173.24 173.24 2ptu s SER 7 N -2.86 2.02 -0.13 7.02 0.01 -1.26 -1.05 113.70 117.44 2ptu s SER 7 Ca 0.08 -0.28 0.02 0.00 1.31 0.00 0.00 55.95 57.08 2ptu s SER 7 Cb -0.00 -0.80 -0.00 0.00 0.21 0.00 0.00 66.02 65.43 2ptu s SER 7 CO -0.05 -0.09 -0.19 -1.61 0.41 0.00 0.00 173.24 171.71 2ptu s GLU 8 N 1.50 3.15 0.11 12.44 2.02 -0.51 -5.01 118.70 132.41 2ptu s GLU 8 Ca 0.01 -0.80 -0.12 0.00 0.02 0.00 0.00 54.97 54.08 2ptu s GLU 8 Cb -0.13 -2.50 -0.06 0.00 0.10 0.00 0.00 34.13 31.54 2ptu s GLU 8 CO -0.06 0.08 0.47 -1.21 0.02 0.00 0.00 175.26 174.56 2ptu s GLU 9 N 0.62 3.86 0.00 1.61 2.02 -1.26 -1.79 118.70 123.77 2ptu s GLU 9 Ca -0.10 0.32 0.02 0.00 0.02 0.00 0.00 54.97 55.23 2ptu s GLU 9 Cb -0.16 -2.97 -0.01 0.00 0.10 0.00 0.00 34.13 31.09 2ptu s GLU 9 CO 0.03 0.52 -0.07 0.08 0.02 0.00 0.00 175.26 175.84 2ptu s VAL 10 N -1.43 0.53 -0.11 2.63 1.01 -0.45 -4.94 120.40 117.65 2ptu s VAL 10 Ca 0.35 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.95 2ptu s VAL 10 Cb -0.14 -0.47 -0.00 0.00 0.00 0.00 0.00 36.38 35.76 2ptu s VAL 10 CO 0.18 0.07 -0.20 -0.69 0.00 0.00 0.00 175.10 174.46 2ptu s VAL 11 N -0.34 2.36 0.35 2.92 1.01 -1.26 -0.98 120.40 124.45 2ptu s VAL 11 Ca 0.01 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.11 2ptu s VAL 11 Cb -0.04 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 2ptu s VAL 11 CO -0.00 0.55 0.09 -0.83 0.00 0.00 0.00 175.10 174.91 2ptu s GLY 12 N 0.39 2.25 -0.10 4.51 0.00 0.20 -4.97 107.32 109.60 2ptu s GLY 12 Ca -0.15 -1.69 0.02 0.00 0.00 0.00 0.00 44.72 42.89 2ptu s GLY 12 CO 0.07 -1.79 -0.15 0.14 0.00 0.00 0.00 173.10 171.38 2ptu s VAL 13 N -3.33 1.42 0.19 1.40 1.01 -1.26 -1.46 120.40 118.36 2ptu s VAL 13 Ca 0.31 -0.60 -0.32 0.00 0.00 0.00 0.00 61.98 61.37 2ptu s VAL 13 Cb 0.06 -1.30 -0.15 0.00 0.00 0.00 0.00 36.38 34.99 2ptu s VAL 13 CO 0.15 0.42 1.27 -0.24 0.00 0.00 0.00 175.10 176.70 2ptu n SER 14 N 4.13 1.89 0.00 3.32 2.88 -0.80 -1.88 113.62 123.16 2ptu n SER 14 Ca -0.19 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 2ptu n SER 14 Cb 0.51 -1.29 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 2ptu n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ptu n GLY 15 N 2.13 0.75 3.08 0.46 0.00 0.53 -4.93 105.19 107.22 2ptu n GLY 15 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 2ptu n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ptu s LYS 16 N -0.48 0.64 0.39 1.61 -0.14 -0.79 -4.74 119.74 116.23 2ptu s LYS 16 Ca 0.00 -0.70 -0.27 0.00 -1.36 0.00 0.00 55.97 53.63 2ptu s LYS 16 Cb 0.00 -0.53 -0.10 0.00 -1.68 0.00 0.00 37.83 35.52 2ptu s LYS 16 CO 0.00 0.12 1.46 -1.25 -0.76 0.00 0.00 175.35 174.92 2ptu s PRO 17 N -1.30 4.02 0.10 -1.68 0.04 -1.20 -1.21 135.00 133.76 2ptu s PRO 17 Ca -0.05 2.51 0.03 0.00 0.04 0.00 0.00 61.00 63.54 2ptu s PRO 17 Cb -0.08 -2.89 -0.04 0.00 0.04 0.00 0.00 34.50 31.52 2ptu s PRO 17 CO 0.01 -0.58 -0.09 0.54 0.04 0.00 0.00 177.00 176.92 2ptu s VAL 18 N -1.14 0.85 0.03 -0.36 0.11 -0.55 -4.88 120.40 114.47 2ptu s VAL 18 Ca 0.55 -1.74 0.04 0.00 -2.93 0.00 0.00 61.98 57.89 2ptu s VAL 18 Cb -0.45 -1.46 -0.02 0.00 -1.53 0.00 0.00 36.38 32.92 2ptu s VAL 18 CO 0.61 -0.67 -0.12 -1.58 -3.33 0.00 0.00 175.10 170.01 2ptu s GLN 19 N -3.15 0.79 -0.28 1.54 0.74 -1.26 -0.84 119.66 117.21 2ptu s GLN 19 Ca 0.08 -0.69 0.02 0.00 0.05 0.00 0.00 55.36 54.82 2ptu s GLN 19 Cb -0.00 -0.75 0.08 0.00 1.10 0.00 0.00 33.01 33.43 2ptu s GLN 19 CO -0.01 0.18 -0.03 -0.51 -0.55 0.00 0.00 175.29 174.37 2ptu s LEU 20 N -1.11 3.39 -0.36 3.68 1.43 0.54 -4.98 118.68 121.27 2ptu s LEU 20 Ca -0.01 -1.56 -0.02 0.00 -1.03 0.00 0.00 54.13 51.52 2ptu s LEU 20 Cb -0.08 -1.38 0.09 0.00 0.03 0.00 0.00 46.19 44.86 2ptu s LEU 20 CO 0.01 -0.28 0.12 -0.60 0.23 0.00 0.00 176.35 175.82 2ptu s ARG 21 N 1.20 2.10 0.65 1.70 3.52 -1.26 -1.87 118.95 124.99 2ptu s ARG 21 Ca -0.01 -1.62 -0.15 0.00 -0.13 0.00 0.00 55.73 53.82 2ptu s ARG 21 Cb -0.19 -3.40 -0.00 0.00 -1.56 0.00 0.00 34.95 29.79 2ptu s ARG 21 CO -0.08 -0.89 1.12 -1.25 -0.81 0.00 0.00 175.30 173.38 2ptu s PRO 22 N 1.16 2.81 0.13 5.12 0.04 -1.26 -5.06 135.00 137.93 2ptu s PRO 22 Ca 0.04 1.42 0.04 0.00 0.04 0.00 0.00 61.00 62.53 2ptu s PRO 22 Cb -0.21 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2ptu s PRO 22 CO -0.03 -1.25 -0.10 -1.54 0.04 0.00 0.00 177.00 174.12 2ptu s SER 23 N -2.51 1.62 -0.87 6.66 1.04 -1.26 -4.90 113.70 113.48 2ptu s SER 23 Ca 0.68 -0.97 -0.05 0.00 0.48 0.00 0.00 55.95 56.09 2ptu s SER 23 Cb -0.21 0.01 -0.01 0.00 0.10 0.00 0.00 66.02 65.91 2ptu s SER 23 CO 0.41 -0.34 0.73 0.59 0.98 0.00 0.00 173.24 175.61 2ptu n ASN 24 N -0.00 -6.60 -4.08 7.02 3.02 -1.26 -5.04 115.26 108.32 2ptu n ASN 24 Ca -0.12 -0.52 -0.12 0.00 -0.03 0.00 0.00 54.58 53.80 2ptu n ASN 24 Cb 0.60 -4.21 -0.11 0.00 -0.61 0.00 0.00 39.78 35.45 2ptu n ASN 24 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2ptu s ILE 25 N -3.14 0.52 -0.07 2.41 -4.36 -1.26 -4.97 121.20 110.33 2ptu s ILE 25 Ca 0.15 -1.25 -0.29 0.00 -0.26 0.00 0.00 60.65 59.00 2ptu s ILE 25 Cb -0.04 -0.82 -0.02 0.00 1.25 0.00 0.00 42.46 42.83 2ptu s ILE 25 CO 0.80 -0.51 0.95 -1.58 0.24 0.00 0.00 174.94 174.84 2ptu s GLN 26 N -2.08 4.47 0.00 0.37 0.74 -1.26 -4.95 119.66 116.94 2ptu s GLN 26 Ca -0.06 1.32 0.07 0.00 0.05 0.00 0.00 55.36 56.74 2ptu s GLN 26 Cb -0.06 -3.50 0.12 0.00 1.10 0.00 0.00 33.01 30.66 2ptu s GLN 26 CO -0.01 -0.17 0.92 0.25 -0.55 0.00 0.00 175.29 175.73 2ptu n THR 27 N 4.23 0.42 -4.77 -0.34 -2.24 -1.26 -4.94 114.28 105.38 2ptu n THR 27 Ca 0.06 -0.71 -0.33 0.00 -2.27 0.00 0.00 64.05 60.80 2ptu n THR 27 Cb 0.50 0.88 -0.16 0.00 -2.10 0.00 0.00 70.33 69.45 2ptu n THR 27 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ptu s LYS 28 N -0.78 3.11 -0.92 -0.78 -0.14 -1.26 -4.68 119.74 114.30 2ptu s LYS 28 Ca 0.12 -0.82 -0.06 0.00 -1.36 0.00 0.00 55.97 53.85 2ptu s LYS 28 Cb 0.07 -2.47 0.01 0.00 -1.68 0.00 0.00 37.83 33.75 2ptu s LYS 28 CO 0.10 0.06 0.80 -0.25 -0.76 0.00 0.00 175.35 175.30 2ptu n ASP 29 N 3.89 -4.77 -4.50 2.83 8.00 -1.26 -5.01 116.55 115.73 2ptu n ASP 29 Ca -0.19 -0.37 -0.23 0.00 0.71 0.00 0.00 54.79 54.70 2ptu n ASP 29 Cb 0.52 -3.60 -0.11 0.00 -0.02 0.00 0.00 41.12 37.92 2ptu n ASP 29 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2ptu s VAL 30 N -3.22 1.50 -0.06 2.53 -7.23 -1.26 -3.92 120.40 108.73 2ptu s VAL 30 Ca 0.37 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.54 2ptu s VAL 30 Cb -0.16 -2.81 -0.03 0.00 0.56 0.00 0.00 36.38 33.94 2ptu s VAL 30 CO 0.50 -0.04 -0.10 -0.55 -0.31 0.00 0.00 175.10 174.60 2ptu s SER 31 N -3.55 4.36 -0.07 4.85 0.15 0.13 -4.85 113.70 114.72 2ptu s SER 31 Ca 0.35 -0.11 0.01 0.00 0.70 0.00 0.00 55.95 56.91 2ptu s SER 31 Cb 0.08 -1.05 0.02 0.00 -1.71 0.00 0.00 66.02 63.36 2ptu s SER 31 CO 0.16 0.35 -0.10 -0.69 1.20 0.00 0.00 173.24 174.16 2ptu s VAL 32 N -0.73 1.01 -0.07 4.45 1.01 -0.63 -0.76 120.40 124.68 2ptu s VAL 32 Ca 0.11 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2ptu s VAL 32 Cb -0.11 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.32 2ptu s VAL 32 CO 0.01 0.34 -0.12 -1.10 0.00 0.00 0.00 175.10 174.23 2ptu s GLN 33 N 0.94 1.72 -0.18 2.72 -0.21 0.05 0.07 119.66 124.78 2ptu s GLN 33 Ca -0.10 -0.42 -0.06 0.00 0.02 0.00 0.00 55.36 54.80 2ptu s GLN 33 Cb -0.15 -1.43 -0.04 0.00 1.00 0.00 0.00 33.01 32.39 2ptu s GLN 33 CO 0.00 0.01 0.04 -1.58 -2.12 0.00 0.00 175.29 171.65 2ptu s TRP 34 N 0.71 3.18 0.08 0.91 0.52 -0.07 -1.06 118.94 123.20 2ptu s TRP 34 Ca -0.14 -0.07 0.03 0.00 0.02 0.00 0.00 56.10 55.94 2ptu s TRP 34 Cb -0.16 -2.06 -0.03 0.00 -1.15 0.00 0.00 33.47 30.07 2ptu s TRP 34 CO 0.03 0.05 -0.09 0.15 0.02 0.00 0.00 176.95 177.12 2ptu s LYS 35 N 0.49 0.75 -0.12 4.98 1.02 0.32 -0.12 119.74 127.06 2ptu s LYS 35 Ca 0.01 -1.08 0.02 0.00 0.02 0.00 0.00 55.97 54.94 2ptu s LYS 35 Cb -0.13 -0.38 -0.00 0.00 -0.52 0.00 0.00 37.83 36.80 2ptu s LYS 35 CO 0.01 0.05 -0.20 0.21 -0.92 0.00 0.00 175.35 174.50 2ptu s LYS 36 N -2.70 3.14 -0.18 1.68 2.20 -0.33 -0.34 119.74 123.22 2ptu s LYS 36 Ca 0.02 -0.81 -0.29 0.00 -0.36 0.00 0.00 55.97 54.53 2ptu s LYS 36 Cb -0.03 -2.45 -0.03 0.00 -1.51 0.00 0.00 37.83 33.81 2ptu s LYS 36 CO -0.01 0.12 1.54 0.99 -0.36 0.00 0.00 175.35 177.63 2ptu s THR 37 N 0.53 3.80 0.23 3.43 2.01 -0.15 -0.36 115.64 125.12 2ptu s THR 37 Ca -0.13 0.93 -0.31 0.00 0.31 0.00 0.00 61.69 62.50 2ptu s THR 37 Cb -0.17 -3.73 -0.11 0.00 0.01 0.00 0.00 72.50 68.51 2ptu s THR 37 CO 0.05 -0.22 1.57 -1.61 -0.69 0.00 0.00 174.62 173.71 2ptu s GLU 38 N 4.28 4.19 0.39 4.92 0.41 0.04 -4.21 118.70 128.72 2ptu s GLU 38 Ca 0.68 2.45 -0.27 0.00 -0.41 0.00 0.00 54.97 57.41 2ptu s GLU 38 Cb -0.26 -3.09 -0.11 0.00 -1.78 0.00 0.00 34.13 28.89 2ptu s GLU 38 CO 0.26 -0.59 1.46 1.04 -0.49 0.00 0.00 175.26 176.94 2ptu n GLN 39 N 3.08 2.55 -1.67 1.61 6.02 -1.26 -2.13 117.38 125.58 2ptu n GLN 39 Ca 0.11 0.90 -0.11 0.00 -0.01 0.00 0.00 57.00 57.88 2ptu n GLN 39 Cb 0.38 -2.64 -0.03 0.00 1.02 0.00 0.00 30.24 28.97 2ptu n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ptu n GLY 40 N 0.50 0.74 3.83 1.08 0.00 -1.26 -5.00 105.19 105.08 2ptu n GLY 40 Ca 0.02 -0.47 -0.06 0.00 0.00 0.00 0.00 46.02 45.51 2ptu n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ptu s SER 41 N -2.73 -0.12 0.00 1.61 1.04 -0.91 -5.04 113.70 107.55 2ptu s SER 41 Ca 0.00 -0.76 0.13 0.00 0.48 0.00 0.00 55.95 55.81 2ptu s SER 41 Cb 0.00 0.70 0.14 0.00 0.10 0.00 0.00 66.02 66.95 2ptu s SER 41 CO 0.00 -1.33 0.97 1.41 0.98 0.00 0.00 173.24 175.27 2ptu n HIS 42 N -0.52 0.07 -2.01 5.02 -0.00 -1.26 -4.53 115.22 111.99 2ptu n HIS 42 Ca -0.06 -0.06 -0.42 0.00 -0.00 0.00 0.00 57.72 57.18 2ptu n HIS 42 Cb 0.60 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.56 2ptu n HIS 42 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2ptu s ARG 43 N -1.11 4.22 -0.22 -0.41 3.52 -1.26 -4.84 118.95 118.85 2ptu s ARG 43 Ca 0.17 2.22 -0.14 0.00 -0.13 0.00 0.00 55.73 57.85 2ptu s ARG 43 Cb 0.12 -3.62 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 2ptu s ARG 43 CO 0.17 -0.70 0.33 0.15 -0.81 0.00 0.00 175.30 174.44 2ptu s LYS 44 N 2.69 4.12 0.02 5.12 1.02 -1.26 -0.78 119.74 130.67 2ptu s LYS 44 Ca 0.71 0.05 -0.16 0.00 0.02 0.00 0.00 55.97 56.59 2ptu s LYS 44 Cb -0.37 -3.55 -0.06 0.00 -0.52 0.00 0.00 37.83 33.33 2ptu s LYS 44 CO 0.31 -0.04 0.45 -1.50 -0.92 0.00 0.00 175.35 173.64 2ptu s ILE 45 N 1.35 4.96 0.00 2.17 2.07 0.51 -4.95 121.20 127.30 2ptu s ILE 45 Ca 0.15 0.94 -0.19 0.00 -1.41 0.00 0.00 60.65 60.14 2ptu s ILE 45 Cb -0.15 -3.76 -0.06 0.00 0.13 0.00 0.00 42.46 38.63 2ptu s ILE 45 CO 0.07 0.57 0.55 -1.61 -1.91 0.00 0.00 174.94 172.62 2ptu s GLU 46 N -1.07 4.24 -0.15 3.50 2.02 -1.26 -1.18 118.70 124.79 2ptu s GLU 46 Ca 0.25 0.67 -0.11 0.00 0.02 0.00 0.00 54.97 55.80 2ptu s GLU 46 Cb -0.17 -3.31 -0.07 0.00 0.10 0.00 0.00 34.13 30.68 2ptu s GLU 46 CO 0.15 0.45 -0.25 -0.89 0.02 0.00 0.00 175.26 174.75 2ptu n ILE 47 N 2.46 1.20 -3.77 -1.63 5.41 0.83 -4.62 119.36 119.23 2ptu n ILE 47 Ca -0.09 -0.07 -0.13 0.00 1.00 0.00 0.00 62.75 63.46 2ptu n ILE 47 Cb 0.51 -1.90 -0.12 0.00 -0.71 0.00 0.00 39.64 37.41 2ptu n ILE 47 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 2ptu s LEU 48 N -7.28 0.92 -0.03 1.39 1.98 -1.11 -1.08 118.68 113.47 2ptu s LEU 48 Ca -0.24 0.45 0.07 0.00 -2.89 0.00 0.00 54.13 51.52 2ptu s LEU 48 Cb 0.07 0.71 -0.02 0.00 0.66 0.00 0.00 46.19 47.62 2ptu s LEU 48 CO 0.32 -0.11 -0.24 0.20 -1.89 0.00 0.00 176.35 174.63 2ptu s ASN 49 N 0.52 2.89 -0.31 3.68 0.01 -0.72 -0.89 114.94 120.11 2ptu s ASN 49 Ca -0.03 -0.46 0.02 0.00 -0.71 0.00 0.00 52.86 51.68 2ptu s ASN 49 Cb -0.05 -0.49 0.09 0.00 0.41 0.00 0.00 41.25 41.22 2ptu s ASN 49 CO -0.03 0.28 0.04 0.86 -1.51 0.00 0.00 177.10 176.74 2ptu s TRP 50 N -0.42 2.80 0.00 2.20 -0.11 0.11 0.42 118.94 123.94 2ptu s TRP 50 Ca 0.05 -2.33 0.00 0.00 1.22 0.00 0.00 56.10 55.04 2ptu s TRP 50 Cb -0.11 -2.24 0.00 0.00 -1.50 0.00 0.00 33.47 29.62 2ptu s TRP 50 CO 0.01 -0.89 0.00 0.66 -4.62 0.00 0.00 176.95 172.10 2ptu n TYR 51 N 4.54 0.00 0.96 5.86 4.02 -1.25 -1.60 117.16 129.68 2ptu n TYR 51 Ca -0.01 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.00 2ptu n TYR 51 Cb 0.42 0.00 0.28 0.00 -0.02 0.00 0.00 39.34 40.02 2ptu n TYR 51 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2ptu n ASN 52 N 0.00 2.55 -0.60 7.72 6.94 -1.26 -4.17 115.26 126.44 2ptu n ASN 52 Ca 0.00 -1.84 0.06 0.00 -0.02 0.00 0.00 54.58 52.79 2ptu n ASN 52 Cb 0.00 -0.09 0.15 0.00 -2.36 0.00 0.00 39.78 37.48 2ptu n ASN 52 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2ptu n ASP 53 N 0.94 1.64 -0.19 0.53 8.00 -1.26 -5.12 116.55 121.10 2ptu n ASP 53 Ca 0.17 -3.29 0.03 0.00 0.71 0.00 0.00 54.79 52.40 2ptu n ASP 53 Cb 0.50 -0.45 -0.01 0.00 -0.02 0.00 0.00 41.12 41.14 2ptu n ASP 53 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ptu n GLY 54 N -0.88 -1.54 3.63 0.44 0.00 -1.26 -4.74 105.19 100.84 2ptu n GLY 54 Ca 0.15 -1.48 -0.43 0.00 0.00 0.00 0.00 46.02 44.26 2ptu n GLY 54 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2ptu s PRO 55 N -1.43 3.87 -0.14 1.61 0.02 -1.26 -3.89 135.00 133.78 2ptu s PRO 55 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 61.00 62.43 2ptu s PRO 55 Cb 0.00 -3.94 -0.01 0.00 0.02 0.00 0.00 34.50 30.58 2ptu s PRO 55 CO 0.00 -1.18 -0.15 -1.54 -0.33 0.00 0.00 177.00 173.80 2ptu s SER 56 N 3.33 3.76 0.31 2.53 1.04 0.17 -4.94 113.70 119.89 2ptu s SER 56 Ca 0.62 -0.42 -0.29 0.00 0.48 0.00 0.00 55.95 56.34 2ptu s SER 56 Cb -0.20 -1.57 -0.10 0.00 0.10 0.00 0.00 66.02 64.25 2ptu s SER 56 CO 0.25 0.12 1.37 0.26 0.98 0.00 0.00 173.24 176.23 2ptu s TRP 57 N 0.62 2.98 0.18 5.02 0.52 -1.26 -1.76 118.94 125.24 2ptu s TRP 57 Ca -0.08 1.25 0.27 0.00 0.02 0.00 0.00 56.10 57.56 2ptu s TRP 57 Cb -0.16 -3.77 1.12 0.00 -1.15 0.00 0.00 33.47 29.51 2ptu s TRP 57 CO 0.03 -2.27 1.91 0.77 0.02 0.00 0.00 176.95 177.40 2ptu h SER 58 N 3.89 0.00 -4.67 2.95 0.02 -1.36 -3.43 113.55 110.95 2ptu h SER 58 Ca -0.48 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.15 2ptu h SER 58 Cb 1.22 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.55 2ptu h SER 58 CO 0.69 0.16 -0.75 0.20 -1.14 0.00 0.00 176.83 176.00 2ptu s ASN 59 N -6.07 1.14 0.37 3.07 0.01 -1.26 -5.06 114.94 107.14 2ptu s ASN 59 Ca -0.00 -0.58 0.10 0.00 -0.71 0.00 0.00 52.86 51.67 2ptu s ASN 59 Cb 0.10 0.01 0.85 0.00 0.41 0.00 0.00 41.25 42.63 2ptu s ASN 59 CO 0.61 -0.16 1.90 0.58 -1.51 0.00 0.00 177.10 178.51 2ptu h VAL 60 N 4.42 0.86 0.00 1.60 2.07 -2.01 -2.09 116.25 121.10 2ptu h VAL 60 Ca -0.38 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 2ptu h VAL 60 Cb 1.20 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2ptu h VAL 60 CO 0.41 0.12 -0.34 0.77 0.02 0.00 0.00 177.57 178.54 2ptu h SER 61 N 0.64 0.00 -0.07 0.57 4.64 -1.98 -3.26 113.55 114.10 2ptu h SER 61 Ca 0.40 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.74 2ptu h SER 61 Cb 0.65 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2ptu h SER 61 CO -0.16 0.34 0.08 -0.26 -0.87 0.00 0.00 176.83 175.95 2ptu h PHE 62 N 0.00 0.00 0.00 4.77 -1.00 -1.78 -1.19 116.94 117.73 2ptu h PHE 62 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2ptu h PHE 62 Cb 0.84 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.40 2ptu h PHE 62 CO 0.00 0.00 0.00 -1.13 -1.61 0.00 0.00 178.31 175.57 2ptu n SER 63 N -3.89 0.70 -0.00 2.17 3.41 -1.23 -0.87 113.62 113.91 2ptu n SER 63 Ca -0.01 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.30 2ptu n SER 63 Cb 0.17 -0.77 -0.13 0.00 -0.26 0.00 0.00 64.21 63.22 2ptu n SER 63 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2ptu n ASP 64 N -2.19 0.77 -0.13 4.04 8.00 -0.46 -4.57 116.55 122.00 2ptu n ASP 64 Ca 0.04 -0.77 -0.25 0.00 0.71 0.00 0.00 54.79 54.53 2ptu n ASP 64 Cb 0.35 1.23 -0.11 0.00 -0.02 0.00 0.00 41.12 42.57 2ptu n ASP 64 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2ptu n ILE 65 N -1.68 1.52 -3.49 0.53 5.41 -1.00 -4.87 119.36 115.79 2ptu n ILE 65 Ca 0.02 -0.46 -0.20 0.00 1.00 0.00 0.00 62.75 63.11 2ptu n ILE 65 Cb 0.39 -1.69 -0.02 0.00 -0.71 0.00 0.00 39.64 37.61 2ptu n ILE 65 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2ptu s TYR 66 N -2.51 2.75 0.07 1.39 2.02 -0.05 -1.34 117.35 119.69 2ptu s TYR 66 Ca -0.37 -0.45 0.03 0.00 -0.37 0.00 0.00 57.07 55.91 2ptu s TYR 66 Cb 0.12 -2.17 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 2ptu s TYR 66 CO 0.54 -0.14 -0.09 0.20 -1.57 0.00 0.00 175.55 174.49 2ptu s GLY 67 N -4.16 0.70 -0.02 0.71 0.00 -0.53 -4.68 107.32 99.34 2ptu s GLY 67 Ca 0.49 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 44.22 2ptu s GLY 67 CO 0.29 -1.06 -0.05 -0.12 0.00 0.00 0.00 173.10 172.16 2ptu s PHE 68 N -1.93 0.61 -0.33 1.90 5.36 -1.26 -1.62 117.98 120.71 2ptu s PHE 68 Ca -0.02 -0.13 -0.13 0.00 -0.96 0.00 0.00 56.93 55.69 2ptu s PHE 68 Cb -0.06 -0.48 -0.02 0.00 -0.34 0.00 0.00 43.02 42.12 2ptu s PHE 68 CO 0.00 -0.08 0.25 0.34 -1.46 0.00 0.00 175.22 174.27 2ptu s ASP 69 N 0.33 6.07 0.30 6.13 2.15 -0.37 -4.96 116.67 126.31 2ptu s ASP 69 Ca -0.04 -0.29 0.09 0.00 0.43 0.00 0.00 52.55 52.75 2ptu s ASP 69 Cb -0.08 -2.14 0.45 0.00 -0.30 0.00 0.00 42.92 40.85 2ptu s ASP 69 CO -0.00 -0.21 1.68 1.88 -0.17 0.00 0.00 175.17 178.35 2ptu h TYR 70 N 8.45 0.10 0.44 -5.34 0.05 -1.96 0.46 116.97 119.18 2ptu h TYR 70 Ca -0.32 -0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.41 2ptu h TYR 70 Cb 1.16 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.89 2ptu h TYR 70 CO 0.69 0.58 -0.21 0.78 -1.05 0.00 0.00 178.16 178.95 2ptu h GLY 71 N 1.48 -0.61 -1.19 3.88 0.00 -1.99 -3.38 103.07 101.26 2ptu h GLY 71 Ca -0.00 0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2ptu h GLY 71 CO 0.07 -0.22 0.00 2.09 0.00 0.00 0.00 176.54 178.48 2ptu n ASP 72 N -5.21 2.90 -0.93 0.19 5.68 -1.22 -4.93 116.55 113.03 2ptu n ASP 72 Ca -0.10 -2.05 -0.12 0.00 -0.50 0.00 0.00 54.79 52.02 2ptu n ASP 72 Cb 0.29 -0.23 -0.05 0.00 -1.14 0.00 0.00 41.12 39.99 2ptu n ASP 72 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2ptu n PHE 73 N 0.39 0.00 -2.60 2.11 3.01 0.16 -4.59 117.46 115.93 2ptu n PHE 73 Ca 0.11 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.17 2ptu n PHE 73 Cb 0.44 -2.40 -0.05 0.00 -0.01 0.00 0.00 39.48 37.46 2ptu n PHE 73 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ptu s ALA 74 N -2.32 3.36 -0.19 4.37 0.00 -1.21 -4.78 121.76 120.99 2ptu s ALA 74 Ca 0.00 0.75 -0.06 0.00 0.00 0.00 0.00 51.96 52.65 2ptu s ALA 74 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2ptu s ALA 74 CO 0.00 -0.05 0.02 -1.17 0.00 0.00 0.00 175.76 174.56 2ptu s LEU 75 N -0.86 3.48 0.21 0.00 2.96 -0.78 -1.24 118.68 122.44 2ptu s LEU 75 Ca 0.45 -0.08 0.10 0.00 -0.22 0.00 0.00 54.13 54.38 2ptu s LEU 75 Cb -0.28 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 2ptu s LEU 75 CO 0.35 0.12 -0.11 -0.94 -1.32 0.00 0.00 176.35 174.46 2ptu s SER 76 N 0.66 4.15 -0.14 3.68 1.04 -0.64 -0.34 113.70 122.10 2ptu s SER 76 Ca 0.01 -0.67 -0.00 0.00 0.48 0.00 0.00 55.95 55.77 2ptu s SER 76 Cb -0.14 -0.65 -0.01 0.00 0.10 0.00 0.00 66.02 65.32 2ptu s SER 76 CO 0.02 0.08 -0.13 -0.63 0.98 0.00 0.00 173.24 173.56 2ptu s ILE 77 N -1.90 2.95 0.03 -1.02 1.01 -0.02 -1.45 121.20 120.80 2ptu s ILE 77 Ca 0.26 -0.69 0.23 0.00 0.00 0.00 0.00 60.65 60.46 2ptu s ILE 77 Cb -0.08 -2.24 0.23 0.00 0.01 0.00 0.00 42.46 40.38 2ptu s ILE 77 CO 0.15 0.51 1.76 0.11 0.00 0.00 0.00 174.94 177.48 2ptu h LYS 78 N 6.97 0.00 -0.66 2.79 1.57 -1.49 -1.47 116.57 124.28 2ptu h LYS 78 Ca -0.29 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 2ptu h LYS 78 Cb 1.20 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.34 2ptu h LYS 78 CO 0.56 0.23 -0.32 0.45 -0.57 0.00 0.00 179.45 179.80 2ptu s SER 79 N -6.19 -0.99 0.57 0.86 0.15 -1.26 -3.27 113.70 103.58 2ptu s SER 79 Ca 0.02 -0.83 -0.19 0.00 0.70 0.00 0.00 55.95 55.65 2ptu s SER 79 Cb 0.09 1.28 -0.06 0.00 -1.71 0.00 0.00 66.02 65.62 2ptu s SER 79 CO 0.65 -0.07 0.98 0.00 1.20 0.00 0.00 173.24 175.99 2ptu n ALA 80 N 3.46 0.21 -2.27 5.45 0.00 -0.35 -4.64 120.51 122.37 2ptu n ALA 80 Ca 0.12 0.04 -0.15 0.00 0.00 0.00 0.00 53.44 53.45 2ptu n ALA 80 Cb 0.60 -2.11 -0.10 0.00 0.00 0.00 0.00 19.45 17.84 2ptu n ALA 80 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2ptu s LYS 81 N -2.63 1.13 0.30 0.00 1.02 -1.26 -0.35 119.74 117.95 2ptu s LYS 81 Ca 0.73 -1.49 0.04 0.00 0.02 0.00 0.00 55.97 55.27 2ptu s LYS 81 Cb -0.44 -0.73 0.65 0.00 -0.52 0.00 0.00 37.83 36.79 2ptu s LYS 81 CO 0.49 0.09 1.83 -0.07 -0.92 0.00 0.00 175.35 176.77 2ptu h LEU 82 N 2.72 0.84 -1.26 3.17 4.07 -1.95 -0.80 115.31 122.10 2ptu h LEU 82 Ca -0.37 0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.65 2ptu h LEU 82 Cb 1.20 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.83 2ptu h LEU 82 CO 0.63 0.42 0.00 0.06 -1.08 0.00 0.00 178.44 178.47 2ptu h GLN 83 N 0.89 0.00 0.00 1.13 3.07 -1.97 -2.44 115.11 115.79 2ptu h GLN 83 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.24 2ptu h GLN 83 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.18 2ptu h GLN 83 CO -0.27 0.00 0.00 -0.25 0.09 0.00 0.00 178.83 178.40 2ptu n ASP 84 N -2.32 0.36 -4.73 0.06 8.00 -0.31 -4.78 116.55 112.83 2ptu n ASP 84 Ca -0.00 0.55 -0.36 0.00 0.71 0.00 0.00 54.79 55.69 2ptu n ASP 84 Cb 0.11 -0.64 0.08 0.00 -0.02 0.00 0.00 41.12 40.65 2ptu n ASP 84 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2ptu s SER 85 N -3.67 4.48 0.00 -2.24 0.01 -0.92 -4.88 113.70 106.49 2ptu s SER 85 Ca 0.11 2.47 0.00 0.00 1.31 0.00 0.00 55.95 59.84 2ptu s SER 85 Cb 0.14 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2ptu s SER 85 CO 0.50 -2.08 0.00 0.61 0.41 0.00 0.00 173.24 172.68 2ptu n GLY 86 N 0.62 0.92 3.64 3.44 0.00 -0.83 -4.79 105.19 108.19 2ptu n GLY 86 Ca 0.14 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 2ptu n GLY 86 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2ptu s HIS 87 N -1.42 3.32 -0.04 1.61 5.65 -1.26 -0.81 115.29 122.34 2ptu s HIS 87 Ca 0.00 0.68 0.05 0.00 0.25 0.00 0.00 55.06 56.05 2ptu s HIS 87 Cb 0.00 -2.67 -0.02 0.00 -1.18 0.00 0.00 32.58 28.71 2ptu s HIS 87 CO 0.00 -0.17 -0.19 0.71 -0.65 0.00 0.00 174.74 174.44 2ptu s TYR 88 N 1.90 2.56 -0.07 3.88 1.51 0.19 -0.98 117.35 126.34 2ptu s TYR 88 Ca 0.22 -0.30 0.02 0.00 -1.01 0.00 0.00 57.07 56.00 2ptu s TYR 88 Cb -0.15 -1.59 0.02 0.00 -0.11 0.00 0.00 41.96 40.12 2ptu s TYR 88 CO 0.09 0.08 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.33 2ptu s LEU 89 N -0.63 1.55 -0.33 -1.29 2.96 0.54 -0.46 118.68 121.02 2ptu s LEU 89 Ca 0.10 -0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 53.64 2ptu s LEU 89 Cb -0.11 -0.78 0.01 0.00 0.50 0.00 0.00 46.19 45.81 2ptu s LEU 89 CO 0.00 0.00 0.15 -0.22 -1.32 0.00 0.00 176.35 174.97 2ptu s LEU 90 N 0.83 4.29 -0.19 -0.68 0.20 -0.92 -0.52 118.68 121.68 2ptu s LEU 90 Ca -0.12 -0.80 -0.07 0.00 0.69 0.00 0.00 54.13 53.83 2ptu s LEU 90 Cb -0.15 -1.97 -0.04 0.00 -0.43 0.00 0.00 46.19 43.60 2ptu s LEU 90 CO 0.02 -0.27 0.06 -1.61 -0.29 0.00 0.00 176.35 174.25 2ptu s GLU 91 N 1.54 3.91 -0.15 1.98 2.02 -0.23 -0.95 118.70 126.83 2ptu s GLU 91 Ca 0.03 -0.37 0.01 0.00 0.02 0.00 0.00 54.97 54.65 2ptu s GLU 91 Cb -0.18 -3.23 0.00 0.00 0.10 0.00 0.00 34.13 30.82 2ptu s GLU 91 CO 0.05 0.19 -0.17 0.42 0.02 0.00 0.00 175.26 175.77 2ptu s ILE 92 N 0.59 2.49 -0.06 -1.63 1.01 -0.48 -0.77 121.20 122.35 2ptu s ILE 92 Ca 0.03 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.86 2ptu s ILE 92 Cb -0.13 -2.03 0.02 0.00 0.01 0.00 0.00 42.46 40.32 2ptu s ILE 92 CO 0.01 0.53 -0.11 0.28 0.00 0.00 0.00 174.94 175.65 2ptu s THR 93 N 0.75 1.02 0.60 2.92 -1.32 0.06 0.12 115.64 119.79 2ptu s THR 93 Ca -0.07 -0.41 0.03 0.00 -1.21 0.00 0.00 61.69 60.04 2ptu s THR 93 Cb -0.16 -0.95 0.11 0.00 -1.51 0.00 0.00 72.50 70.00 2ptu s THR 93 CO 0.00 0.33 0.83 -0.46 -2.21 0.00 0.00 174.62 173.11 2ptu n ASN 94 N 3.89 1.49 0.14 8.08 0.23 -1.10 0.23 115.26 128.21 2ptu n ASN 94 Ca -0.23 -2.17 0.05 0.00 -0.53 0.00 0.00 54.58 51.70 2ptu n ASN 94 Cb 0.51 -0.50 0.50 0.00 -2.08 0.00 0.00 39.78 38.21 2ptu n ASN 94 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 2ptu h THR 95 N -0.31 1.09 0.00 5.53 1.35 -1.93 -2.20 112.91 116.44 2ptu h THR 95 Ca -0.27 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2ptu h THR 95 Cb 1.11 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 2ptu h THR 95 CO 0.33 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.32 2ptu n GLY 96 N -1.31 -0.84 0.46 5.82 0.00 -1.26 -4.89 105.19 103.17 2ptu n GLY 96 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2ptu n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ptu n GLY 97 N 0.12 2.51 3.70 -0.02 0.00 -0.83 -5.06 105.19 105.62 2ptu n GLY 97 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2ptu n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ptu s LYS 98 N -0.88 4.31 -0.06 1.61 1.02 -1.26 -4.79 119.74 119.69 2ptu s LYS 98 Ca 0.00 1.98 -0.13 0.00 0.02 0.00 0.00 55.97 57.84 2ptu s LYS 98 Cb 0.00 -3.46 -0.05 0.00 -0.52 0.00 0.00 37.83 33.80 2ptu s LYS 98 CO 0.00 -0.50 0.33 0.14 -0.92 0.00 0.00 175.35 174.40 2ptu s VAL 99 N 1.90 5.19 -0.22 3.17 -7.23 -1.26 -2.72 120.40 119.24 2ptu s VAL 99 Ca 0.64 0.66 -0.00 0.00 -1.81 0.00 0.00 61.98 61.46 2ptu s VAL 99 Cb -0.33 -3.64 0.02 0.00 0.56 0.00 0.00 36.38 33.00 2ptu s VAL 99 CO 0.28 0.54 -0.12 0.00 -0.31 0.00 0.00 175.10 175.49 2ptu s ASN 101 N 1.30 5.61 -0.32 0.00 0.01 -1.26 -1.38 114.94 118.91 2ptu s ASN 101 Ca 0.02 0.11 0.03 0.00 -0.71 0.00 0.00 52.86 52.31 2ptu s ASN 101 Cb -0.15 -1.91 0.09 0.00 0.41 0.00 0.00 41.25 39.69 2ptu s ASN 101 CO -0.08 0.22 0.02 -0.54 -1.51 0.00 0.00 177.10 175.21 2ptu s LYS 102 N 0.11 1.50 0.10 -0.60 -0.14 -0.12 -2.95 119.74 117.63 2ptu s LYS 102 Ca 0.05 -1.62 -0.17 0.00 -1.36 0.00 0.00 55.97 52.86 2ptu s LYS 102 Cb -0.12 -2.95 -0.07 0.00 -1.68 0.00 0.00 37.83 33.01 2ptu s LYS 102 CO 0.01 -0.87 0.55 -0.80 -0.76 0.00 0.00 175.35 173.49 2ptu s ASN 103 N 1.06 6.97 -0.00 2.83 0.01 -0.22 -2.16 114.94 123.43 2ptu s ASN 103 Ca 0.07 1.18 0.03 0.00 -0.71 0.00 0.00 52.86 53.43 2ptu s ASN 103 Cb -0.19 -2.33 -0.01 0.00 0.41 0.00 0.00 41.25 39.13 2ptu s ASN 103 CO -0.10 0.22 -0.09 -0.36 -1.51 0.00 0.00 177.10 175.26 2ptu s PHE 104 N -1.23 0.83 -0.24 2.20 0.08 0.39 -1.42 117.98 118.59 2ptu s PHE 104 Ca 0.32 -0.17 -0.03 0.00 0.12 0.00 0.00 56.93 57.16 2ptu s PHE 104 Cb -0.18 -0.53 0.01 0.00 -0.57 0.00 0.00 43.02 41.75 2ptu s PHE 104 CO 0.19 -0.01 -0.03 -1.14 -0.10 0.00 0.00 175.22 174.12 2ptu s GLN 105 N -0.29 3.14 -0.19 0.44 2.00 -0.74 -0.64 119.66 123.39 2ptu s GLN 105 Ca 0.03 -0.79 -0.09 0.00 -2.00 0.00 0.00 55.36 52.51 2ptu s GLN 105 Cb -0.04 -3.05 -0.05 0.00 0.80 0.00 0.00 33.01 30.68 2ptu s GLN 105 CO -0.00 -0.31 0.13 -1.17 -0.50 0.00 0.00 175.29 173.44 2ptu s LEU 106 N 1.43 4.21 -0.16 3.68 2.96 0.01 -1.34 118.68 129.45 2ptu s LEU 106 Ca 0.03 0.26 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 2ptu s LEU 106 Cb -0.15 -2.08 0.02 0.00 0.50 0.00 0.00 46.19 44.48 2ptu s LEU 106 CO -0.03 0.22 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.26 2ptu s LEU 107 N 0.14 2.08 -0.22 -0.68 1.02 -0.16 -1.97 118.68 118.89 2ptu s LEU 107 Ca 0.09 -0.62 -0.07 0.00 0.02 0.00 0.00 54.13 53.55 2ptu s LEU 107 Cb -0.11 -1.43 -0.03 0.00 0.02 0.00 0.00 46.19 44.63 2ptu s LEU 107 CO -0.01 0.02 0.06 -0.63 0.02 0.00 0.00 176.35 175.81 2ptu s ILE 108 N 1.17 4.40 -0.08 -0.59 -1.09 -1.26 -0.63 121.20 123.12 2ptu s ILE 108 Ca 0.01 -0.15 -0.11 0.00 -2.23 0.00 0.00 60.65 58.17 2ptu s ILE 108 Cb -0.14 -3.02 -0.05 0.00 -1.58 0.00 0.00 42.46 37.67 2ptu s ILE 108 CO -0.10 0.39 0.27 -0.76 -1.23 0.00 0.00 174.94 173.52 2ptu s LEU 109 N 1.15 4.39 0.00 2.97 1.02 -0.54 -4.83 118.68 122.84 2ptu s LEU 109 Ca 0.04 0.67 0.00 0.00 0.02 0.00 0.00 54.13 54.86 2ptu s LEU 109 Cb -0.14 -2.33 0.00 0.00 0.02 0.00 0.00 46.19 43.73 2ptu s LEU 109 CO 0.03 0.31 0.00 0.47 0.02 0.00 0.00 176.35 177.18