#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nld s VAL 2 N 0.00 -0.87 -0.28 -0.39 1.01 -1.26 -3.57 120.40 115.04 1nld s VAL 2 Ca 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 61.98 61.73 1nld s VAL 2 Cb 0.00 -0.94 0.10 0.00 0.00 0.00 0.00 36.38 35.54 1nld s VAL 2 CO 0.00 -0.04 0.87 -1.59 0.00 0.00 0.00 175.10 174.34 1nld s LYS 3 N 2.76 0.63 -0.59 2.72 -2.85 -0.78 -4.98 119.74 116.64 1nld s LYS 3 Ca 0.18 0.84 -0.17 0.00 -1.00 0.00 0.00 55.97 55.82 1nld s LYS 3 Cb -0.15 0.26 0.13 0.00 -2.06 0.00 0.00 37.83 36.01 1nld s LYS 3 CO -0.19 -0.09 0.61 -0.51 0.10 0.00 0.00 175.35 175.27 1nld s LEU 4 N 0.65 5.93 -0.08 2.77 1.02 -1.26 -2.52 118.68 125.19 1nld s LEU 4 Ca -0.02 -1.75 -0.20 0.00 0.02 0.00 0.00 54.13 52.18 1nld s LEU 4 Cb -0.05 -2.25 -0.04 0.00 0.02 0.00 0.00 46.19 43.87 1nld s LEU 4 CO -0.07 -0.93 0.57 0.00 0.02 0.00 0.00 176.35 175.94 1nld s GLN 5 N 1.89 4.36 0.31 1.70 0.00 -0.65 -3.70 119.66 123.57 1nld s GLN 5 Ca 0.08 0.65 0.10 0.00 -0.00 0.00 0.00 55.36 56.19 1nld s GLN 5 Cb -0.25 -3.42 -0.05 0.00 0.00 0.00 0.00 33.01 29.29 1nld s GLN 5 CO 0.03 0.18 -0.02 1.14 0.00 0.00 0.00 175.29 176.61 1nld s GLN 6 N 0.50 2.08 -0.12 9.60 -2.07 -1.26 -0.21 119.66 128.18 1nld s GLN 6 Ca 0.31 -1.66 -0.13 0.00 -1.82 0.00 0.00 55.36 52.06 1nld s GLN 6 Cb -0.17 -1.97 0.03 0.00 -1.09 0.00 0.00 33.01 29.81 1nld s GLN 6 CO 0.14 0.23 0.36 -1.54 -1.32 0.00 0.00 175.29 173.16 1nld s SER 7 N -3.68 -0.36 -0.10 12.60 1.04 -0.37 -4.97 113.70 117.88 1nld s SER 7 Ca 0.33 0.66 -0.32 0.00 0.48 0.00 0.00 55.95 57.10 1nld s SER 7 Cb -0.03 0.69 0.13 0.00 0.10 0.00 0.00 66.02 66.91 1nld s SER 7 CO 0.19 -0.16 1.42 -0.83 0.98 0.00 0.00 173.24 174.83 1nld s GLY 8 N 0.02 -0.40 0.31 7.32 0.00 -1.26 -0.32 107.32 112.98 1nld s GLY 8 Ca -0.02 0.66 -0.29 0.00 0.00 0.00 0.00 44.72 45.08 1nld s GLY 8 CO 0.01 2.78 1.14 2.56 0.00 0.00 0.00 173.10 179.59 1nld s PRO 9 N -2.01 4.50 0.24 2.90 0.04 -1.26 -4.95 135.00 134.46 1nld s PRO 9 Ca 0.22 1.86 0.23 0.00 0.04 0.00 0.00 61.00 63.35 1nld s PRO 9 Cb 0.05 -3.08 0.09 0.00 0.04 0.00 0.00 34.50 31.60 1nld s PRO 9 CO -0.05 0.07 1.16 0.78 0.04 0.00 0.00 177.00 179.00 1nld h GLY 10 N 3.54 0.00 -4.64 0.56 0.00 -1.93 -3.41 103.07 97.18 1nld h GLY 10 Ca -0.47 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.34 1nld h GLY 10 CO 0.66 0.00 -0.82 -2.27 0.00 0.00 0.00 176.54 174.11 1nld s LEU 11 N -5.42 2.15 -0.00 3.11 2.96 -1.26 -0.34 118.68 119.88 1nld s LEU 11 Ca 0.01 -0.47 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 1nld s LEU 11 Cb 0.09 -0.81 0.01 0.00 0.50 0.00 0.00 46.19 45.98 1nld s LEU 11 CO 0.76 0.11 0.22 -0.69 -1.32 0.00 0.00 176.35 175.43 1nld s VAL 12 N -0.77 0.07 -0.02 1.68 1.01 0.58 -4.89 120.40 118.07 1nld s VAL 12 Ca 0.05 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.38 1nld s VAL 12 Cb -0.08 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 1nld s VAL 12 CO 0.01 -0.33 0.21 -1.58 0.00 0.00 0.00 175.10 173.41 1nld s GLN 13 N -1.41 3.49 0.18 2.72 0.74 -1.26 -0.94 119.66 123.18 1nld s GLN 13 Ca -0.14 -0.20 -0.31 0.00 0.05 0.00 0.00 55.36 54.76 1nld s GLN 13 Cb -0.06 -3.11 -0.16 0.00 1.10 0.00 0.00 33.01 30.78 1nld s GLN 13 CO 0.03 0.68 0.88 -2.30 -0.55 0.00 0.00 175.29 174.03 1nld n PRO 14 N 1.18 0.62 0.00 1.67 -0.02 -1.26 -1.26 135.00 135.93 1nld n PRO 14 Ca -0.12 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 1nld n PRO 14 Cb 0.53 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 1nld n PRO 14 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1nld n SER 15 N 1.77 0.00 -4.62 2.55 7.64 0.66 -4.92 113.62 116.69 1nld n SER 15 Ca 0.16 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.65 1nld n SER 15 Cb 0.24 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.48 1nld n SER 15 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1nld n GLN 16 N 0.00 1.14 -1.71 1.43 7.27 -0.39 -2.57 117.38 122.56 1nld n GLN 16 Ca 0.00 0.43 -0.30 0.00 0.07 0.00 0.00 57.00 57.20 1nld n GLN 16 Cb 0.00 -2.16 0.07 0.00 2.41 0.00 0.00 30.24 30.55 1nld n GLN 16 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1nld s SER 17 N -1.03 4.94 -0.04 1.69 0.01 -1.26 -2.79 113.70 115.22 1nld s SER 17 Ca 0.71 1.23 0.03 0.00 1.31 0.00 0.00 55.95 59.22 1nld s SER 17 Cb -0.46 -1.99 0.01 0.00 0.21 0.00 0.00 66.02 63.79 1nld s SER 17 CO 0.51 -1.67 -0.11 -0.22 0.41 0.00 0.00 173.24 172.16 1nld s LEU 18 N -5.58 1.72 -0.06 2.44 2.96 -0.48 -4.97 118.68 114.71 1nld s LEU 18 Ca 0.60 -0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 54.26 1nld s LEU 18 Cb -0.13 -0.70 0.03 0.00 0.50 0.00 0.00 46.19 45.89 1nld s LEU 18 CO 0.53 0.06 -0.01 -0.44 -1.32 0.00 0.00 176.35 175.17 1nld s SER 19 N 0.37 1.32 -0.05 3.68 0.01 -1.26 -1.07 113.70 116.69 1nld s SER 19 Ca -0.07 -0.09 0.06 0.00 1.31 0.00 0.00 55.95 57.15 1nld s SER 19 Cb -0.12 -0.42 -0.01 0.00 0.21 0.00 0.00 66.02 65.68 1nld s SER 19 CO 0.02 -0.15 -0.23 -0.63 0.41 0.00 0.00 173.24 172.66 1nld s ILE 20 N 1.63 1.88 -0.26 1.44 1.01 0.57 -4.35 121.20 123.12 1nld s ILE 20 Ca -0.00 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.62 1nld s ILE 20 Cb -0.13 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.74 1nld s ILE 20 CO -0.04 0.53 0.04 -0.89 0.00 0.00 0.00 174.94 174.58 1nld s THR 21 N -0.12 3.82 -0.31 2.92 2.01 0.56 -1.30 115.64 123.22 1nld s THR 21 Ca -0.03 -0.53 -0.14 0.00 0.31 0.00 0.00 61.69 61.30 1nld s THR 21 Cb -0.13 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 1nld s THR 21 CO 0.03 0.25 0.31 0.00 -0.69 0.00 0.00 174.62 174.51 1nld s THR 23 N 1.93 4.16 0.71 0.00 2.01 0.70 -1.27 115.64 123.88 1nld s THR 23 Ca 0.11 -1.76 -0.10 0.00 0.31 0.00 0.00 61.69 60.25 1nld s THR 23 Cb -0.16 -3.72 0.03 0.00 0.01 0.00 0.00 72.50 68.66 1nld s THR 23 CO 0.11 -0.74 1.08 0.68 -0.69 0.00 0.00 174.62 175.06 1nld s VAL 24 N 1.36 3.13 -0.07 3.82 -7.23 -0.56 -1.64 120.40 119.21 1nld s VAL 24 Ca 0.06 0.25 -0.30 0.00 -1.81 0.00 0.00 61.98 60.17 1nld s VAL 24 Cb -0.26 -3.34 0.09 0.00 0.56 0.00 0.00 36.38 33.43 1nld s VAL 24 CO -0.01 -0.43 0.76 -0.94 -0.31 0.00 0.00 175.10 174.18 1nld s SER 25 N -4.41 -0.57 0.00 4.85 1.04 -1.05 -4.85 113.70 108.71 1nld s SER 25 Ca 0.58 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1nld s SER 25 Cb -0.11 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1nld s SER 25 CO 0.50 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.77 1nld n GLY 26 N 0.77 0.81 1.36 7.32 0.00 -1.23 -1.86 105.19 112.36 1nld n GLY 26 Ca -0.16 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 1nld n GLY 26 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1nld n PHE 27 N -2.00 -0.90 -4.52 1.61 -1.74 -1.26 -4.79 117.46 103.87 1nld n PHE 27 Ca 0.00 -0.93 -0.33 0.00 -0.56 0.00 0.00 57.45 55.63 1nld n PHE 27 Cb 0.00 0.23 -0.14 0.00 1.52 0.00 0.00 39.48 41.09 1nld n PHE 27 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1nld s SER 28 N -1.87 4.20 0.00 5.98 1.04 -1.26 -4.99 113.70 116.80 1nld s SER 28 Ca 0.11 -0.31 0.15 0.00 0.48 0.00 0.00 55.95 56.39 1nld s SER 28 Cb -0.01 -1.67 0.68 0.00 0.10 0.00 0.00 66.02 65.13 1nld s SER 28 CO 0.08 0.13 1.49 0.18 0.98 0.00 0.00 173.24 176.09 1nld n LEU 29 N 3.80 0.00 -0.61 2.42 4.77 -1.26 -0.87 117.00 125.24 1nld n LEU 29 Ca -0.18 0.47 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1nld n LEU 29 Cb 0.52 -0.47 0.41 0.00 -2.33 0.00 0.00 43.42 41.55 1nld n LEU 29 CO 0.31 -0.22 0.80 0.35 -1.33 0.00 0.00 177.39 177.30 1nld n THR 30 N -1.47 0.00 0.00 -5.08 -2.24 -1.26 -4.13 114.28 100.10 1nld n THR 30 Ca 0.04 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1nld n THR 30 Cb 0.17 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1nld n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nld s TYR 32 N -0.91 0.06 0.44 0.00 2.02 -0.54 -4.90 117.35 113.53 1nld s TYR 32 Ca 0.00 -0.01 -0.09 0.00 -0.37 0.00 0.00 57.07 56.60 1nld s TYR 32 Cb 0.00 -0.05 -0.06 0.00 -0.40 0.00 0.00 41.96 41.46 1nld s TYR 32 CO 0.00 -0.00 0.80 0.20 -1.57 0.00 0.00 175.55 174.97 1nld s GLY 33 N 0.02 1.82 -0.13 0.71 0.00 -1.26 -4.19 107.32 104.29 1nld s GLY 33 Ca -0.00 -0.26 0.03 0.00 0.00 0.00 0.00 44.72 44.48 1nld s GLY 33 CO -0.00 -0.07 -0.21 0.14 0.00 0.00 0.00 173.10 172.96 1nld s VAL 34 N -2.52 1.97 0.15 1.40 1.01 -0.85 -0.55 120.40 121.00 1nld s VAL 34 Ca 0.51 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.51 1nld s VAL 34 Cb -0.10 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 1nld s VAL 34 CO 0.36 0.53 0.39 -1.00 0.00 0.00 0.00 175.10 175.39 1nld s HIS 35 N 0.80 3.47 -0.19 5.22 3.76 -0.18 -2.72 115.29 125.44 1nld s HIS 35 Ca -0.08 0.59 0.00 0.00 -0.15 0.00 0.00 55.06 55.42 1nld s HIS 35 Cb -0.16 -2.03 0.05 0.00 1.11 0.00 0.00 32.58 31.55 1nld s HIS 35 CO -0.01 0.42 -0.07 -1.58 -0.85 0.00 0.00 174.74 172.65 1nld s TRP 36 N -1.67 2.14 0.11 1.40 0.52 -0.14 -1.18 118.94 120.12 1nld s TRP 36 Ca 0.41 -1.43 0.06 0.00 0.02 0.00 0.00 56.10 55.16 1nld s TRP 36 Cb -0.12 -1.50 -0.04 0.00 -1.15 0.00 0.00 33.47 30.66 1nld s TRP 36 CO 0.24 -0.70 -0.14 0.14 0.02 0.00 0.00 176.95 176.51 1nld s VAL 37 N 1.49 1.27 0.40 4.03 -7.23 -1.21 -1.06 120.40 118.10 1nld s VAL 37 Ca -0.01 -1.61 0.04 0.00 -1.81 0.00 0.00 61.98 58.58 1nld s VAL 37 Cb -0.16 -1.42 -0.05 0.00 0.56 0.00 0.00 36.38 35.31 1nld s VAL 37 CO -0.08 -0.37 0.05 0.00 -0.31 0.00 0.00 175.10 174.40 1nld s ARG 38 N -2.44 1.90 -0.35 4.82 1.70 -0.17 -0.55 118.95 123.85 1nld s ARG 38 Ca 0.06 -2.12 0.00 0.00 -0.47 0.00 0.00 55.73 53.20 1nld s ARG 38 Cb -0.06 -1.13 0.14 0.00 -0.57 0.00 0.00 34.95 33.33 1nld s ARG 38 CO 0.03 -0.25 0.21 -1.14 -1.08 0.00 0.00 175.30 173.06 1nld s GLN 39 N -3.81 0.58 0.11 3.89 0.74 0.80 -1.30 119.66 120.68 1nld s GLN 39 Ca 0.27 -1.34 -0.31 0.00 0.05 0.00 0.00 55.36 54.03 1nld s GLN 39 Cb 0.06 -1.36 -0.10 0.00 1.10 0.00 0.00 33.01 32.71 1nld s GLN 39 CO 0.13 -1.20 1.88 -1.12 -0.55 0.00 0.00 175.29 174.43 1nld s SER 40 N 1.07 6.41 -0.36 6.67 0.01 -1.23 -2.93 113.70 123.33 1nld s SER 40 Ca 0.18 2.77 -0.44 0.00 1.31 0.00 0.00 55.95 59.77 1nld s SER 40 Cb -0.23 -2.56 -0.18 0.00 0.21 0.00 0.00 66.02 63.26 1nld s SER 40 CO -0.00 -1.03 1.61 -2.65 0.41 0.00 0.00 173.24 171.57 1nld n PRO 41 N 6.11 0.46 0.00 12.44 -0.02 -1.26 -0.88 135.00 151.85 1nld n PRO 41 Ca 0.18 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1nld n PRO 41 Cb 0.39 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1nld n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nld n GLY 42 N 3.84 2.13 0.00 -1.23 0.00 -1.26 -4.83 105.19 103.84 1nld n GLY 42 Ca 0.28 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1nld n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nld n LYS 43 N 0.00 0.00 -2.39 1.61 4.76 -0.06 -5.05 118.16 117.03 1nld n LYS 43 Ca 0.00 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1nld n LYS 43 Cb 0.00 -0.71 0.00 0.00 -1.84 0.00 0.00 35.03 32.48 1nld n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nld n GLY 44 N -0.25 -1.08 3.62 0.72 0.00 -1.06 -4.99 105.19 102.15 1nld n GLY 44 Ca 0.00 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.04 1nld n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nld s LEU 45 N 0.00 3.77 -0.07 0.99 1.02 -1.26 -3.53 118.68 119.59 1nld s LEU 45 Ca 0.00 1.98 0.03 0.00 0.02 0.00 0.00 54.13 56.16 1nld s LEU 45 Cb 0.00 -3.52 -0.02 0.00 0.02 0.00 0.00 46.19 42.67 1nld s LEU 45 CO 0.00 -1.60 -0.15 -0.70 0.02 0.00 0.00 176.35 173.92 1nld s GLU 46 N 5.55 2.74 -0.09 1.70 2.12 -0.42 -4.97 118.70 125.33 1nld s GLU 46 Ca 0.91 -0.72 -0.21 0.00 0.36 0.00 0.00 54.97 55.31 1nld s GLU 46 Cb -0.33 -2.42 -0.04 0.00 0.26 0.00 0.00 34.13 31.60 1nld s GLU 46 CO 0.36 0.49 0.59 -0.46 -0.54 0.00 0.00 175.26 175.69 1nld s TRP 47 N -0.38 3.55 -0.19 5.30 -0.00 -1.26 -1.00 118.94 124.97 1nld s TRP 47 Ca 0.04 1.08 0.03 0.00 -0.00 0.00 0.00 56.10 57.24 1nld s TRP 47 Cb -0.12 -2.68 -0.13 0.00 -0.00 0.00 0.00 33.47 30.54 1nld s TRP 47 CO 0.02 0.14 -0.14 1.28 -0.00 0.00 0.00 176.95 178.24 1nld n LEU 48 N 3.69 2.65 0.00 5.86 4.32 -0.22 -4.71 117.00 128.59 1nld n LEU 48 Ca -0.04 -0.09 0.00 0.00 -0.02 0.00 0.00 56.01 55.86 1nld n LEU 48 Cb 0.51 -0.55 0.00 0.00 -1.62 0.00 0.00 43.42 41.76 1nld n LEU 48 CO 0.45 0.77 0.00 0.61 -1.22 0.00 0.00 177.39 178.00 1nld n GLY 49 N 2.53 -1.40 3.47 -0.72 0.00 -0.54 -1.80 105.19 106.74 1nld n GLY 49 Ca -0.33 -1.05 -0.17 0.00 0.00 0.00 0.00 46.02 44.47 1nld n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nld s VAL 50 N -2.08 0.01 -0.16 1.61 0.11 -0.29 -0.96 120.40 118.64 1nld s VAL 50 Ca 0.00 -0.08 0.00 0.00 -2.93 0.00 0.00 61.98 58.97 1nld s VAL 50 Cb 0.00 -0.94 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 1nld s VAL 50 CO 0.00 -0.04 -0.11 -0.51 -3.33 0.00 0.00 175.10 171.10 1nld s ILE 51 N -1.24 1.46 0.64 7.04 2.07 -1.10 -1.35 121.20 128.72 1nld s ILE 51 Ca -0.11 -0.67 -0.09 0.00 -1.41 0.00 0.00 60.65 58.36 1nld s ILE 51 Cb -0.01 -1.45 0.00 0.00 0.13 0.00 0.00 42.46 41.13 1nld s ILE 51 CO 0.09 0.34 1.00 0.26 -1.91 0.00 0.00 174.94 174.72 1nld s TRP 52 N 1.51 3.36 0.57 3.50 0.52 0.82 -2.00 118.94 127.22 1nld s TRP 52 Ca 0.03 0.93 0.32 0.00 0.02 0.00 0.00 56.10 57.40 1nld s TRP 52 Cb -0.14 -2.85 1.43 0.00 -1.15 0.00 0.00 33.47 30.77 1nld s TRP 52 CO -0.09 -0.92 1.78 0.66 0.02 0.00 0.00 176.95 178.40 1nld h SER 53 N -0.37 0.00 -0.22 2.95 4.64 -1.76 0.59 113.55 119.37 1nld h SER 53 Ca -0.45 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1nld h SER 53 Cb 1.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1nld h SER 53 CO 0.62 0.00 0.02 0.61 -0.87 0.00 0.00 176.83 177.21 1nld n GLY 54 N -1.65 2.11 3.99 -0.77 0.00 -1.26 -4.65 105.19 102.95 1nld n GLY 54 Ca 0.18 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1nld n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nld n GLY 55 N 0.20 0.72 3.73 -0.02 0.00 0.20 -4.95 105.19 105.07 1nld n GLY 55 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1nld n GLY 55 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1nld s ASP 56 N -2.54 7.39 0.31 1.61 -4.77 -1.24 -4.71 116.67 112.72 1nld s ASP 56 Ca 0.00 1.67 0.08 0.00 -3.30 0.00 0.00 52.55 51.00 1nld s ASP 56 Cb 0.00 -2.55 -0.04 0.00 -1.09 0.00 0.00 42.92 39.24 1nld s ASP 56 CO 0.00 -0.08 0.19 0.42 0.70 0.00 0.00 175.17 176.40 1nld s THR 57 N 0.18 3.62 -0.05 2.11 -4.23 -1.26 -0.13 115.64 115.88 1nld s THR 57 Ca 0.45 -1.54 -0.02 0.00 -1.18 0.00 0.00 61.69 59.40 1nld s THR 57 Cb -0.22 -3.14 0.04 0.00 1.34 0.00 0.00 72.50 70.52 1nld s THR 57 CO 0.27 -0.25 0.09 -1.81 -0.54 0.00 0.00 174.62 172.39 1nld s ASP 58 N -3.87 0.52 0.31 3.99 1.01 -0.46 -4.99 116.67 113.18 1nld s ASP 58 Ca 0.37 0.17 0.09 0.00 0.71 0.00 0.00 52.55 53.89 1nld s ASP 58 Cb -0.06 0.04 -0.04 0.00 1.01 0.00 0.00 42.92 43.87 1nld s ASP 58 CO 0.24 -0.20 0.06 -0.31 0.21 0.00 0.00 175.17 175.18 1nld s TYR 59 N 1.72 2.69 -0.13 4.23 2.02 -1.26 -1.14 117.35 125.47 1nld s TYR 59 Ca -0.02 -0.32 -0.26 0.00 -0.37 0.00 0.00 57.07 56.10 1nld s TYR 59 Cb -0.12 -1.43 -0.02 0.00 -0.40 0.00 0.00 41.96 39.99 1nld s TYR 59 CO -0.04 0.48 0.84 1.21 -1.57 0.00 0.00 175.55 176.47 1nld s ASN 60 N -3.75 7.02 0.29 2.29 3.84 -0.75 -4.90 114.94 118.98 1nld s ASN 60 Ca 0.35 1.25 -0.02 0.00 0.21 0.00 0.00 52.86 54.64 1nld s ASN 60 Cb -0.04 -2.47 0.61 0.00 -0.55 0.00 0.00 41.25 38.81 1nld s ASN 60 CO 0.21 -0.35 1.59 0.00 -2.79 0.00 0.00 177.10 175.76 1nld h ALA 61 N 7.18 0.97 -0.02 1.71 0.00 -1.95 0.32 119.26 127.47 1nld h ALA 61 Ca -0.32 0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1nld h ALA 61 Cb 1.15 0.58 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 1nld h ALA 61 CO 0.82 -0.49 0.07 0.00 0.00 0.00 0.00 179.25 179.65 1nld h ALA 62 N 1.91 1.21 0.00 0.00 0.00 -1.97 -3.11 119.26 117.30 1nld h ALA 62 Ca 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1nld h ALA 62 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1nld h ALA 62 CO -0.88 -0.08 -1.09 1.19 0.00 0.00 0.00 179.25 178.39 1nld n PHE 63 N -3.23 0.00 -0.31 0.00 3.72 0.93 -4.80 117.46 113.77 1nld n PHE 63 Ca -0.02 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.45 1nld n PHE 63 Cb 0.15 -0.07 0.16 0.00 -0.94 0.00 0.00 39.48 38.78 1nld n PHE 63 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 1nld n ILE 64 N -1.58 -0.37 0.09 4.37 0.00 -0.14 -0.46 119.36 121.27 1nld n ILE 64 Ca -0.01 1.97 0.20 0.00 0.00 0.00 0.00 62.75 64.92 1nld n ILE 64 Cb 0.09 -2.77 0.72 0.00 0.00 0.00 0.00 39.64 37.67 1nld n ILE 64 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1nld h SER 65 N 0.00 0.00 0.00 9.51 4.64 -1.87 -2.74 113.55 123.09 1nld h SER 65 Ca 0.45 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.71 1nld h SER 65 Cb 0.78 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.73 1nld h SER 65 CO -0.87 0.00 -0.62 -2.11 -0.87 0.00 0.00 176.83 172.36 1nld n ARG 66 N -3.58 0.36 -4.90 4.77 1.85 0.39 -5.01 116.66 110.54 1nld n ARG 66 Ca 0.08 -1.83 -0.32 0.00 -1.00 0.00 0.00 57.85 54.78 1nld n ARG 66 Cb 0.69 -0.60 -0.13 0.00 -1.05 0.00 0.00 32.46 31.36 1nld n ARG 66 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1nld s LEU 67 N -0.78 2.57 -0.33 2.89 1.02 -1.02 -0.10 118.68 122.93 1nld s LEU 67 Ca 0.20 -0.31 -0.01 0.00 0.02 0.00 0.00 54.13 54.03 1nld s LEU 67 Cb 0.22 -1.51 0.13 0.00 0.02 0.00 0.00 46.19 45.05 1nld s LEU 67 CO -0.06 0.31 0.19 -0.55 0.02 0.00 0.00 176.35 176.26 1nld s SER 68 N -0.92 3.14 -0.22 2.29 0.15 0.41 -4.93 113.70 113.62 1nld s SER 68 Ca 0.12 -1.91 -0.15 0.00 0.70 0.00 0.00 55.95 54.72 1nld s SER 68 Cb -0.10 -0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 63.78 1nld s SER 68 CO 0.02 -0.35 0.35 -0.63 1.20 0.00 0.00 173.24 173.82 1nld s ILE 69 N 1.39 5.23 0.34 6.45 1.01 -1.26 -2.39 121.20 131.98 1nld s ILE 69 Ca 0.15 0.58 0.04 0.00 0.00 0.00 0.00 60.65 61.42 1nld s ILE 69 Cb -0.21 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.55 1nld s ILE 69 CO -0.11 0.26 0.16 0.42 0.00 0.00 0.00 174.94 175.67 1nld s THR 70 N 1.34 0.40 0.30 2.92 -4.23 0.25 -4.95 115.64 111.67 1nld s THR 70 Ca 0.16 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.48 1nld s THR 70 Cb -0.15 -2.47 0.06 0.00 1.34 0.00 0.00 72.50 71.28 1nld s THR 70 CO 0.07 0.00 0.86 -1.59 -0.54 0.00 0.00 174.62 173.42 1nld s LYS 71 N -3.74 1.85 -0.31 3.99 -2.85 -1.26 0.21 119.74 117.64 1nld s LYS 71 Ca 0.33 -1.16 -0.02 0.00 -1.00 0.00 0.00 55.97 54.11 1nld s LYS 71 Cb 0.04 0.54 0.11 0.00 -2.06 0.00 0.00 37.83 36.47 1nld s LYS 71 CO 0.18 -0.86 0.16 0.34 0.10 0.00 0.00 175.35 175.26 1nld s ASP 72 N -3.12 3.37 0.27 0.03 -1.08 0.15 -4.94 116.67 111.35 1nld s ASP 72 Ca 0.16 -1.62 -0.07 0.00 -0.52 0.00 0.00 52.55 50.50 1nld s ASP 72 Cb -0.04 -0.39 0.47 0.00 -1.46 0.00 0.00 42.92 41.49 1nld s ASP 72 CO 0.08 -0.39 1.58 0.78 0.52 0.00 0.00 175.17 177.74 1nld h ASN 73 N 7.91 -0.73 -0.01 -0.34 4.21 -1.93 -0.35 115.58 124.34 1nld h ASN 73 Ca -0.11 0.26 -0.18 0.00 1.21 0.00 0.00 56.30 57.49 1nld h ASN 73 Cb 1.00 0.53 -0.00 0.00 -1.12 0.00 0.00 38.32 38.72 1nld h ASN 73 CO 0.38 -0.30 -0.61 0.77 -1.29 0.00 0.00 177.43 176.38 1nld h SER 74 N 0.01 0.71 0.73 5.81 4.64 -1.96 -3.10 113.55 120.40 1nld h SER 74 Ca 0.46 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1nld h SER 74 Cb 0.77 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1nld h SER 74 CO -0.90 1.15 0.00 0.29 -0.87 0.00 0.00 176.83 176.50 1nld n LYS 75 N -3.94 0.21 -3.40 4.77 5.02 -0.27 -4.90 118.16 115.65 1nld n LYS 75 Ca -0.04 0.02 -0.19 0.00 -2.02 0.00 0.00 58.31 56.08 1nld n LYS 75 Cb 0.65 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 34.23 1nld n LYS 75 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1nld n SER 76 N -1.39 -4.55 -3.80 4.39 7.64 -0.47 -4.91 113.62 110.53 1nld n SER 76 Ca 0.10 -0.50 -0.15 0.00 1.01 0.00 0.00 58.87 59.33 1nld n SER 76 Cb 0.27 -4.53 -0.16 0.00 -1.01 0.00 0.00 64.21 58.78 1nld n SER 76 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1nld s GLN 77 N -5.83 0.09 0.37 1.43 -0.21 -1.18 -1.50 119.66 112.83 1nld s GLN 77 Ca 0.34 0.13 0.03 0.00 0.02 0.00 0.00 55.36 55.88 1nld s GLN 77 Cb -0.15 -0.31 -0.01 0.00 1.00 0.00 0.00 33.01 33.54 1nld s GLN 77 CO 0.64 -0.14 0.54 0.08 -2.12 0.00 0.00 175.29 174.29 1nld s VAL 78 N 0.94 4.31 -0.18 1.09 1.01 -0.39 0.31 120.40 127.48 1nld s VAL 78 Ca -0.08 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 1nld s VAL 78 Cb -0.12 -3.54 0.06 0.00 0.00 0.00 0.00 36.38 32.78 1nld s VAL 78 CO -0.02 -0.28 0.07 -0.36 0.00 0.00 0.00 175.10 174.51 1nld s PHE 79 N -2.30 0.48 -0.18 5.22 0.08 0.58 -2.71 117.98 119.14 1nld s PHE 79 Ca 0.44 -0.51 -0.08 0.00 0.12 0.00 0.00 56.93 56.90 1nld s PHE 79 Cb -0.10 -0.81 -0.04 0.00 -0.57 0.00 0.00 43.02 41.50 1nld s PHE 79 CO 0.34 -0.55 0.10 0.12 -0.10 0.00 0.00 175.22 175.13 1nld s PHE 80 N 2.04 3.36 -0.16 0.36 2.19 -0.42 -0.59 117.98 124.76 1nld s PHE 80 Ca 0.01 0.24 -0.04 0.00 0.33 0.00 0.00 56.93 57.47 1nld s PHE 80 Cb -0.16 -2.09 0.08 0.00 -1.31 0.00 0.00 43.02 39.53 1nld s PHE 80 CO -0.09 0.29 0.25 0.21 1.83 0.00 0.00 175.22 177.70 1nld s LYS 81 N 0.18 0.17 0.13 10.12 2.20 -1.01 -0.31 119.74 131.22 1nld s LYS 81 Ca 0.07 0.51 0.05 0.00 -0.36 0.00 0.00 55.97 56.24 1nld s LYS 81 Cb -0.12 -0.53 -0.04 0.00 -1.51 0.00 0.00 37.83 35.64 1nld s LYS 81 CO -0.00 -0.45 0.08 1.41 -0.36 0.00 0.00 175.35 176.03 1nld s MET 82 N 2.38 2.78 0.30 4.03 -2.45 -0.23 -0.45 119.30 125.66 1nld s MET 82 Ca 0.04 -0.84 0.11 0.00 -1.25 0.00 0.00 55.69 53.76 1nld s MET 82 Cb -0.14 -2.62 -0.05 0.00 1.25 0.00 0.00 34.83 33.27 1nld s MET 82 CO -0.10 0.51 -0.15 -0.80 1.05 0.00 0.00 175.02 175.53 1nld s ASN 82 N -2.75 3.71 -1.29 1.11 0.01 0.85 -1.39 114.94 115.20 1nld s ASN 82 Ca 0.29 -1.04 -0.01 0.00 -0.71 0.00 0.00 52.86 51.39 1nld s ASN 82 Cb -0.11 -0.36 -0.00 0.00 0.41 0.00 0.00 41.25 41.19 1nld s ASN 82 CO 0.22 -0.03 0.73 -1.20 -1.51 0.00 0.00 177.10 175.30 1nld n SER 82 N -0.69 -1.42 -4.65 -1.22 7.64 -1.06 -4.88 113.62 107.34 1nld n SER 82 Ca -0.05 -0.81 -0.42 0.00 1.01 0.00 0.00 58.87 58.60 1nld n SER 82 Cb 0.61 -4.15 -0.03 0.00 -1.01 0.00 0.00 64.21 59.64 1nld n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1nld s LEU 82 N -6.62 4.23 0.21 -3.43 1.43 -1.12 -4.55 118.68 108.82 1nld s LEU 82 Ca 0.02 2.18 0.03 0.00 -1.03 0.00 0.00 54.13 55.33 1nld s LEU 82 Cb -0.01 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 1nld s LEU 82 CO 0.81 -1.05 0.35 -1.10 0.23 0.00 0.00 176.35 175.58 1nld s GLN 83 N 4.32 3.45 0.57 1.70 -1.52 -1.26 -0.25 119.66 126.67 1nld s GLN 83 Ca 0.77 -0.61 0.36 0.00 -1.95 0.00 0.00 55.36 53.93 1nld s GLN 83 Cb -0.33 -2.90 1.45 0.00 -0.22 0.00 0.00 33.01 31.01 1nld s GLN 83 CO 0.31 0.44 1.67 -1.35 -0.25 0.00 0.00 175.29 176.12 1nld h PRO 84 N 1.63 0.00 -0.04 2.91 0.11 -1.96 0.12 132.00 134.77 1nld h PRO 84 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1nld h PRO 84 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1nld h PRO 84 CO 0.65 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.71 1nld n ASN 85 N -3.85 0.72 -1.66 -2.05 6.94 -1.26 -3.24 115.26 110.86 1nld n ASN 85 Ca 0.26 -1.36 0.06 0.00 -0.02 0.00 0.00 54.58 53.52 1nld n ASN 85 Cb 1.35 -0.02 0.35 0.00 -2.36 0.00 0.00 39.78 39.10 1nld n ASN 85 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1nld n ASP 86 N -0.39 4.95 -4.68 0.53 8.00 0.41 -4.86 116.55 120.51 1nld n ASP 86 Ca 0.19 -2.73 -0.43 0.00 0.71 0.00 0.00 54.79 52.53 1nld n ASP 86 Cb 0.21 -0.64 -0.02 0.00 -0.02 0.00 0.00 41.12 40.64 1nld n ASP 86 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1nld s ARG 87 N -2.40 4.39 0.04 -1.24 3.52 -1.20 -4.90 118.95 117.17 1nld s ARG 87 Ca 0.47 1.38 -0.12 0.00 -0.13 0.00 0.00 55.73 57.32 1nld s ARG 87 Cb 0.35 -3.56 0.04 0.00 -1.56 0.00 0.00 34.95 30.22 1nld s ARG 87 CO 0.15 -0.36 0.57 0.00 -0.81 0.00 0.00 175.30 174.84 1nld n ALA 88 N 5.21 -1.54 -3.24 6.12 0.00 -0.99 -4.47 120.51 121.60 1nld n ALA 88 Ca 0.09 -0.45 -0.35 0.00 0.00 0.00 0.00 53.44 52.72 1nld n ALA 88 Cb 0.48 0.19 -0.13 0.00 0.00 0.00 0.00 19.45 19.99 1nld n ALA 88 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nld s ILE 89 N -2.21 3.80 -0.05 0.00 1.09 -1.15 -0.86 121.20 121.81 1nld s ILE 89 Ca 0.13 -0.36 -0.14 0.00 -1.10 0.00 0.00 60.65 59.19 1nld s ILE 89 Cb -0.01 -2.73 -0.05 0.00 -1.06 0.00 0.00 42.46 38.61 1nld s ILE 89 CO 0.01 0.41 0.35 -0.31 -0.10 0.00 0.00 174.94 175.30 1nld s TYR 90 N 1.31 3.65 0.38 3.97 1.51 0.59 -0.14 117.35 128.63 1nld s TYR 90 Ca 0.04 0.85 0.08 0.00 -1.01 0.00 0.00 57.07 57.03 1nld s TYR 90 Cb -0.15 -2.26 -0.07 0.00 -0.11 0.00 0.00 41.96 39.37 1nld s TYR 90 CO 0.00 0.56 -0.01 0.71 -1.11 0.00 0.00 175.55 175.70 1nld s TYR 91 N -0.69 2.49 -0.14 2.71 2.02 0.28 -1.43 117.35 122.59 1nld s TYR 91 Ca 0.21 -0.59 -0.04 0.00 -0.37 0.00 0.00 57.07 56.28 1nld s TYR 91 Cb -0.15 -1.64 0.06 0.00 -0.40 0.00 0.00 41.96 39.83 1nld s TYR 91 CO 0.10 0.48 0.12 0.00 -1.57 0.00 0.00 175.55 174.68 1nld s ALA 93 N 2.20 1.20 0.45 0.00 0.00 -0.33 -0.10 121.76 125.18 1nld s ALA 93 Ca 0.04 -0.38 -0.24 0.00 0.00 0.00 0.00 51.96 51.38 1nld s ALA 93 Cb -0.15 -0.55 -0.10 0.00 0.00 0.00 0.00 23.12 22.33 1nld s ALA 93 CO -0.08 0.11 1.04 -2.13 0.00 0.00 0.00 175.76 174.70 1nld n ARG 94 N 3.82 1.37 0.16 0.00 0.63 0.16 -1.02 116.66 121.78 1nld n ARG 94 Ca -0.23 0.49 -0.13 0.00 -0.92 0.00 0.00 57.85 57.06 1nld n ARG 94 Cb 0.52 -2.11 -0.08 0.00 0.45 0.00 0.00 32.46 31.24 1nld n ARG 94 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1nld h ARG 95 N 1.47 -0.41 0.00 -0.14 1.12 -1.16 -3.41 114.38 111.84 1nld h ARG 95 Ca -0.46 0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.44 1nld h ARG 95 Cb 1.34 0.09 0.00 0.00 -0.01 0.00 0.00 29.97 31.39 1nld h ARG 95 CO 0.56 -0.10 0.00 0.41 -3.11 0.00 0.00 179.97 177.74 1nld n GLY 96 N -0.35 0.63 3.45 2.80 0.00 -1.26 -4.72 105.19 105.74 1nld n GLY 96 Ca -0.10 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 1nld n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nld n GLY 97 N 4.69 -0.46 3.51 -0.02 0.00 -1.26 -4.61 105.19 107.04 1nld n GLY 97 Ca 0.00 1.15 -0.43 0.00 0.00 0.00 0.00 46.02 46.73 1nld n GLY 97 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nld n ASP 101 N 10.21 2.13 -4.05 1.61 9.92 -1.26 -4.70 116.55 130.40 1nld n ASP 101 Ca 0.65 0.04 -0.23 0.00 -0.53 0.00 0.00 54.79 54.71 1nld n ASP 101 Cb 0.03 -1.37 -0.16 0.00 -0.64 0.00 0.00 41.12 38.97 1nld n ASP 101 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1nld s PHE 102 N 9.35 1.33 0.50 1.24 0.08 -1.26 -4.97 117.98 124.25 1nld s PHE 102 Ca 1.08 -0.39 0.04 0.00 0.12 0.00 0.00 56.93 57.78 1nld s PHE 102 Cb -0.60 -0.94 -0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1nld s PHE 102 CO 0.39 -0.16 0.17 -1.58 -0.10 0.00 0.00 175.22 173.93 1nld s TRP 103 N 0.25 1.97 0.32 0.36 0.52 -1.26 0.38 118.94 121.47 1nld s TRP 103 Ca -0.06 -0.83 0.06 0.00 0.02 0.00 0.00 56.10 55.29 1nld s TRP 103 Cb -0.11 -1.79 -0.01 0.00 -1.15 0.00 0.00 33.47 30.41 1nld s TRP 103 CO 0.02 0.01 0.45 0.20 0.02 0.00 0.00 176.95 177.64 1nld s GLY 104 N -4.00 1.52 0.43 0.98 0.00 0.86 -4.00 107.32 103.10 1nld s GLY 104 Ca 0.23 -1.41 0.16 0.00 0.00 0.00 0.00 44.72 43.70 1nld s GLY 104 CO 0.13 -1.34 1.93 0.06 0.00 0.00 0.00 173.10 173.88 1nld h GLN 105 N 0.94 0.40 0.00 2.90 3.07 -1.90 -3.45 115.11 117.07 1nld h GLN 105 Ca -0.47 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.25 1nld h GLN 105 Cb 1.25 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.72 1nld h GLN 105 CO 0.54 0.26 0.00 0.41 0.09 0.00 0.00 178.83 180.14 1nld n GLY 106 N -1.52 2.56 2.73 0.06 0.00 -1.26 -5.05 105.19 102.70 1nld n GLY 106 Ca 0.14 -1.86 -0.20 0.00 0.00 0.00 0.00 46.02 44.10 1nld n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nld s THR 107 N -2.62 -0.22 0.01 2.61 2.01 -0.52 -4.87 115.64 112.04 1nld s THR 107 Ca 0.00 0.04 -0.22 0.00 0.31 0.00 0.00 61.69 61.83 1nld s THR 107 Cb 0.00 -0.50 -0.05 0.00 0.01 0.00 0.00 72.50 71.95 1nld s THR 107 CO 0.00 -0.10 0.64 0.28 -0.69 0.00 0.00 174.62 174.74 1nld s THR 108 N 2.25 4.85 -0.16 -0.82 -1.32 -1.26 -0.30 115.64 118.87 1nld s THR 108 Ca 0.04 1.34 0.01 0.00 -1.21 0.00 0.00 61.69 61.87 1nld s THR 108 Cb -0.15 -3.98 0.01 0.00 -1.51 0.00 0.00 72.50 66.88 1nld s THR 108 CO -0.09 0.42 -0.18 -0.69 -2.21 0.00 0.00 174.62 171.87 1nld s VAL 109 N -0.23 2.35 -0.15 5.08 1.01 -0.04 -4.00 120.40 124.41 1nld s VAL 109 Ca 0.33 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 1nld s VAL 109 Cb -0.19 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 1nld s VAL 109 CO 0.19 0.53 -0.03 -0.89 0.00 0.00 0.00 175.10 174.89 1nld s THR 110 N 1.01 3.93 -0.53 3.92 2.01 0.54 -2.35 115.64 124.17 1nld s THR 110 Ca -0.02 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.66 1nld s THR 110 Cb -0.15 -2.71 0.13 0.00 0.01 0.00 0.00 72.50 69.78 1nld s THR 110 CO -0.05 0.50 0.28 -0.69 -0.69 0.00 0.00 174.62 173.97 1nld s VAL 111 N 0.24 2.72 0.13 3.82 1.01 -1.26 -0.31 120.40 126.75 1nld s VAL 111 Ca -0.02 -3.27 -0.12 0.00 0.00 0.00 0.00 61.98 58.57 1nld s VAL 111 Cb -0.14 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1nld s VAL 111 CO 0.03 -0.81 0.31 -0.94 0.00 0.00 0.00 175.10 173.70 1nld s SER 112 N -0.16 -0.05 -1.05 3.32 1.04 -0.12 -4.17 113.70 112.52 1nld s SER 112 Ca 0.17 -0.59 -0.02 0.00 0.48 0.00 0.00 55.95 55.99 1nld s SER 112 Cb -0.25 0.43 0.32 0.00 0.10 0.00 0.00 66.02 66.62 1nld s SER 112 CO -0.01 -0.84 1.70 -0.24 0.98 0.00 0.00 173.24 174.82 1nld n SER 113 N -0.18 7.01 -4.06 7.02 2.88 -1.26 -4.10 113.62 120.93 1nld n SER 113 Ca -0.13 -3.58 -0.09 0.00 -1.33 0.00 0.00 58.87 53.74 1nld n SER 113 Cb 0.63 -1.21 -0.11 0.00 -0.75 0.00 0.00 64.21 62.77 1nld n SER 113 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nld s ALA 114 N -3.74 0.44 0.78 -1.46 0.00 -1.26 -5.14 121.76 111.38 1nld s ALA 114 Ca 0.36 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 51.21 1nld s ALA 114 Cb 0.13 0.17 -0.12 0.00 0.00 0.00 0.00 23.12 23.30 1nld s ALA 114 CO -0.03 -0.22 -0.98 -1.13 0.00 0.00 0.00 175.76 173.40 1nld n SER 115 N 0.85 -2.49 -0.11 0.00 3.41 -1.26 -4.95 113.62 109.07 1nld n SER 115 Ca -0.19 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.50 1nld n SER 115 Cb 0.58 -0.47 0.11 0.00 -0.26 0.00 0.00 64.21 64.17 1nld n SER 115 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1nld n THR 116 N -3.12 1.59 0.00 6.66 -1.04 -1.26 -4.55 114.28 112.56 1nld n THR 116 Ca -0.01 -1.90 0.00 0.00 -2.04 0.00 0.00 64.05 60.10 1nld n THR 116 Cb 0.47 -0.09 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 1nld n THR 116 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1nld n THR 117 N -1.19 0.00 -2.93 12.58 -1.04 -1.26 -4.39 114.28 116.04 1nld n THR 117 Ca 0.13 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.74 1nld n THR 117 Cb 0.62 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.09 1nld n THR 117 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nld s ALA 118 N 0.00 3.30 0.73 2.41 0.00 -1.26 -2.60 121.76 124.33 1nld s ALA 118 Ca 0.00 0.30 -0.15 0.00 0.00 0.00 0.00 51.96 52.11 1nld s ALA 118 Cb 0.00 -3.08 0.04 0.00 0.00 0.00 0.00 23.12 20.08 1nld s ALA 118 CO 0.00 -0.08 1.19 -1.25 0.00 0.00 0.00 175.76 175.62 1nld s PRO 119 N 0.57 2.18 -0.31 0.00 0.04 -1.06 -4.60 135.00 131.82 1nld s PRO 119 Ca 0.42 1.70 -0.06 0.00 0.04 0.00 0.00 61.00 63.10 1nld s PRO 119 Cb -0.20 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.53 1nld s PRO 119 CO 0.23 -1.79 0.07 -1.12 0.04 0.00 0.00 177.00 174.43 1nld s SER 120 N -2.14 5.13 -0.46 6.66 0.01 0.18 -4.94 113.70 118.14 1nld s SER 120 Ca 0.73 -1.01 -0.19 0.00 1.31 0.00 0.00 55.95 56.80 1nld s SER 120 Cb -0.28 -1.84 0.04 0.00 0.21 0.00 0.00 66.02 64.15 1nld s SER 120 CO 0.45 -0.26 0.54 -0.69 0.41 0.00 0.00 173.24 173.69 1nld s VAL 121 N 1.41 4.97 -0.14 3.43 1.01 -1.26 -1.49 120.40 128.33 1nld s VAL 121 Ca -0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 1nld s VAL 121 Cb -0.19 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1nld s VAL 121 CO 0.02 -0.60 -0.08 -0.31 0.00 0.00 0.00 175.10 174.13 1nld s TYR 122 N 2.42 2.93 0.86 5.22 2.02 0.22 -4.95 117.35 126.07 1nld s TYR 122 Ca 0.15 -0.41 -0.12 0.00 -0.37 0.00 0.00 57.07 56.32 1nld s TYR 122 Cb -0.18 -1.90 0.11 0.00 -0.40 0.00 0.00 41.96 39.60 1nld s TYR 122 CO 0.14 -0.08 1.10 -1.25 -1.57 0.00 0.00 175.55 173.89 1nld s PRO 123 N 0.28 1.55 -0.16 -1.71 0.04 -1.26 -0.67 135.00 133.07 1nld s PRO 123 Ca -0.06 0.62 -0.03 0.00 0.04 0.00 0.00 61.00 61.57 1nld s PRO 123 Cb -0.15 -1.86 0.05 0.00 0.04 0.00 0.00 34.50 32.59 1nld s PRO 123 CO 0.04 -1.98 0.03 -0.51 0.04 0.00 0.00 177.00 174.62 1nld s LEU 124 N -6.00 0.90 0.07 -3.56 1.43 0.15 -4.77 118.68 106.90 1nld s LEU 124 Ca 0.62 -0.59 0.09 0.00 -1.03 0.00 0.00 54.13 53.23 1nld s LEU 124 Cb -0.16 -0.50 -0.03 0.00 0.03 0.00 0.00 46.19 45.53 1nld s LEU 124 CO 0.55 -0.28 -0.25 0.00 0.23 0.00 0.00 176.35 176.60 1nld s ALA 125 N 1.93 2.37 -0.06 4.21 0.00 -1.26 -0.88 121.76 128.07 1nld s ALA 125 Ca 0.01 -1.32 -0.30 0.00 0.00 0.00 0.00 51.96 50.35 1nld s ALA 125 Cb -0.16 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 1nld s ALA 125 CO -0.07 0.55 1.35 -1.25 0.00 0.00 0.00 175.76 176.33 1nld s PRO 126 N -1.56 4.28 0.12 0.00 0.04 -1.26 -4.92 135.00 131.70 1nld s PRO 126 Ca 0.13 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 1nld s PRO 126 Cb -0.10 -3.66 -0.08 0.00 0.04 0.00 0.00 34.50 30.70 1nld s PRO 126 CO 0.04 -0.60 1.59 -0.39 0.04 0.00 0.00 177.00 177.68 1nld h VAL 127 N 5.14 0.18 -3.28 -0.36 -1.51 -1.98 -3.40 116.25 111.05 1nld h VAL 127 Ca -0.35 0.00 -0.67 0.00 -1.23 0.00 0.00 66.70 64.46 1nld h VAL 127 Cb 1.16 0.18 -0.33 0.00 -2.13 0.00 0.00 31.29 30.17 1nld h VAL 127 CO 0.92 0.00 -0.81 -0.94 -1.23 0.00 0.00 177.57 175.51 1nld s SER 128 N -4.77 3.69 0.83 4.19 1.04 -1.26 -4.55 113.70 112.87 1nld s SER 128 Ca -0.16 -0.69 -0.11 0.00 0.48 0.00 0.00 55.95 55.47 1nld s SER 128 Cb 0.08 -1.57 0.09 0.00 0.10 0.00 0.00 66.02 64.72 1nld s SER 128 CO 0.64 -0.04 1.09 -0.83 0.98 0.00 0.00 173.24 175.08 1nld s GLY 129 N 1.32 1.65 -0.32 7.32 0.00 -1.26 -4.99 107.32 111.04 1nld s GLY 129 Ca 0.03 0.11 -0.27 0.00 0.00 0.00 0.00 44.72 44.59 1nld s GLY 129 CO -0.09 0.52 0.99 0.99 0.00 0.00 0.00 173.10 175.52 1nld s ASP 130 N -3.41 6.85 0.22 1.64 1.11 -1.26 -4.93 116.67 116.89 1nld s ASP 130 Ca 0.62 0.92 -0.08 0.00 0.18 0.00 0.00 52.55 54.19 1nld s ASP 130 Cb -0.17 -2.50 0.19 0.00 1.07 0.00 0.00 42.92 41.50 1nld s ASP 130 CO 0.56 -0.82 1.84 1.56 1.18 0.00 0.00 175.17 179.50 1nld h GLN 131 N 8.13 1.19 -6.51 8.23 4.20 -1.95 -3.41 115.11 124.99 1nld h GLN 131 Ca -0.22 -0.14 -0.53 0.00 0.06 0.00 0.00 58.65 57.82 1nld h GLN 131 Cb 1.07 -0.23 0.03 0.00 0.30 0.00 0.00 27.48 28.65 1nld h GLN 131 CO 0.99 0.88 1.02 0.99 -0.67 0.00 0.00 178.83 182.04 1nld s THR 132 N -5.83 2.71 0.00 -0.54 2.01 -1.26 -4.81 115.64 107.92 1nld s THR 132 Ca -0.13 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.16 1nld s THR 132 Cb 0.16 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.49 1nld s THR 132 CO 0.82 0.00 0.78 -3.20 -0.69 0.00 0.00 174.62 172.34 1nld n ASN 133 N 5.23 2.12 0.00 3.53 5.15 -1.26 -4.39 115.26 125.64 1nld n ASN 133 Ca 0.16 -1.48 0.00 0.00 -0.60 0.00 0.00 54.58 52.66 1nld n ASN 133 Cb 0.39 -0.44 0.00 0.00 -0.53 0.00 0.00 39.78 39.20 1nld n ASN 133 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1nld n SER 134 N 1.63 0.00 -4.20 1.20 3.41 -1.26 -4.27 113.62 110.13 1nld n SER 134 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 1nld n SER 134 Cb 0.21 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.06 1nld n SER 134 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1nld s SER 135 N -1.00 1.23 -0.02 4.04 0.01 -1.26 -2.01 113.70 114.69 1nld s SER 135 Ca 0.00 -1.05 0.01 0.00 1.31 0.00 0.00 55.95 56.22 1nld s SER 135 Cb 0.00 0.09 0.01 0.00 0.21 0.00 0.00 66.02 66.33 1nld s SER 135 CO 0.00 -0.48 -0.03 0.54 0.41 0.00 0.00 173.24 173.68 1nld s VAL 136 N -3.60 0.32 -0.13 3.43 0.11 0.86 -4.52 120.40 116.87 1nld s VAL 136 Ca 0.16 -0.07 0.03 0.00 -2.93 0.00 0.00 61.98 59.16 1nld s VAL 136 Cb 0.05 -0.34 0.01 0.00 -1.53 0.00 0.00 36.38 34.57 1nld s VAL 136 CO -0.02 0.14 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.79 1nld s THR 137 N 0.51 2.16 0.44 5.04 2.01 -1.26 -1.45 115.64 123.09 1nld s THR 137 Ca -0.05 -0.96 0.07 0.00 0.31 0.00 0.00 61.69 61.06 1nld s THR 137 Cb -0.09 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 1nld s THR 137 CO -0.01 0.55 0.27 -0.76 -0.69 0.00 0.00 174.62 173.98 1nld s LEU 138 N 0.67 3.09 0.31 4.42 2.01 0.43 -4.42 118.68 125.20 1nld s LEU 138 Ca -0.10 -1.04 -0.10 0.00 0.01 0.00 0.00 54.13 52.90 1nld s LEU 138 Cb -0.16 -1.54 0.01 0.00 0.01 0.00 0.00 46.19 44.51 1nld s LEU 138 CO 0.02 -0.69 0.55 -0.83 1.01 0.00 0.00 176.35 176.41 1nld s GLY 139 N -4.03 0.84 -0.03 -3.19 0.00 -0.06 -1.69 107.32 99.15 1nld s GLY 139 Ca 0.41 -1.07 -0.07 0.00 0.00 0.00 0.00 44.72 43.98 1nld s GLY 139 CO 0.23 -0.68 0.17 0.00 0.00 0.00 0.00 173.10 172.81 1nld s LEU 141 N -0.63 1.73 -0.47 0.00 2.96 0.16 -2.20 118.68 120.23 1nld s LEU 141 Ca -0.07 -0.33 0.04 0.00 -0.22 0.00 0.00 54.13 53.55 1nld s LEU 141 Cb -0.04 -0.89 0.12 0.00 0.50 0.00 0.00 46.19 45.88 1nld s LEU 141 CO 0.01 0.06 0.21 -0.69 -1.32 0.00 0.00 176.35 174.62 1nld s VAL 142 N 0.54 2.38 0.29 1.68 1.01 -0.45 -0.61 120.40 125.24 1nld s VAL 142 Ca -0.13 -2.99 0.06 0.00 0.00 0.00 0.00 61.98 58.91 1nld s VAL 142 Cb -0.15 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 1nld s VAL 142 CO 0.04 -0.76 0.37 -0.54 0.00 0.00 0.00 175.10 174.22 1nld s LYS 143 N 0.07 3.16 -0.62 2.72 1.02 -0.56 -1.48 119.74 124.05 1nld s LYS 143 Ca 0.16 -0.97 -0.07 0.00 0.02 0.00 0.00 55.97 55.11 1nld s LYS 143 Cb -0.24 -2.77 0.01 0.00 -0.52 0.00 0.00 37.83 34.31 1nld s LYS 143 CO -0.02 0.24 0.66 0.41 -0.92 0.00 0.00 175.35 175.71 1nld n GLY 144 N -1.47 -1.24 3.31 -3.33 0.00 -1.14 0.49 105.19 101.81 1nld n GLY 144 Ca -0.04 0.78 -0.12 0.00 0.00 0.00 0.00 46.02 46.65 1nld n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1nld s TYR 145 N -2.82 -0.21 0.00 1.61 -0.85 -1.23 -2.57 117.35 111.28 1nld s TYR 145 Ca 0.10 0.04 0.00 0.00 -0.52 0.00 0.00 57.07 56.69 1nld s TYR 145 Cb -0.03 0.21 0.00 0.00 0.38 0.00 0.00 41.96 42.52 1nld s TYR 145 CO 0.77 -0.61 0.00 0.34 -1.52 0.00 0.00 175.55 174.52 1nld n PHE 146 N 0.21 0.00 -1.43 -3.49 7.35 -1.07 -1.69 117.46 117.34 1nld n PHE 146 Ca -0.17 0.00 -0.50 0.00 -0.76 0.00 0.00 57.45 56.01 1nld n PHE 146 Cb 0.61 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.37 1nld n PHE 146 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1nld n PRO 147 N -1.09 0.91 -0.37 -7.13 -0.02 -1.26 -4.74 135.00 121.30 1nld n PRO 147 Ca 0.00 0.23 0.35 0.00 -2.02 0.00 0.00 63.50 62.06 1nld n PRO 147 Cb 0.00 -2.37 0.61 0.00 -0.02 0.00 0.00 33.50 31.72 1nld n PRO 147 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1nld n GLU 148 N 8.20 -0.05 -1.67 -0.52 4.07 -1.26 -4.55 120.64 124.86 1nld n GLU 148 Ca 0.44 1.30 -0.45 0.00 -0.06 0.00 0.00 57.16 58.39 1nld n GLU 148 Cb 0.21 -2.42 -0.04 0.00 -0.06 0.00 0.00 31.44 29.13 1nld n GLU 148 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1nld n PRO 149 N -4.99 2.57 -3.69 5.31 -0.04 -1.26 -4.92 135.00 127.98 1nld n PRO 149 Ca 0.38 0.94 -0.11 0.00 -0.04 0.00 0.00 63.50 64.67 1nld n PRO 149 Cb 1.37 -2.85 -0.09 0.00 -0.04 0.00 0.00 33.50 31.89 1nld n PRO 149 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1nld s VAL 150 N 4.08 -0.01 0.14 0.52 1.01 -1.26 -3.79 120.40 121.08 1nld s VAL 150 Ca 0.90 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.95 1nld s VAL 150 Cb -0.55 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1nld s VAL 150 CO 0.45 0.01 0.16 -0.89 0.00 0.00 0.00 175.10 174.84 1nld s THR 151 N 0.98 4.72 -0.02 3.92 2.01 -0.15 -4.97 115.64 122.13 1nld s THR 151 Ca -0.06 -0.89 -0.11 0.00 0.31 0.00 0.00 61.69 60.94 1nld s THR 151 Cb -0.06 -3.38 0.01 0.00 0.01 0.00 0.00 72.50 69.09 1nld s THR 151 CO -0.09 -0.04 0.23 -0.22 -0.69 0.00 0.00 174.62 173.81 1nld s LEU 152 N -2.95 1.18 0.25 4.42 0.20 -1.26 -1.64 118.68 118.88 1nld s LEU 152 Ca 0.32 0.01 -0.22 0.00 0.69 0.00 0.00 54.13 54.93 1nld s LEU 152 Cb -0.11 0.96 0.03 0.00 -0.43 0.00 0.00 46.19 46.65 1nld s LEU 152 CO 0.24 -0.37 0.71 0.28 -0.29 0.00 0.00 176.35 176.92 1nld s THR 153 N -1.18 0.00 -0.21 3.68 -1.32 -0.29 -5.01 115.64 111.31 1nld s THR 153 Ca -0.12 -0.77 0.01 0.00 -1.21 0.00 0.00 61.69 59.60 1nld s THR 153 Cb -0.06 -1.79 0.03 0.00 -1.51 0.00 0.00 72.50 69.18 1nld s THR 153 CO 0.03 0.00 -0.17 0.26 -2.21 0.00 0.00 174.62 172.53 1nld s TRP 154 N -3.85 2.94 -1.42 9.09 0.52 -1.26 -1.24 118.94 123.73 1nld s TRP 154 Ca 0.09 -1.84 -0.09 0.00 0.02 0.00 0.00 56.10 54.28 1nld s TRP 154 Cb -0.05 -1.93 0.02 0.00 -1.15 0.00 0.00 33.47 30.36 1nld s TRP 154 CO 0.03 -0.82 1.04 0.09 0.02 0.00 0.00 176.95 177.31 1nld n ASN 155 N 4.57 -6.15 -3.64 2.95 3.02 0.18 -1.12 115.26 115.07 1nld n ASN 155 Ca -0.19 -0.51 -0.26 0.00 -0.03 0.00 0.00 54.58 53.59 1nld n ASN 155 Cb 0.48 -4.87 0.02 0.00 -0.61 0.00 0.00 39.78 34.80 1nld n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1nld n SER 156 N -2.89 -5.52 0.00 6.41 7.64 -1.26 -1.82 113.62 116.17 1nld n SER 156 Ca -0.01 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 58.99 1nld n SER 156 Cb 0.57 -3.11 0.00 0.00 -1.01 0.00 0.00 64.21 60.65 1nld n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nld n GLY 157 N -1.73 2.11 0.36 0.23 0.00 -1.18 -4.76 105.19 100.22 1nld n GLY 157 Ca -0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.93 1nld n GLY 157 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1nld h SER 158 N 0.00 0.86 -2.99 1.61 0.87 -1.42 -3.28 113.55 109.20 1nld h SER 158 Ca 0.00 0.01 -0.72 0.00 -1.23 0.00 0.00 61.79 59.85 1nld h SER 158 Cb 0.00 -0.17 -0.21 0.00 -0.44 0.00 0.00 62.40 61.57 1nld h SER 158 CO 0.00 0.54 -0.02 -0.22 -0.53 0.00 0.00 176.83 176.60 1nld s LEU 159 N -9.96 5.67 -0.12 2.23 2.96 -0.28 -4.84 118.68 114.35 1nld s LEU 159 Ca -0.11 -1.54 -0.08 0.00 -0.22 0.00 0.00 54.13 52.18 1nld s LEU 159 Cb 0.20 -2.27 -0.05 0.00 0.50 0.00 0.00 46.19 44.56 1nld s LEU 159 CO 0.80 -1.00 -0.19 -1.54 -1.32 0.00 0.00 176.35 173.09 1nld n SER 160 N 5.91 1.21 -4.71 3.68 3.41 -1.24 -4.08 113.62 117.79 1nld n SER 160 Ca -0.11 0.20 -0.32 0.00 -0.26 0.00 0.00 58.87 58.38 1nld n SER 160 Cb 0.42 -0.48 0.12 0.00 -0.26 0.00 0.00 64.21 64.01 1nld n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1nld s SER 161 N -6.22 3.75 0.00 4.04 0.01 -1.26 -3.05 113.70 110.96 1nld s SER 161 Ca -0.19 2.19 0.00 0.00 1.31 0.00 0.00 55.95 59.26 1nld s SER 161 Cb 0.06 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1nld s SER 161 CO 0.25 -2.55 0.00 0.61 0.41 0.00 0.00 173.24 171.96 1nld n GLY 162 N 0.04 0.31 3.78 3.44 0.00 -1.26 -4.80 105.19 106.70 1nld n GLY 162 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1nld n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nld s VAL 163 N -1.76 5.03 -0.22 1.61 1.01 -1.17 -2.76 120.40 122.15 1nld s VAL 163 Ca 0.00 0.96 -0.03 0.00 0.00 0.00 0.00 61.98 62.91 1nld s VAL 163 Cb 0.00 -3.79 0.07 0.00 0.00 0.00 0.00 36.38 32.66 1nld s VAL 163 CO 0.00 0.47 0.07 -1.00 0.00 0.00 0.00 175.10 174.64 1nld s HIS 164 N -0.38 0.88 -0.26 5.22 3.76 -0.95 -4.97 115.29 118.59 1nld s HIS 164 Ca 0.26 -0.89 -0.07 0.00 -0.15 0.00 0.00 55.06 54.20 1nld s HIS 164 Cb -0.17 -1.05 -0.02 0.00 1.11 0.00 0.00 32.58 32.46 1nld s HIS 164 CO 0.13 -0.66 0.08 0.99 -0.85 0.00 0.00 174.74 174.43 1nld s THR 165 N 1.91 4.28 -0.02 1.30 2.01 -1.26 -0.49 115.64 123.36 1nld s THR 165 Ca 0.02 -0.29 -0.20 0.00 0.31 0.00 0.00 61.69 61.53 1nld s THR 165 Cb -0.17 -3.06 -0.05 0.00 0.01 0.00 0.00 72.50 69.23 1nld s THR 165 CO -0.14 0.26 0.56 -0.36 -0.69 0.00 0.00 174.62 174.25 1nld s PHE 166 N 1.59 3.66 0.43 4.92 0.40 0.29 -4.99 117.98 124.28 1nld s PHE 166 Ca 0.06 1.14 -0.23 0.00 -0.60 0.00 0.00 56.93 57.29 1nld s PHE 166 Cb -0.16 -2.57 -0.11 0.00 0.51 0.00 0.00 43.02 40.69 1nld s PHE 166 CO 0.04 0.35 0.82 -0.35 0.70 0.00 0.00 175.22 176.77 1nld n PRO 167 N 2.79 0.99 -2.10 0.24 -0.04 -1.26 -3.75 135.00 131.87 1nld n PRO 167 Ca -0.07 0.36 -0.38 0.00 -0.04 0.00 0.00 63.50 63.36 1nld n PRO 167 Cb 0.51 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 1nld n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nld s ALA 168 N -1.36 2.99 0.09 0.55 0.00 -1.26 -4.74 121.76 118.03 1nld s ALA 168 Ca 0.64 1.09 0.07 0.00 0.00 0.00 0.00 51.96 53.76 1nld s ALA 168 Cb -0.57 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.06 1nld s ALA 168 CO 0.57 -0.87 -0.13 0.54 0.00 0.00 0.00 175.76 175.87 1nld s VAL 169 N -1.43 3.19 -0.11 0.00 0.11 0.61 -4.85 120.40 117.92 1nld s VAL 169 Ca 0.64 -1.28 -0.01 0.00 -2.93 0.00 0.00 61.98 58.41 1nld s VAL 169 Cb -0.33 -2.46 -0.02 0.00 -1.53 0.00 0.00 36.38 32.03 1nld s VAL 169 CO 0.41 0.16 -0.08 -0.22 -3.33 0.00 0.00 175.10 172.03 1nld s LEU 170 N -2.04 3.02 0.00 2.54 2.96 -1.26 -1.05 118.68 122.85 1nld s LEU 170 Ca 0.19 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1nld s LEU 170 Cb -0.11 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 44.90 1nld s LEU 170 CO 0.11 0.24 0.00 0.00 -1.32 0.00 0.00 176.35 175.39 1nld n GLN 171 N 3.01 0.00 -1.67 1.98 -0.00 -0.93 -4.89 117.38 114.88 1nld n GLN 171 Ca -0.18 0.00 -0.40 0.00 -0.00 0.00 0.00 57.00 56.42 1nld n GLN 171 Cb 0.53 0.00 -0.01 0.00 -0.00 0.00 0.00 30.24 30.75 1nld n GLN 171 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1nld n SER 172 N 0.00 7.21 -3.38 2.61 2.88 -1.26 -4.52 113.62 117.15 1nld n SER 172 Ca 0.00 -2.82 -0.20 0.00 -1.33 0.00 0.00 58.87 54.52 1nld n SER 172 Cb 0.00 -1.52 0.08 0.00 -0.75 0.00 0.00 64.21 62.02 1nld n SER 172 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1nld n ASP 173 N 3.68 -4.37 -3.71 -3.46 8.00 -1.26 -5.02 116.55 110.41 1nld n ASP 173 Ca 0.65 -0.55 -0.14 0.00 0.71 0.00 0.00 54.79 55.46 1nld n ASP 173 Cb 0.28 -4.85 -0.08 0.00 -0.02 0.00 0.00 41.12 36.45 1nld n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1nld s LEU 174 N -6.63 0.52 0.04 0.64 1.43 -1.26 -4.94 118.68 108.49 1nld s LEU 174 Ca 0.32 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.64 1nld s LEU 174 Cb -0.14 1.55 -0.04 0.00 0.03 0.00 0.00 46.19 47.59 1nld s LEU 174 CO 0.69 -0.49 0.09 -0.31 0.23 0.00 0.00 176.35 176.56 1nld s TYR 175 N -1.34 3.25 -0.05 0.29 2.02 -0.68 -2.19 117.35 118.64 1nld s TYR 175 Ca -0.13 0.14 -0.00 0.00 -0.37 0.00 0.00 57.07 56.71 1nld s TYR 175 Cb -0.04 -1.68 0.03 0.00 -0.40 0.00 0.00 41.96 39.87 1nld s TYR 175 CO 0.05 0.54 -0.01 0.99 -1.57 0.00 0.00 175.55 175.55 1nld s THR 176 N -1.31 0.35 0.28 -0.71 2.01 -0.22 -2.90 115.64 113.15 1nld s THR 176 Ca 0.27 0.07 0.10 0.00 0.31 0.00 0.00 61.69 62.43 1nld s THR 176 Cb -0.12 -0.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 1nld s THR 176 CO 0.19 0.22 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.12 1nld s LEU 177 N 1.52 3.14 -0.22 4.42 2.96 -0.55 -0.28 118.68 129.67 1nld s LEU 177 Ca -0.02 -0.72 -0.18 0.00 -0.22 0.00 0.00 54.13 52.99 1nld s LEU 177 Cb -0.13 -1.64 0.06 0.00 0.50 0.00 0.00 46.19 44.98 1nld s LEU 177 CO -0.03 -0.05 0.56 -0.94 -1.32 0.00 0.00 176.35 174.57 1nld s SER 178 N -3.68 -0.63 0.08 3.68 1.04 -1.25 -1.34 113.70 111.61 1nld s SER 178 Ca 0.32 1.16 0.04 0.00 0.48 0.00 0.00 55.95 57.95 1nld s SER 178 Cb -0.05 1.14 -0.03 0.00 0.10 0.00 0.00 66.02 67.18 1nld s SER 178 CO 0.20 -0.20 -0.11 -0.55 0.98 0.00 0.00 173.24 173.56 1nld s SER 179 N 0.61 1.41 0.30 7.02 0.15 -0.93 -0.54 113.70 121.71 1nld s SER 179 Ca -0.02 -0.74 0.05 0.00 0.70 0.00 0.00 55.95 55.93 1nld s SER 179 Cb -0.05 0.00 -0.06 0.00 -1.71 0.00 0.00 66.02 64.20 1nld s SER 179 CO -0.04 -0.22 0.01 -0.94 1.20 0.00 0.00 173.24 173.26 1nld s SER 180 N -2.18 2.42 -0.24 5.45 1.04 0.36 -0.88 113.70 119.66 1nld s SER 180 Ca 0.02 -1.30 -0.17 0.00 0.48 0.00 0.00 55.95 54.98 1nld s SER 180 Cb -0.05 -0.10 0.07 0.00 0.10 0.00 0.00 66.02 66.04 1nld s SER 180 CO 0.01 -0.52 0.61 0.54 0.98 0.00 0.00 173.24 174.86 1nld s VAL 181 N -3.23 -0.00 -0.60 5.02 0.11 -0.68 -2.23 120.40 118.79 1nld s VAL 181 Ca 0.33 0.02 0.04 0.00 -2.93 0.00 0.00 61.98 59.44 1nld s VAL 181 Cb 0.07 -0.88 0.16 0.00 -1.53 0.00 0.00 36.38 34.20 1nld s VAL 181 CO 0.13 0.01 0.41 -0.89 -3.33 0.00 0.00 175.10 171.43 1nld s THR 182 N 1.12 2.20 0.88 5.04 2.01 -1.11 -0.43 115.64 125.35 1nld s THR 182 Ca -0.06 -3.66 -0.13 0.00 0.31 0.00 0.00 61.69 58.15 1nld s THR 182 Cb -0.05 -2.47 0.12 0.00 0.01 0.00 0.00 72.50 70.11 1nld s THR 182 CO -0.11 -1.01 1.19 0.68 -0.69 0.00 0.00 174.62 174.67 1nld s VAL 183 N -0.83 1.98 0.98 3.82 -7.23 -0.53 -4.74 120.40 113.86 1nld s VAL 183 Ca 0.25 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 60.29 1nld s VAL 183 Cb -0.08 -2.90 0.18 0.00 0.56 0.00 0.00 36.38 34.13 1nld s VAL 183 CO -0.13 0.00 1.10 -0.89 -0.31 0.00 0.00 175.10 174.87 1nld s THR 184 N -3.52 2.11 0.22 5.32 2.01 -1.26 -0.10 115.64 120.43 1nld s THR 184 Ca 0.65 0.04 -0.09 0.00 0.31 0.00 0.00 61.69 62.60 1nld s THR 184 Cb -0.11 -2.58 0.17 0.00 0.01 0.00 0.00 72.50 70.00 1nld s THR 184 CO 0.51 -0.05 1.86 0.28 -0.69 0.00 0.00 174.62 176.53 1nld h SER 185 N -1.80 0.80 -0.64 3.53 0.02 -1.58 -3.07 113.55 110.81 1nld h SER 185 Ca -0.53 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.42 1nld h SER 185 Cb 1.33 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.66 1nld h SER 185 CO 0.58 0.55 0.42 0.28 -1.14 0.00 0.00 176.83 177.53 1nld h SER 186 N 0.95 0.72 0.16 3.07 0.02 -1.87 -3.34 113.55 113.26 1nld h SER 186 Ca 0.31 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.26 1nld h SER 186 Cb 0.02 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.34 1nld h SER 186 CO -0.11 0.52 -0.43 -0.65 -1.14 0.00 0.00 176.83 175.01 1nld h PRO 187 N 0.86 -0.67 -0.80 3.45 0.11 -1.90 -3.28 132.00 129.77 1nld h PRO 187 Ca 0.24 0.05 0.16 0.00 0.11 0.00 0.00 66.00 66.55 1nld h PRO 187 Cb -0.08 0.15 -0.15 0.00 0.11 0.00 0.00 31.00 31.03 1nld h PRO 187 CO -0.06 -0.45 -0.22 2.35 -0.21 0.00 0.00 178.00 179.41 1nld h TRP 188 N -0.70 -0.50 -0.39 0.65 7.01 -1.71 0.70 115.95 121.01 1nld h TRP 188 Ca 0.01 0.07 -0.09 0.00 2.11 0.00 0.00 58.89 60.99 1nld h TRP 188 Cb 0.70 0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 28.10 1nld h TRP 188 CO -0.36 -0.35 -0.12 -1.00 -2.79 0.00 0.00 178.44 173.82 1nld h PRO 189 N -0.01 0.77 0.00 2.65 0.13 -1.78 -3.38 132.00 130.37 1nld h PRO 189 Ca 0.37 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1nld h PRO 189 Cb 0.59 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1nld h PRO 189 CO -0.83 0.92 -0.00 0.77 -0.23 0.00 0.00 178.00 178.63 1nld h SER 190 N 0.58 0.00 -3.82 1.44 0.02 -1.44 -3.46 113.55 106.87 1nld h SER 190 Ca 0.10 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.53 1nld h SER 190 Cb 0.65 0.00 0.04 0.00 0.14 0.00 0.00 62.40 63.23 1nld h SER 190 CO 0.04 0.28 0.58 -1.61 -1.14 0.00 0.00 176.83 174.98 1nld s GLU 191 N -1.31 4.47 -0.74 3.45 2.02 0.24 -4.98 118.70 121.84 1nld s GLU 191 Ca -0.00 2.05 -0.20 0.00 0.02 0.00 0.00 54.97 56.84 1nld s GLU 191 Cb 0.00 -3.12 0.10 0.00 0.10 0.00 0.00 34.13 31.21 1nld s GLU 191 CO 0.00 -0.04 0.95 -0.08 0.02 0.00 0.00 175.26 176.12 1nld s THR 192 N -1.06 4.62 0.18 3.63 -1.32 -1.26 -4.37 115.64 116.06 1nld s THR 192 Ca 0.48 -1.00 -0.30 0.00 -1.21 0.00 0.00 61.69 59.66 1nld s THR 192 Cb -0.37 -4.67 -0.08 0.00 -1.51 0.00 0.00 72.50 65.88 1nld s THR 192 CO 0.47 -1.39 0.99 -0.63 -2.21 0.00 0.00 174.62 171.86 1nld s ILE 193 N 3.14 4.16 -0.06 5.08 1.09 -1.26 -4.92 121.20 128.43 1nld s ILE 193 Ca 0.23 1.96 -0.06 0.00 -1.10 0.00 0.00 60.65 61.68 1nld s ILE 193 Cb -0.14 -4.25 0.02 0.00 -1.06 0.00 0.00 42.46 37.03 1nld s ILE 193 CO 0.02 0.38 0.18 -0.89 -0.10 0.00 0.00 174.94 174.53 1nld s THR 194 N -0.56 0.00 -0.32 2.92 2.01 -1.26 -2.11 115.64 116.31 1nld s THR 194 Ca 0.45 -0.03 -0.07 0.00 0.31 0.00 0.00 61.69 62.35 1nld s THR 194 Cb -0.26 -0.26 0.02 0.00 0.01 0.00 0.00 72.50 72.01 1nld s THR 194 CO 0.32 -0.02 0.11 0.00 -0.69 0.00 0.00 174.62 174.35 1nld s ASN 196 N 1.47 6.60 0.21 0.00 -0.87 -0.37 -0.68 114.94 121.30 1nld s ASN 196 Ca 0.01 0.72 0.08 0.00 -1.57 0.00 0.00 52.86 52.09 1nld s ASN 196 Cb -0.18 -2.30 -0.05 0.00 -0.02 0.00 0.00 41.25 38.70 1nld s ASN 196 CO 0.03 -0.15 -0.14 -0.69 -2.57 0.00 0.00 177.10 173.58 1nld s VAL 197 N 1.47 1.72 -0.30 1.60 1.01 -0.09 -1.14 120.40 124.66 1nld s VAL 197 Ca 0.25 -2.20 -0.09 0.00 0.00 0.00 0.00 61.98 59.93 1nld s VAL 197 Cb -0.15 -2.07 0.17 0.00 0.00 0.00 0.00 36.38 34.33 1nld s VAL 197 CO 0.10 -0.58 0.85 0.00 0.00 0.00 0.00 175.10 175.48 1nld s ALA 198 N -2.98 -2.76 -0.66 5.51 0.00 -0.65 -0.67 121.76 119.55 1nld s ALA 198 Ca 0.23 1.80 -0.20 0.00 0.00 0.00 0.00 51.96 53.80 1nld s ALA 198 Cb -0.00 -2.22 0.10 0.00 0.00 0.00 0.00 23.12 21.00 1nld s ALA 198 CO 0.07 -1.24 0.82 -1.58 0.00 0.00 0.00 175.76 173.83 1nld s HIS 199 N 2.80 2.96 -0.58 0.00 2.46 -0.99 -0.98 115.29 120.96 1nld s HIS 199 Ca 0.05 -0.94 -0.27 0.00 0.47 0.00 0.00 55.06 54.37 1nld s HIS 199 Cb -0.11 -4.11 -0.02 0.00 -0.13 0.00 0.00 32.58 28.21 1nld s HIS 199 CO -0.16 -1.40 1.80 -1.25 -2.47 0.00 0.00 174.74 171.25 1nld s PRO 200 N 2.95 2.79 0.00 2.88 0.04 -1.25 -2.69 135.00 139.72 1nld s PRO 200 Ca 0.17 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1nld s PRO 200 Cb -0.20 -4.33 0.00 0.00 0.04 0.00 0.00 34.50 30.01 1nld s PRO 200 CO 0.05 -2.54 0.00 0.00 0.04 0.00 0.00 177.00 174.55 1nld n ALA 201 N 12.06 0.00 0.23 8.56 0.00 -1.26 -4.87 120.51 135.24 1nld n ALA 201 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.66 1nld n ALA 201 Cb 0.51 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.98 1nld n ALA 201 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nld n SER 202 N 0.00 1.34 -3.43 0.00 3.41 -1.10 -5.02 113.62 108.82 1nld n SER 202 Ca 0.00 -1.17 -0.21 0.00 -0.26 0.00 0.00 58.87 57.23 1nld n SER 202 Cb 0.00 0.10 0.05 0.00 -0.26 0.00 0.00 64.21 64.09 1nld n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1nld n SER 203 N 0.18 -6.17 -4.12 4.04 7.64 -1.14 -4.97 113.62 109.08 1nld n SER 203 Ca 0.03 -0.78 -0.34 0.00 1.01 0.00 0.00 58.87 58.79 1nld n SER 203 Cb 0.13 -4.30 -0.13 0.00 -1.01 0.00 0.00 64.21 58.90 1nld n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1nld s THR 204 N -3.36 2.85 -0.22 0.44 2.01 -1.23 -5.02 115.64 111.11 1nld s THR 204 Ca 0.40 -1.78 -0.09 0.00 0.31 0.00 0.00 61.69 60.53 1nld s THR 204 Cb -0.10 -2.82 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 1nld s THR 204 CO 0.80 -0.36 0.11 -0.75 -0.69 0.00 0.00 174.62 173.73 1nld s LYS 205 N 1.14 3.93 0.09 4.92 2.47 -1.26 -2.35 119.74 128.68 1nld s LYS 205 Ca 0.01 -0.35 0.04 0.00 -1.56 0.00 0.00 55.97 54.11 1nld s LYS 205 Cb -0.20 -3.38 -0.03 0.00 -1.46 0.00 0.00 37.83 32.75 1nld s LYS 205 CO -0.04 0.06 -0.11 0.08 0.16 0.00 0.00 175.35 175.50 1nld s VAL 206 N 1.00 0.97 -0.11 4.02 1.01 0.16 -5.00 120.40 122.45 1nld s VAL 206 Ca 0.05 -1.57 -0.02 0.00 0.00 0.00 0.00 61.98 60.44 1nld s VAL 206 Cb -0.14 -1.30 0.04 0.00 0.00 0.00 0.00 36.38 34.99 1nld s VAL 206 CO 0.03 -0.49 0.02 -1.81 0.00 0.00 0.00 175.10 172.85 1nld s ASP 207 N -2.31 1.95 -0.35 3.32 1.01 -1.26 -0.91 116.67 118.12 1nld s ASP 207 Ca 0.04 -0.30 0.04 0.00 0.71 0.00 0.00 52.55 53.04 1nld s ASP 207 Cb -0.04 -0.44 0.10 0.00 1.01 0.00 0.00 42.92 43.55 1nld s ASP 207 CO 0.01 -0.24 0.06 -0.54 0.21 0.00 0.00 175.17 174.67 1nld s LYS 208 N 1.97 1.51 -0.11 8.23 -0.14 0.14 -4.93 119.74 126.41 1nld s LYS 208 Ca 0.03 -1.90 -0.30 0.00 -1.36 0.00 0.00 55.97 52.45 1nld s LYS 208 Cb -0.14 -3.23 -0.01 0.00 -1.68 0.00 0.00 37.83 32.77 1nld s LYS 208 CO -0.06 -0.95 1.02 -1.59 -0.76 0.00 0.00 175.35 173.01 1nld s LYS 209 N 0.87 4.41 -0.25 1.68 -2.85 -1.26 -0.61 119.74 121.73 1nld s LYS 209 Ca 0.11 1.41 -0.29 0.00 -1.00 0.00 0.00 55.97 56.20 1nld s LYS 209 Cb -0.19 -3.55 -0.02 0.00 -2.06 0.00 0.00 37.83 32.00 1nld s LYS 209 CO -0.08 -0.35 1.65 0.42 0.10 0.00 0.00 175.35 177.10 1nld s ILE 210 N 2.12 3.65 0.14 3.79 -1.09 -0.90 -4.97 121.20 123.94 1nld s ILE 210 Ca 0.49 0.72 0.08 0.00 -2.23 0.00 0.00 60.65 59.70 1nld s ILE 210 Cb -0.18 -3.70 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 1nld s ILE 210 CO 0.17 -0.33 -0.09 -1.61 -1.23 0.00 0.00 174.94 171.86 1nld s GLU 211 N 4.88 2.14 0.70 2.79 2.02 -1.26 -4.74 118.70 125.22 1nld s GLU 211 Ca 0.73 -1.12 -0.16 0.00 0.02 0.00 0.00 54.97 54.44 1nld s GLU 211 Cb -0.24 -2.26 0.02 0.00 0.10 0.00 0.00 34.13 31.75 1nld s GLU 211 CO 0.30 0.48 1.24 -2.14 0.02 0.00 0.00 175.26 175.16 1nld s PRO 212 N -2.52 2.29 0.25 0.39 0.02 -1.26 -4.70 135.00 129.46 1nld s PRO 212 Ca 0.23 1.88 0.05 0.00 0.02 0.00 0.00 61.00 63.18 1nld s PRO 212 Cb -0.10 -1.84 -0.02 0.00 0.02 0.00 0.00 34.50 32.57 1nld s PRO 212 CO 0.15 -1.75 0.24 2.89 -0.33 0.00 0.00 177.00 178.19 1nld n ARG 213 N -2.41 0.34 -3.65 5.54 1.85 -1.26 -5.12 116.66 111.95 1nld n ARG 213 Ca 0.14 -2.41 0.01 0.00 -1.00 0.00 0.00 57.85 54.59 1nld n ARG 213 Cb 0.49 2.03 -0.06 0.00 -1.05 0.00 0.00 32.46 33.87 1nld n ARG 213 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1nld s GLY 214 N -2.71 0.48 0.00 2.89 0.00 -1.26 -4.81 107.32 101.91 1nld s GLY 214 Ca 0.28 3.67 0.00 0.00 0.00 0.00 0.00 44.72 48.67 1nld s GLY 214 CO 0.20 2.60 0.22 0.00 0.00 0.00 0.00 173.10 176.12