#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tei s ASP 2 N 0.00 5.81 -0.30 0.00 1.01 -1.26 -5.03 116.67 116.90 1tei s ASP 2 Ca 0.00 2.12 -0.11 0.00 0.71 0.00 0.00 52.55 55.27 1tei s ASP 2 Cb 0.00 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 1tei s ASP 2 CO 0.00 -1.16 0.18 -0.89 0.21 0.00 0.00 175.17 173.52 1tei s THR 3 N -1.84 5.01 -0.04 -1.27 2.01 -1.26 -5.03 115.64 113.22 1tei s THR 3 Ca 0.71 -0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.63 1tei s THR 3 Cb -0.22 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 1tei s THR 3 CO 0.26 0.13 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.47 1tei s ILE 4 N 1.70 1.83 -0.11 1.82 -1.09 -1.26 -3.48 121.20 120.61 1tei s ILE 4 Ca 0.06 -0.96 -0.01 0.00 -2.23 0.00 0.00 60.65 57.51 1tei s ILE 4 Cb -0.17 -1.54 0.03 0.00 -1.58 0.00 0.00 42.46 39.20 1tei s ILE 4 CO 0.09 0.52 -0.05 -0.69 -1.23 0.00 0.00 174.94 173.57 1tei s VAL 5 N -0.28 0.84 0.13 2.92 1.01 -1.02 0.15 120.40 124.14 1tei s VAL 5 Ca 0.02 -0.19 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 1tei s VAL 5 Cb -0.11 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 1tei s VAL 5 CO 0.01 0.32 0.17 0.00 0.00 0.00 0.00 175.10 175.60 1tei s ALA 6 N 1.78 0.25 -0.24 5.51 0.00 -0.25 -1.17 121.76 127.65 1tei s ALA 6 Ca 0.05 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.00 1tei s ALA 6 Cb -0.13 0.72 0.06 0.00 0.00 0.00 0.00 23.12 23.77 1tei s ALA 6 CO -0.07 -0.54 -0.08 0.08 0.00 0.00 0.00 175.76 175.14 1tei s VAL 7 N -3.96 1.76 -0.04 0.00 1.01 0.00 -0.77 120.40 118.40 1tei s VAL 7 Ca 0.15 -1.32 -0.04 0.00 0.00 0.00 0.00 61.98 60.77 1tei s VAL 7 Cb 0.05 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1tei s VAL 7 CO -0.03 -0.03 0.16 -1.83 0.00 0.00 0.00 175.10 173.37 1tei s GLU 8 N 1.30 3.41 -0.78 2.72 -1.05 -0.18 -1.17 118.70 122.95 1tei s GLU 8 Ca -0.06 -0.29 -0.00 0.00 -0.15 0.00 0.00 54.97 54.47 1tei s GLU 8 Cb -0.19 -3.10 0.19 0.00 -0.44 0.00 0.00 34.13 30.59 1tei s GLU 8 CO -0.06 0.70 0.63 -0.51 0.95 0.00 0.00 175.26 176.96 1tei s LEU 9 N -1.69 5.29 -0.45 1.83 1.02 0.81 -0.78 118.68 124.70 1tei s LEU 9 Ca 0.24 -3.52 -0.29 0.00 0.02 0.00 0.00 54.13 50.58 1tei s LEU 9 Cb -0.12 -1.83 0.03 0.00 0.02 0.00 0.00 46.19 44.28 1tei s LEU 9 CO 0.15 -0.21 1.11 -0.62 0.02 0.00 0.00 176.35 176.80 1tei s ASP 10 N -0.22 6.67 0.21 2.29 -1.08 0.53 -2.05 116.67 123.01 1tei s ASP 10 Ca 0.24 0.53 0.22 0.00 -0.52 0.00 0.00 52.55 53.02 1tei s ASP 10 Cb -0.10 -2.54 0.02 0.00 -1.46 0.00 0.00 42.92 38.83 1tei s ASP 10 CO -0.11 -1.18 1.07 0.71 0.52 0.00 0.00 175.17 176.19 1tei h THR 11 N 6.14 0.04 -3.25 1.71 1.35 -1.65 -0.95 112.91 116.31 1tei h THR 11 Ca -0.23 -1.07 -0.66 0.00 -0.55 0.00 0.00 66.41 63.89 1tei h THR 11 Cb 1.06 1.58 -0.31 0.00 -1.73 0.00 0.00 68.15 68.75 1tei h THR 11 CO 1.10 0.02 -0.80 -0.47 -0.25 0.00 0.00 175.52 175.13 1tei s TYR 12 N -3.32 2.82 -0.26 4.73 5.04 -1.21 -4.51 117.35 120.64 1tei s TYR 12 Ca -0.00 -1.17 -0.29 0.00 -2.44 0.00 0.00 57.07 53.16 1tei s TYR 12 Cb 0.09 -1.95 0.01 0.00 0.35 0.00 0.00 41.96 40.47 1tei s TYR 12 CO 0.78 -0.58 1.07 -1.25 -1.34 0.00 0.00 175.55 174.24 1tei s PRO 13 N 1.09 4.18 -0.80 4.97 0.04 -1.26 -4.97 135.00 138.25 1tei s PRO 13 Ca -0.00 1.28 -0.01 0.00 0.04 0.00 0.00 61.00 62.31 1tei s PRO 13 Cb -0.14 -3.69 0.20 0.00 0.04 0.00 0.00 34.50 30.91 1tei s PRO 13 CO -0.04 -0.74 0.66 -0.80 0.04 0.00 0.00 177.00 176.12 1tei s ASN 14 N 1.44 5.61 0.45 6.66 -0.87 -1.26 -4.93 114.94 122.04 1tei s ASN 14 Ca 0.45 -3.59 0.12 0.00 -1.57 0.00 0.00 52.86 48.27 1tei s ASN 14 Cb -0.14 -1.84 1.03 0.00 -0.02 0.00 0.00 41.25 40.27 1tei s ASN 14 CO 0.10 -0.20 2.06 0.71 -2.57 0.00 0.00 177.10 177.20 1tei h THR 15 N 4.36 1.01 -0.49 1.60 1.35 -1.85 -1.75 112.91 117.14 1tei h THR 15 Ca 0.12 -0.12 0.04 0.00 -0.55 0.00 0.00 66.41 65.90 1tei h THR 15 Cb 0.83 0.62 -0.03 0.00 -1.73 0.00 0.00 68.15 67.84 1tei h THR 15 CO 0.80 0.06 0.33 -2.24 -0.25 0.00 0.00 175.52 174.22 1tei h ASP 16 N 0.35 0.44 -0.64 5.36 2.03 -1.92 -0.83 116.42 121.22 1tei h ASP 16 Ca 0.15 -0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.36 1tei h ASP 16 Cb 0.16 -0.10 -0.05 0.00 -0.83 0.00 0.00 39.33 38.51 1tei h ASP 16 CO -0.03 0.30 0.12 2.30 -1.03 0.00 0.00 179.24 180.89 1tei n ILE 17 N -4.47 2.81 -0.09 4.15 -5.35 -0.94 -4.92 119.36 110.55 1tei n ILE 17 Ca 0.06 -1.47 0.00 0.00 -0.27 0.00 0.00 62.75 61.07 1tei n ILE 17 Cb 0.18 -0.32 0.00 0.00 -1.74 0.00 0.00 39.64 37.76 1tei n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1tei n GLY 18 N 0.31 0.51 3.76 3.28 0.00 -0.32 -4.72 105.19 108.01 1tei n GLY 18 Ca 0.33 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.00 1tei n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tei s ASP 19 N -2.76 5.40 0.73 1.61 1.01 -0.70 -4.94 116.67 117.02 1tei s ASP 19 Ca 0.00 2.22 -0.11 0.00 0.71 0.00 0.00 52.55 55.37 1tei s ASP 19 Cb 0.00 -2.58 0.03 0.00 1.01 0.00 0.00 42.92 41.38 1tei s ASP 19 CO 0.00 -1.44 1.07 -2.84 0.21 0.00 0.00 175.17 172.17 1tei s PRO 20 N -3.45 2.62 0.00 8.23 0.02 -1.26 -4.07 135.00 137.09 1tei s PRO 20 Ca 0.73 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.74 1tei s PRO 20 Cb -0.25 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.31 1tei s PRO 20 CO 0.32 -1.33 1.02 -1.13 -0.33 0.00 0.00 177.00 175.54 1tei n SER 21 N -3.29 2.96 -3.57 2.53 3.41 -1.26 -4.61 113.62 109.79 1tei n SER 21 Ca 0.08 -1.84 -0.11 0.00 -0.26 0.00 0.00 58.87 56.74 1tei n SER 21 Cb 0.54 -0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 63.93 1tei n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1tei s TYR 22 N 0.13 -0.32 0.34 7.33 -0.85 -1.26 -4.95 117.35 117.77 1tei s TYR 22 Ca 0.00 0.03 -0.27 0.00 -0.52 0.00 0.00 57.07 56.31 1tei s TYR 22 Cb 0.00 0.38 -0.13 0.00 0.38 0.00 0.00 41.96 42.60 1tei s TYR 22 CO 0.00 -0.78 1.17 -2.30 -1.52 0.00 0.00 175.55 172.12 1tei n PRO 23 N -0.29 1.79 -3.91 -3.49 -0.02 -1.26 -4.68 135.00 123.13 1tei n PRO 23 Ca -0.16 0.63 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 1tei n PRO 23 Cb 0.64 -2.14 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 1tei n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1tei s HIS 24 N -1.11 0.01 0.12 6.00 -3.43 -0.36 -1.48 115.29 115.04 1tei s HIS 24 Ca 0.57 -0.44 0.09 0.00 -0.80 0.00 0.00 55.06 54.49 1tei s HIS 24 Cb -0.61 0.54 -0.04 0.00 -1.43 0.00 0.00 32.58 31.04 1tei s HIS 24 CO 0.61 -1.17 -0.21 0.96 -2.00 0.00 0.00 174.74 172.93 1tei s ILE 25 N -3.90 2.67 0.22 -5.38 -4.36 -0.82 -0.35 121.20 109.28 1tei s ILE 25 Ca 0.15 -1.56 -0.19 0.00 -0.26 0.00 0.00 60.65 58.80 1tei s ILE 25 Cb -0.04 -2.21 0.03 0.00 1.25 0.00 0.00 42.46 41.48 1tei s ILE 25 CO 0.08 0.11 0.58 -0.83 0.24 0.00 0.00 174.94 175.12 1tei s GLY 26 N -2.08 -0.07 -0.30 6.27 0.00 0.04 -1.93 107.32 109.26 1tei s GLY 26 Ca 0.17 -0.25 -0.06 0.00 0.00 0.00 0.00 44.72 44.57 1tei s GLY 26 CO 0.09 -0.21 0.06 -0.42 0.00 0.00 0.00 173.10 172.61 1tei s ILE 27 N -3.89 3.72 -0.25 0.90 1.01 -0.49 -1.01 121.20 121.18 1tei s ILE 27 Ca 0.11 -0.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.81 1tei s ILE 27 Cb -0.02 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 1tei s ILE 27 CO 0.01 0.04 0.10 -1.81 0.00 0.00 0.00 174.94 173.27 1tei s ASP 28 N 1.44 5.39 -0.39 3.58 1.01 0.05 -0.64 116.67 127.11 1tei s ASP 28 Ca 0.01 -0.13 -0.02 0.00 0.71 0.00 0.00 52.55 53.12 1tei s ASP 28 Cb -0.18 -1.97 0.10 0.00 1.01 0.00 0.00 42.92 41.88 1tei s ASP 28 CO 0.01 -0.01 0.17 -0.63 0.21 0.00 0.00 175.17 174.92 1tei s ILE 29 N 1.48 3.17 -1.35 0.77 -1.09 -1.26 -1.09 121.20 121.84 1tei s ILE 29 Ca 0.06 -2.02 0.00 0.00 -2.23 0.00 0.00 60.65 56.46 1tei s ILE 29 Cb -0.15 -3.16 0.00 0.00 -1.58 0.00 0.00 42.46 37.57 1tei s ILE 29 CO 0.05 -0.63 0.00 0.29 -1.23 0.00 0.00 174.94 173.42 1tei n LYS 30 N 4.57 -1.66 -3.59 2.79 5.02 0.12 -4.92 118.16 120.48 1tei n LYS 30 Ca -0.03 0.94 -0.16 0.00 -2.02 0.00 0.00 58.31 57.04 1tei n LYS 30 Cb 0.42 -5.35 -0.07 0.00 -0.02 0.00 0.00 35.03 30.00 1tei n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1tei s SER 31 N -2.45 -0.63 0.29 4.39 0.15 -1.26 -4.92 113.70 109.26 1tei s SER 31 Ca 0.00 0.92 0.25 0.00 0.70 0.00 0.00 55.95 57.82 1tei s SER 31 Cb 0.00 0.85 1.01 0.00 -1.71 0.00 0.00 66.02 66.17 1tei s SER 31 CO 0.00 -0.44 1.75 1.62 1.20 0.00 0.00 173.24 177.36 1tei h VAL 32 N 3.52 0.00 -1.98 4.45 3.04 -1.88 -3.38 116.25 120.01 1tei h VAL 32 Ca -0.28 -0.29 -0.64 0.00 -1.01 0.00 0.00 66.70 64.49 1tei h VAL 32 Cb 1.15 1.07 -0.14 0.00 -2.01 0.00 0.00 31.29 31.37 1tei h VAL 32 CO 0.27 0.00 1.04 -0.13 -1.01 0.00 0.00 177.57 177.74 1tei s ARG 33 N -3.34 3.48 0.19 4.17 0.52 -1.26 -4.97 118.95 117.74 1tei s ARG 33 Ca 0.04 -1.25 -0.30 0.00 -0.52 0.00 0.00 55.73 53.69 1tei s ARG 33 Cb 0.09 -4.90 -0.16 0.00 0.52 0.00 0.00 34.95 30.50 1tei s ARG 33 CO 0.43 -1.97 0.86 0.43 0.02 0.00 0.00 175.30 175.06 1tei n SER 34 N 7.81 0.14 0.21 0.23 7.64 -1.26 -4.80 113.62 123.59 1tei n SER 34 Ca 0.21 1.15 0.13 0.00 1.01 0.00 0.00 58.87 61.37 1tei n SER 34 Cb 0.49 -1.09 0.31 0.00 -1.01 0.00 0.00 64.21 62.91 1tei n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1tei h LYS 35 N 2.03 0.00 -1.96 1.43 1.79 -1.21 -3.45 116.57 115.19 1tei h LYS 35 Ca -0.37 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.07 1tei h LYS 35 Cb 1.39 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.83 1tei h LYS 35 CO 0.62 0.00 0.18 0.21 -1.08 0.00 0.00 179.45 179.38 1tei s LYS 36 N -3.28 0.85 0.24 3.15 2.47 -1.24 -5.02 119.74 116.91 1tei s LYS 36 Ca 0.06 0.81 0.01 0.00 -1.56 0.00 0.00 55.97 55.29 1tei s LYS 36 Cb 0.07 0.41 -0.03 0.00 -1.46 0.00 0.00 37.83 36.82 1tei s LYS 36 CO 0.62 -0.14 0.19 0.95 0.16 0.00 0.00 175.35 177.14 1tei s THR 37 N 0.05 0.00 -0.14 3.43 -4.23 -1.26 -1.40 115.64 112.08 1tei s THR 37 Ca -0.02 -1.96 -0.17 0.00 -1.18 0.00 0.00 61.69 58.36 1tei s THR 37 Cb -0.04 -2.49 0.04 0.00 1.34 0.00 0.00 72.50 71.35 1tei s THR 37 CO 0.02 0.00 0.46 0.00 -0.54 0.00 0.00 174.62 174.56 1tei s ALA 38 N -3.94 -1.14 0.32 3.99 0.00 -0.81 -4.98 121.76 115.20 1tei s ALA 38 Ca 0.38 1.15 -0.29 0.00 0.00 0.00 0.00 51.96 53.20 1tei s ALA 38 Cb 0.05 -0.57 -0.11 0.00 0.00 0.00 0.00 23.12 22.50 1tei s ALA 38 CO 0.16 -0.24 1.55 0.21 0.00 0.00 0.00 175.76 177.45 1tei s LYS 39 N -0.12 4.13 -0.15 0.00 2.20 -1.26 -1.94 119.74 122.58 1tei s LYS 39 Ca -0.03 2.56 -0.00 0.00 -0.36 0.00 0.00 55.97 58.14 1tei s LYS 39 Cb -0.03 -3.01 0.03 0.00 -1.51 0.00 0.00 37.83 33.31 1tei s LYS 39 CO 0.02 -0.59 -0.08 -0.46 -0.36 0.00 0.00 175.35 173.88 1tei s TRP 40 N -0.37 1.80 -1.27 4.03 -0.00 -0.55 -4.74 118.94 117.84 1tei s TRP 40 Ca 0.60 -1.08 -0.16 0.00 -0.00 0.00 0.00 56.10 55.46 1tei s TRP 40 Cb -0.47 -1.37 0.11 0.00 -0.00 0.00 0.00 33.47 31.74 1tei s TRP 40 CO 0.53 -0.61 1.62 0.09 -0.00 0.00 0.00 176.95 178.57 1tei n ASN 41 N 4.85 5.05 -4.75 5.86 3.02 -1.26 -4.40 115.26 123.64 1tei n ASN 41 Ca -0.13 -2.94 -0.41 0.00 -0.03 0.00 0.00 54.58 51.06 1tei n ASN 41 Cb 0.48 -1.67 -0.02 0.00 -0.61 0.00 0.00 39.78 37.96 1tei n ASN 41 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1tei s MET 42 N 3.09 4.20 -0.40 3.52 -2.45 -1.26 -4.98 119.30 121.02 1tei s MET 42 Ca 0.49 2.42 -0.04 0.00 -1.25 0.00 0.00 55.69 57.32 1tei s MET 42 Cb 0.01 -3.07 0.10 0.00 1.25 0.00 0.00 34.83 33.12 1tei s MET 42 CO 0.05 -0.52 0.20 -0.65 1.05 0.00 0.00 175.02 175.14 1tei s GLN 43 N -0.34 2.16 -0.06 4.11 -0.21 -1.26 -5.07 119.66 119.00 1tei s GLN 43 Ca 0.62 -1.71 -0.34 0.00 0.02 0.00 0.00 55.36 53.95 1tei s GLN 43 Cb -0.45 -3.59 -0.12 0.00 1.00 0.00 0.00 33.01 29.85 1tei s GLN 43 CO 0.45 -1.02 1.84 -1.71 -2.12 0.00 0.00 175.29 172.73 1tei n ASN 44 N 4.66 3.38 0.00 5.90 2.85 -1.26 -2.39 115.26 128.41 1tei n ASN 44 Ca -0.05 0.99 0.00 0.00 -0.11 0.00 0.00 54.58 55.41 1tei n ASN 44 Cb 0.42 -1.37 0.00 0.00 1.24 0.00 0.00 39.78 40.06 1tei n ASN 44 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1tei n GLY 45 N 4.26 0.81 3.58 8.20 0.00 0.25 -4.98 105.19 117.31 1tei n GLY 45 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 1tei n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tei s LYS 46 N -0.62 2.11 -0.11 1.61 1.02 -1.00 -4.93 119.74 117.81 1tei s LYS 46 Ca 0.00 -1.12 -0.30 0.00 0.02 0.00 0.00 55.97 54.58 1tei s LYS 46 Cb 0.00 -2.25 -0.01 0.00 -0.52 0.00 0.00 37.83 35.04 1tei s LYS 46 CO 0.00 0.48 1.09 0.08 -0.92 0.00 0.00 175.35 176.07 1tei s VAL 47 N -1.41 4.58 0.48 3.17 1.01 -1.26 -4.18 120.40 122.79 1tei s VAL 47 Ca 0.23 1.87 0.04 0.00 0.00 0.00 0.00 61.98 64.12 1tei s VAL 47 Cb -0.10 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 1tei s VAL 47 CO 0.14 -0.03 0.09 -0.83 0.00 0.00 0.00 175.10 174.47 1tei s GLY 48 N 1.28 2.71 -0.02 4.51 0.00 -0.07 -4.55 107.32 111.19 1tei s GLY 48 Ca 0.50 -1.19 0.02 0.00 0.00 0.00 0.00 44.72 44.06 1tei s GLY 48 CO 0.17 -2.10 -0.08 -1.59 0.00 0.00 0.00 173.10 169.50 1tei s THR 49 N -2.78 0.71 -0.02 0.90 2.01 -0.09 -1.61 115.64 114.75 1tei s THR 49 Ca 0.22 -0.35 0.07 0.00 0.31 0.00 0.00 61.69 61.94 1tei s THR 49 Cb 0.03 -0.61 -0.02 0.00 0.01 0.00 0.00 72.50 71.91 1tei s THR 49 CO 0.12 0.21 -0.25 0.00 -0.69 0.00 0.00 174.62 174.01 1tei s ALA 50 N 0.01 2.08 -0.08 7.40 0.00 0.18 -1.38 121.76 129.97 1tei s ALA 50 Ca -0.00 -1.07 -0.02 0.00 0.00 0.00 0.00 51.96 50.88 1tei s ALA 50 Cb -0.06 -0.54 0.03 0.00 0.00 0.00 0.00 23.12 22.55 1tei s ALA 50 CO -0.00 0.50 0.01 -1.58 0.00 0.00 0.00 175.76 174.69 1tei s HIS 51 N -0.53 0.63 -0.07 0.00 5.04 0.01 -1.57 115.29 118.80 1tei s HIS 51 Ca 0.08 -0.18 0.02 0.00 -1.54 0.00 0.00 55.06 53.44 1tei s HIS 51 Cb -0.10 -0.79 -0.03 0.00 0.04 0.00 0.00 32.58 31.71 1tei s HIS 51 CO -0.00 -0.34 -0.12 0.42 -2.34 0.00 0.00 174.74 172.36 1tei s ILE 52 N 1.99 3.28 0.03 0.89 1.09 0.18 -1.32 121.20 127.34 1tei s ILE 52 Ca 0.05 -0.63 -0.00 0.00 -1.10 0.00 0.00 60.65 58.96 1tei s ILE 52 Cb -0.13 -2.32 -0.03 0.00 -1.06 0.00 0.00 42.46 38.92 1tei s ILE 52 CO -0.05 0.58 -0.03 0.27 -0.10 0.00 0.00 174.94 175.61 1tei s ILE 53 N -0.55 0.17 -0.11 2.92 -4.36 -0.12 -0.77 121.20 118.37 1tei s ILE 53 Ca 0.08 -1.27 -0.30 0.00 -0.26 0.00 0.00 60.65 58.90 1tei s ILE 53 Cb -0.12 -0.77 0.09 0.00 1.25 0.00 0.00 42.46 42.91 1tei s ILE 53 CO 0.02 -0.70 0.78 -0.47 0.24 0.00 0.00 174.94 174.81 1tei s TYR 54 N -2.44 -0.59 -0.11 1.37 5.04 -0.87 -1.29 117.35 118.46 1tei s TYR 54 Ca -0.07 1.09 -0.14 0.00 -2.44 0.00 0.00 57.07 55.51 1tei s TYR 54 Cb -0.03 0.40 0.03 0.00 0.35 0.00 0.00 41.96 42.72 1tei s TYR 54 CO -0.05 -0.50 0.36 0.54 -1.34 0.00 0.00 175.55 174.57 1tei s ASN 55 N -0.93 -0.35 0.35 4.32 2.20 -1.25 -1.98 114.94 117.30 1tei s ASN 55 Ca -0.07 0.60 0.26 0.00 -0.94 0.00 0.00 52.86 52.71 1tei s ASN 55 Cb -0.01 0.65 1.20 0.00 -2.00 0.00 0.00 41.25 41.09 1tei s ASN 55 CO 0.06 -0.21 1.79 0.77 -2.94 0.00 0.00 177.10 176.57 1tei h SER 56 N 5.11 0.00 0.42 3.54 4.64 -0.55 -0.05 113.55 126.66 1tei h SER 56 Ca -0.27 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 1tei h SER 56 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1tei h SER 56 CO 0.30 0.00 -0.20 0.58 -0.87 0.00 0.00 176.83 176.64 1tei h VAL 57 N 0.00 0.25 0.00 0.95 2.07 -1.89 -3.33 116.25 114.30 1tei h VAL 57 Ca 0.00 -0.62 -0.11 0.00 0.82 0.00 0.00 66.70 66.79 1tei h VAL 57 Cb 0.27 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1tei h VAL 57 CO 0.00 0.05 -0.56 0.44 0.02 0.00 0.00 177.57 177.53 1tei h ASP 58 N -1.06 0.00 -5.97 0.57 3.32 -1.98 -3.47 116.42 107.83 1tei h ASP 58 Ca -0.06 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.60 1tei h ASP 58 Cb 0.52 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.16 1tei h ASP 58 CO 0.09 0.51 -0.82 0.29 -1.72 0.00 0.00 179.24 177.59 1tei n LYS 59 N -3.21 -5.03 -4.06 3.56 5.02 -0.03 -4.89 118.16 109.51 1tei n LYS 59 Ca 0.01 0.67 -0.24 0.00 -2.02 0.00 0.00 58.31 56.73 1tei n LYS 59 Cb 0.74 -5.32 -0.17 0.00 -0.02 0.00 0.00 35.03 30.27 1tei n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1tei s ARG 60 N -5.78 1.27 -0.25 1.97 3.52 -1.25 -1.75 118.95 116.68 1tei s ARG 60 Ca 0.04 -0.19 -0.12 0.00 -0.13 0.00 0.00 55.73 55.33 1tei s ARG 60 Cb -0.01 -1.31 -0.05 0.00 -1.56 0.00 0.00 34.95 32.03 1tei s ARG 60 CO 0.79 -0.18 0.21 -1.17 -0.81 0.00 0.00 175.30 174.14 1tei s LEU 61 N 1.41 4.08 0.14 -0.88 2.96 -0.33 -3.92 118.68 122.15 1tei s LEU 61 Ca -0.02 0.12 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 1tei s LEU 61 Cb -0.13 -2.18 -0.04 0.00 0.50 0.00 0.00 46.19 44.34 1tei s LEU 61 CO -0.04 -0.01 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.38 1tei s SER 62 N 1.37 2.31 -0.04 3.68 0.01 -0.42 -1.31 113.70 119.30 1tei s SER 62 Ca 0.09 -0.85 -0.09 0.00 1.31 0.00 0.00 55.95 56.42 1tei s SER 62 Cb -0.15 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 65.99 1tei s SER 62 CO 0.08 -0.10 0.20 0.00 0.41 0.00 0.00 173.24 173.82 1tei s ALA 63 N -2.17 -0.50 -0.03 1.44 0.00 -0.41 -0.94 121.76 119.16 1tei s ALA 63 Ca 0.13 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.40 1tei s ALA 63 Cb -0.05 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.96 1tei s ALA 63 CO 0.05 -0.16 -0.06 0.08 0.00 0.00 0.00 175.76 175.66 1tei s VAL 64 N -0.65 0.57 -0.02 0.00 1.01 -0.44 -1.89 120.40 118.99 1tei s VAL 64 Ca -0.07 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1tei s VAL 64 Cb -0.04 -0.54 -0.00 0.00 0.00 0.00 0.00 36.38 35.80 1tei s VAL 64 CO 0.01 0.20 -0.12 -0.69 0.00 0.00 0.00 175.10 174.50 1tei s VAL 65 N 0.37 1.02 0.20 2.92 1.01 -0.70 -0.81 120.40 124.41 1tei s VAL 65 Ca -0.05 -0.52 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 1tei s VAL 65 Cb -0.09 -0.88 0.05 0.00 0.00 0.00 0.00 36.38 35.46 1tei s VAL 65 CO 0.00 0.30 0.65 -0.94 0.00 0.00 0.00 175.10 175.11 1tei s SER 66 N -0.04 -0.46 0.15 3.32 1.04 -0.48 -1.26 113.70 115.98 1tei s SER 66 Ca -0.00 -0.21 0.11 0.00 0.48 0.00 0.00 55.95 56.33 1tei s SER 66 Cb -0.08 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 1tei s SER 66 CO 0.00 -1.09 -0.24 -0.31 0.98 0.00 0.00 173.24 172.58 1tei s TYR 67 N -3.79 2.19 0.39 5.02 2.02 -1.26 -0.91 117.35 121.01 1tei s TYR 67 Ca 0.04 -0.39 -0.26 0.00 -0.37 0.00 0.00 57.07 56.10 1tei s TYR 67 Cb -0.03 -1.15 -0.11 0.00 -0.40 0.00 0.00 41.96 40.28 1tei s TYR 67 CO -0.06 0.38 1.15 -2.30 -1.57 0.00 0.00 175.55 173.15 1tei n PRO 68 N 0.66 1.69 -1.95 -1.71 -0.02 -1.26 -2.36 135.00 130.06 1tei n PRO 68 Ca -0.16 0.60 -0.17 0.00 -2.02 0.00 0.00 63.50 61.75 1tei n PRO 68 Cb 0.54 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 1tei n PRO 68 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1tei n ASN 69 N 0.51 -4.82 -4.33 2.55 5.03 -1.26 -4.96 115.26 107.98 1tei n ASN 69 Ca 0.08 0.25 -0.17 0.00 0.87 0.00 0.00 54.58 55.61 1tei n ASN 69 Cb 0.38 -4.19 -0.10 0.00 -1.02 0.00 0.00 39.78 34.85 1tei n ASN 69 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1tei s ALA 70 N -2.66 1.85 0.57 5.41 0.00 -0.99 -5.13 121.76 120.80 1tei s ALA 70 Ca 0.00 -1.72 -0.18 0.00 0.00 0.00 0.00 51.96 50.06 1tei s ALA 70 Cb 0.00 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 1tei s ALA 70 CO 0.00 -0.15 1.09 -0.51 0.00 0.00 0.00 175.76 176.20 1tei s ASP 71 N -3.30 5.70 0.03 0.00 1.01 -1.26 -4.66 116.67 114.18 1tei s ASP 71 Ca 0.25 2.02 -0.00 0.00 0.71 0.00 0.00 52.55 55.53 1tei s ASP 71 Cb 0.04 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 1tei s ASP 71 CO 0.07 -1.23 0.14 -0.94 0.21 0.00 0.00 175.17 173.43 1tei s SER 72 N -2.20 6.00 -0.06 0.27 1.04 -1.26 -4.60 113.70 112.88 1tei s SER 72 Ca 0.69 0.20 -0.13 0.00 0.48 0.00 0.00 55.95 57.18 1tei s SER 72 Cb -0.20 -1.78 -0.05 0.00 0.10 0.00 0.00 66.02 64.09 1tei s SER 72 CO 0.31 0.22 0.33 0.00 0.98 0.00 0.00 173.24 175.08 1tei s ALA 73 N -1.35 3.71 0.03 5.32 0.00 -0.39 -4.94 121.76 124.14 1tei s ALA 73 Ca 0.29 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.93 1tei s ALA 73 Cb -0.12 -2.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.67 1tei s ALA 73 CO 0.21 0.42 -0.14 0.99 0.00 0.00 0.00 175.76 177.23 1tei s THR 74 N -0.70 1.09 -0.13 0.00 2.01 -1.26 -1.72 115.64 114.94 1tei s THR 74 Ca 0.20 -0.89 -0.11 0.00 0.31 0.00 0.00 61.69 61.21 1tei s THR 74 Cb -0.15 -0.97 0.04 0.00 0.01 0.00 0.00 72.50 71.43 1tei s THR 74 CO 0.09 0.08 0.33 0.54 -0.69 0.00 0.00 174.62 174.98 1tei s VAL 75 N -0.71 -0.01 0.04 3.82 0.11 -0.79 -4.72 120.40 118.15 1tei s VAL 75 Ca 0.02 0.02 0.01 0.00 -2.93 0.00 0.00 61.98 59.11 1tei s VAL 75 Cb -0.07 -0.48 -0.03 0.00 -1.53 0.00 0.00 36.38 34.27 1tei s VAL 75 CO 0.01 0.01 -0.05 -0.55 -3.33 0.00 0.00 175.10 171.19 1tei s SER 76 N 0.42 0.60 -0.24 3.54 0.15 -1.26 -1.28 113.70 115.62 1tei s SER 76 Ca -0.02 -0.68 -0.19 0.00 0.70 0.00 0.00 55.95 55.76 1tei s SER 76 Cb -0.04 0.10 0.07 0.00 -1.71 0.00 0.00 66.02 64.44 1tei s SER 76 CO -0.02 -0.35 0.63 -0.47 1.20 0.00 0.00 173.24 174.22 1tei s TYR 77 N -2.22 -0.78 -0.22 3.44 5.04 -0.43 -4.95 117.35 117.22 1tei s TYR 77 Ca -0.06 1.77 -0.28 0.00 -2.44 0.00 0.00 57.07 56.06 1tei s TYR 77 Cb -0.04 0.35 0.01 0.00 0.35 0.00 0.00 41.96 42.62 1tei s TYR 77 CO -0.03 -0.39 1.00 -0.51 -1.34 0.00 0.00 175.55 174.29 1tei s ASP 78 N 0.78 7.07 -0.20 4.32 1.01 -1.26 -1.19 116.67 127.20 1tei s ASP 78 Ca -0.04 1.34 -0.10 0.00 0.71 0.00 0.00 52.55 54.46 1tei s ASP 78 Cb -0.05 -2.52 0.07 0.00 1.01 0.00 0.00 42.92 41.43 1tei s ASP 78 CO -0.06 -0.62 0.47 0.54 0.21 0.00 0.00 175.17 175.71 1tei s VAL 79 N 3.03 -0.22 -0.65 -1.27 0.11 -0.72 -4.98 120.40 115.70 1tei s VAL 79 Ca 0.43 0.09 -0.21 0.00 -2.93 0.00 0.00 61.98 59.36 1tei s VAL 79 Cb -0.15 -0.71 0.09 0.00 -1.53 0.00 0.00 36.38 34.07 1tei s VAL 79 CO 0.07 0.04 0.87 -0.62 -3.33 0.00 0.00 175.10 172.13 1tei s ASP 80 N 1.81 6.20 0.65 3.54 -1.08 -1.26 -4.42 116.67 122.11 1tei s ASP 80 Ca -0.08 -1.22 0.41 0.00 -0.52 0.00 0.00 52.55 51.15 1tei s ASP 80 Cb -0.09 -2.37 2.25 0.00 -1.46 0.00 0.00 42.92 41.25 1tei s ASP 80 CO -0.14 -1.30 2.26 -0.07 0.52 0.00 0.00 175.17 176.45 1tei h LEU 81 N 10.76 0.00 -1.87 -1.34 3.38 -1.98 -1.83 115.31 122.44 1tei h LEU 81 Ca -0.27 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1tei h LEU 81 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1tei h LEU 81 CO 1.15 0.00 -0.13 0.44 0.09 0.00 0.00 178.44 179.99 1tei h ASP 82 N 0.00 0.00 -0.03 -0.43 3.32 -1.91 -1.17 116.42 116.21 1tei h ASP 82 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1tei h ASP 82 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1tei h ASP 82 CO 0.00 0.13 -0.05 0.59 -1.72 0.00 0.00 179.24 178.19 1tei n ASN 83 N -3.69 2.85 -0.02 6.45 3.02 -0.69 -4.57 115.26 118.61 1tei n ASN 83 Ca -0.02 -1.93 -0.03 0.00 -0.03 0.00 0.00 54.58 52.57 1tei n ASN 83 Cb 0.24 0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.44 1tei n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1tei n VAL 84 N 1.18 0.30 -4.25 2.41 0.31 -0.77 -5.07 118.33 112.43 1tei n VAL 84 Ca 0.13 -0.14 -0.26 0.00 -0.01 0.00 0.00 64.34 64.06 1tei n VAL 84 Cb 0.57 -0.75 -0.08 0.00 -0.91 0.00 0.00 33.84 32.67 1tei n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1tei s LEU 85 N -4.98 3.16 0.83 7.52 1.43 -0.51 -4.93 118.68 121.21 1tei s LEU 85 Ca -0.05 -0.50 -0.12 0.00 -1.03 0.00 0.00 54.13 52.43 1tei s LEU 85 Cb 0.02 -1.81 0.09 0.00 0.03 0.00 0.00 46.19 44.52 1tei s LEU 85 CO 0.14 0.08 1.10 -2.16 0.23 0.00 0.00 176.35 175.74 1tei s PRO 86 N -3.00 1.80 0.26 1.29 0.04 -1.26 -4.76 135.00 129.36 1tei s PRO 86 Ca 0.27 0.61 -0.01 0.00 0.04 0.00 0.00 61.00 61.91 1tei s PRO 86 Cb -0.09 -1.89 0.52 0.00 0.04 0.00 0.00 34.50 33.09 1tei s PRO 86 CO 0.17 -1.81 1.77 1.49 0.04 0.00 0.00 177.00 178.66 1tei h GLU 87 N -1.23 0.65 -5.60 4.56 4.81 -1.95 -3.41 114.58 112.42 1tei h GLU 87 Ca -0.48 -0.04 -0.66 0.00 -0.13 0.00 0.00 59.36 58.06 1tei h GLU 87 Cb 1.28 -0.15 -0.21 0.00 0.63 0.00 0.00 28.75 30.30 1tei h GLU 87 CO 0.59 0.43 -0.68 -1.58 -0.73 0.00 0.00 179.01 177.04 1tei s TRP 88 N -5.97 2.98 0.29 0.92 0.52 -1.26 -1.79 118.94 114.63 1tei s TRP 88 Ca -0.12 -0.21 0.05 0.00 0.02 0.00 0.00 56.10 55.84 1tei s TRP 88 Cb 0.21 -1.86 -0.02 0.00 -1.15 0.00 0.00 33.47 30.65 1tei s TRP 88 CO 0.78 0.09 0.28 1.33 0.02 0.00 0.00 176.95 179.45 1tei n VAL 89 N 3.05 0.00 -4.30 4.03 0.24 -0.16 -4.29 118.33 116.89 1tei n VAL 89 Ca -0.18 -2.03 -0.19 0.00 -2.04 0.00 0.00 64.34 59.90 1tei n VAL 89 Cb 0.53 1.04 -0.13 0.00 -1.47 0.00 0.00 33.84 33.81 1tei n VAL 89 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1tei s ARG 90 N -3.10 0.88 0.06 7.34 0.52 0.10 0.25 118.95 125.01 1tei s ARG 90 Ca 0.33 -0.78 0.06 0.00 -0.52 0.00 0.00 55.73 54.82 1tei s ARG 90 Cb 0.01 -0.88 -0.04 0.00 0.52 0.00 0.00 34.95 34.57 1tei s ARG 90 CO 0.24 0.21 -0.12 0.14 0.02 0.00 0.00 175.30 175.79 1tei s VAL 91 N -0.94 3.27 0.20 3.52 -7.23 -1.26 -1.15 120.40 116.82 1tei s VAL 91 Ca 0.00 -1.14 -0.12 0.00 -1.81 0.00 0.00 61.98 58.92 1tei s VAL 91 Cb -0.08 -2.47 0.04 0.00 0.56 0.00 0.00 36.38 34.44 1tei s VAL 91 CO 0.01 0.24 0.60 0.61 -0.31 0.00 0.00 175.10 176.25 1tei n GLY 92 N 1.13 1.10 3.24 2.32 0.00 -0.09 -1.54 105.19 111.35 1tei n GLY 92 Ca -0.15 -1.13 -0.27 0.00 0.00 0.00 0.00 46.02 44.48 1tei n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tei s LEU 93 N 0.00 2.09 0.11 0.99 1.43 -0.32 -0.80 118.68 122.17 1tei s LEU 93 Ca 0.13 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 1tei s LEU 93 Cb -0.03 -1.04 -0.04 0.00 0.03 0.00 0.00 46.19 45.11 1tei s LEU 93 CO 0.06 0.22 -0.08 -0.55 0.23 0.00 0.00 176.35 176.23 1tei s SER 94 N -0.76 1.34 0.07 2.29 0.15 0.49 -1.51 113.70 115.76 1tei s SER 94 Ca 0.08 -0.97 -0.26 0.00 0.70 0.00 0.00 55.95 55.50 1tei s SER 94 Cb -0.08 0.06 0.08 0.00 -1.71 0.00 0.00 66.02 64.36 1tei s SER 94 CO 0.00 -0.40 0.69 0.00 1.20 0.00 0.00 173.24 174.74 1tei s ALA 95 N -3.33 -1.70 0.19 5.45 0.00 -0.79 -0.21 121.76 121.36 1tei s ALA 95 Ca 0.12 0.83 -0.20 0.00 0.00 0.00 0.00 51.96 52.71 1tei s ALA 95 Cb 0.03 0.52 0.04 0.00 0.00 0.00 0.00 23.12 23.72 1tei s ALA 95 CO -0.03 -0.65 0.56 -1.54 0.00 0.00 0.00 175.76 174.10 1tei s SER 96 N -2.28 -0.36 0.10 0.00 1.04 -1.05 -2.30 113.70 108.84 1tei s SER 96 Ca -0.01 -0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.12 1tei s SER 96 Cb -0.01 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 1tei s SER 96 CO -0.07 -1.04 -0.07 0.42 0.98 0.00 0.00 173.24 173.47 1tei s THR 97 N -3.83 0.74 0.00 2.02 -4.23 -0.23 -0.43 115.64 109.68 1tei s THR 97 Ca 0.06 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 1tei s THR 97 Cb -0.01 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.18 1tei s THR 97 CO -0.06 -0.83 0.00 0.61 -0.54 0.00 0.00 174.62 173.80 1tei n GLY 98 N 0.02 2.93 0.15 3.99 0.00 -1.26 -1.51 105.19 109.51 1tei n GLY 98 Ca -0.12 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 1tei n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tei h LEU 99 N 0.00 0.55 -9.73 0.99 5.85 -1.96 0.34 115.31 111.34 1tei h LEU 99 Ca 0.00 -0.46 -0.61 0.00 0.84 0.00 0.00 57.88 57.65 1tei h LEU 99 Cb 0.00 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 40.79 1tei h LEU 99 CO 0.00 1.27 -0.57 -0.31 -0.34 0.00 0.00 178.44 178.49 1tei s TYR 100 N -3.17 3.23 0.42 1.25 2.02 -1.26 -4.91 117.35 114.94 1tei s TYR 100 Ca -0.06 0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.73 1tei s TYR 100 Cb 0.08 -1.60 -0.01 0.00 -0.40 0.00 0.00 41.96 40.03 1tei s TYR 100 CO 0.87 0.53 0.09 0.36 -1.57 0.00 0.00 175.55 175.83 1tei n LYS 101 N 0.12 0.68 -3.63 -0.62 0.00 -1.25 -4.41 118.16 109.06 1tei n LYS 101 Ca -0.08 -3.37 -0.03 0.00 -0.00 0.00 0.00 58.31 54.83 1tei n LYS 101 Cb 0.53 1.48 -0.02 0.00 -0.00 0.00 0.00 35.03 37.02 1tei n LYS 101 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1tei s GLU 102 N -3.57 0.11 0.20 -1.58 -1.05 -1.13 -3.07 118.70 108.61 1tei s GLU 102 Ca 0.13 -0.03 -0.18 0.00 -0.15 0.00 0.00 54.97 54.74 1tei s GLU 102 Cb 0.01 0.05 -0.08 0.00 -0.44 0.00 0.00 34.13 33.67 1tei s GLU 102 CO 0.09 -0.05 0.66 0.95 0.95 0.00 0.00 175.26 177.87 1tei s THR 103 N -2.00 4.67 -0.57 1.83 -4.23 0.98 -4.75 115.64 111.56 1tei s THR 103 Ca 0.11 1.12 0.06 0.00 -1.18 0.00 0.00 61.69 61.79 1tei s THR 103 Cb -0.01 -3.81 0.28 0.00 1.34 0.00 0.00 72.50 70.31 1tei s THR 103 CO -0.04 0.21 0.78 0.59 -0.54 0.00 0.00 174.62 175.62 1tei n ASN 104 N 0.71 3.35 -4.69 3.99 4.13 -1.26 -3.59 115.26 117.90 1tei n ASN 104 Ca -0.03 -3.40 -0.41 0.00 1.68 0.00 0.00 54.58 52.43 1tei n ASN 104 Cb 0.51 -0.63 -0.04 0.00 -1.54 0.00 0.00 39.78 38.08 1tei n ASN 104 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1tei s THR 105 N -2.89 4.97 -0.23 3.41 2.01 -1.11 -2.18 115.64 119.62 1tei s THR 105 Ca 0.42 1.55 -0.06 0.00 0.31 0.00 0.00 61.69 63.91 1tei s THR 105 Cb 0.20 -4.10 -0.02 0.00 0.01 0.00 0.00 72.50 68.59 1tei s THR 105 CO -0.06 0.15 0.04 -0.63 -0.69 0.00 0.00 174.62 173.42 1tei s ILE 106 N 1.40 4.08 -0.15 1.82 -1.09 -0.09 -0.79 121.20 126.38 1tei s ILE 106 Ca 0.39 -0.26 0.22 0.00 -2.23 0.00 0.00 60.65 58.77 1tei s ILE 106 Cb -0.17 -2.89 -0.15 0.00 -1.58 0.00 0.00 42.46 37.67 1tei s ILE 106 CO 0.16 0.37 0.78 0.18 -1.23 0.00 0.00 174.94 175.21 1tei n LEU 107 N 4.75 0.49 -3.51 2.97 4.32 -0.06 -1.73 117.00 124.23 1tei n LEU 107 Ca -0.17 0.19 -0.11 0.00 -0.02 0.00 0.00 56.01 55.90 1tei n LEU 107 Cb 0.51 -0.01 -0.03 0.00 -1.62 0.00 0.00 43.42 42.27 1tei n LEU 107 CO 0.31 -0.07 0.61 -0.94 -1.22 0.00 0.00 177.39 176.08 1tei s SER 108 N -5.06 -0.45 -0.26 -1.43 1.04 -1.24 -4.41 113.70 101.90 1tei s SER 108 Ca -0.04 0.21 -0.18 0.00 0.48 0.00 0.00 55.95 56.43 1tei s SER 108 Cb 0.11 0.43 0.07 0.00 0.10 0.00 0.00 66.02 66.74 1tei s SER 108 CO 0.84 -0.62 0.65 0.86 0.98 0.00 0.00 173.24 175.95 1tei s TRP 109 N -2.46 -0.92 0.04 5.02 -0.00 -0.09 -2.28 118.94 118.25 1tei s TRP 109 Ca 0.00 1.94 0.01 0.00 -0.00 0.00 0.00 56.10 58.05 1tei s TRP 109 Cb -0.01 0.48 -0.02 0.00 -0.00 0.00 0.00 33.47 33.92 1tei s TRP 109 CO -0.04 -0.46 -0.05 -1.54 -0.00 0.00 0.00 176.95 174.87 1tei s SER 110 N 1.22 0.52 -0.13 5.86 1.04 0.38 -0.41 113.70 122.18 1tei s SER 110 Ca -0.07 -0.60 -0.11 0.00 0.48 0.00 0.00 55.95 55.64 1tei s SER 110 Cb -0.05 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.19 1tei s SER 110 CO -0.13 -0.31 0.33 0.12 0.98 0.00 0.00 173.24 174.23 1tei s PHE 111 N -1.85 -0.37 -0.02 5.02 5.36 -0.67 -1.17 117.98 124.28 1tei s PHE 111 Ca -0.10 0.90 0.01 0.00 -0.96 0.00 0.00 56.93 56.78 1tei s PHE 111 Cb -0.07 0.13 0.02 0.00 -0.34 0.00 0.00 43.02 42.75 1tei s PHE 111 CO -0.02 -0.18 -0.02 0.99 -1.46 0.00 0.00 175.22 174.53 1tei s THR 112 N 0.22 0.27 -0.04 0.12 2.01 0.14 -1.89 115.64 116.47 1tei s THR 112 Ca -0.00 -0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.00 1tei s THR 112 Cb -0.03 -0.32 0.01 0.00 0.01 0.00 0.00 72.50 72.18 1tei s THR 112 CO 0.00 0.14 -0.07 -0.55 -0.69 0.00 0.00 174.62 173.45 1tei s SER 113 N 0.71 1.10 -0.02 3.53 0.15 -0.42 -0.66 113.70 118.08 1tei s SER 113 Ca -0.08 -0.17 0.03 0.00 0.70 0.00 0.00 55.95 56.44 1tei s SER 113 Cb -0.11 -0.42 -0.00 0.00 -1.71 0.00 0.00 66.02 63.79 1tei s SER 113 CO -0.01 0.01 -0.10 -0.54 1.20 0.00 0.00 173.24 173.80 1tei s LYS 114 N 0.53 0.96 -0.14 5.44 1.02 0.32 -1.67 119.74 126.19 1tei s LYS 114 Ca -0.08 -0.35 -0.00 0.00 0.02 0.00 0.00 55.97 55.56 1tei s LYS 114 Cb -0.12 -0.90 0.03 0.00 -0.52 0.00 0.00 37.83 36.32 1tei s LYS 114 CO 0.01 0.16 -0.08 -0.51 -0.92 0.00 0.00 175.35 174.01 1tei s LEU 115 N 0.02 1.46 -0.31 3.17 1.43 0.07 -1.38 118.68 123.15 1tei s LEU 115 Ca -0.00 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.54 1tei s LEU 115 Cb -0.07 -0.93 0.02 0.00 0.03 0.00 0.00 46.19 45.24 1tei s LEU 115 CO 0.00 -0.14 0.08 -0.75 0.23 0.00 0.00 176.35 175.78 1tei s LYS 116 N 1.64 2.90 0.72 1.70 2.20 0.87 -0.43 119.74 129.34 1tei s LYS 116 Ca 0.03 -0.98 0.00 0.00 -0.36 0.00 0.00 55.97 54.66 1tei s LYS 116 Cb -0.14 -3.39 0.13 0.00 -1.51 0.00 0.00 37.83 32.93 1tei s LYS 116 CO -0.08 -0.52 0.99 0.45 -0.36 0.00 0.00 175.35 175.82 1tei s SER 117 N 1.46 4.35 -1.06 1.43 0.15 -1.03 0.12 113.70 119.11 1tei s SER 117 Ca 0.01 -0.46 -0.21 0.00 0.70 0.00 0.00 55.95 55.99 1tei s SER 117 Cb -0.18 0.11 -0.08 0.00 -1.71 0.00 0.00 66.02 64.16 1tei s SER 117 CO 0.02 -1.87 1.94 0.59 1.20 0.00 0.00 173.24 175.13 1tei n ASN 118 N -2.81 3.18 -3.54 5.45 4.13 -1.20 -4.67 115.26 115.81 1tei n ASN 118 Ca 0.16 -2.74 -0.09 0.00 1.68 0.00 0.00 54.58 53.59 1tei n ASN 118 Cb 0.61 -1.47 -0.03 0.00 -1.54 0.00 0.00 39.78 37.35 1tei n ASN 118 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1tei s SER 119 N 5.16 -0.34 -0.15 6.41 0.01 -1.26 -5.07 113.70 118.45 1tei s SER 119 Ca 0.59 0.17 -0.29 0.00 1.31 0.00 0.00 55.95 57.74 1tei s SER 119 Cb 0.08 0.33 -0.06 0.00 0.21 0.00 0.00 66.02 66.58 1tei s SER 119 CO 0.09 -0.46 2.15 0.42 0.41 0.00 0.00 173.24 175.85 1tei s THR 120 N -2.20 3.01 0.00 1.44 -4.23 -1.26 -2.61 115.64 109.78 1tei s THR 120 Ca 0.03 0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.54 1tei s THR 120 Cb -0.01 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.82 1tei s THR 120 CO -0.04 -0.00 0.00 1.57 -0.54 0.00 0.00 174.62 175.60 1tei n HIS 121 N 10.53 0.00 -1.94 3.99 -0.00 -1.26 -4.83 115.22 121.71 1tei n HIS 121 Ca 0.27 0.00 -0.24 0.00 -0.00 0.00 0.00 57.72 57.75 1tei n HIS 121 Cb 0.44 -1.47 -0.06 0.00 -0.00 0.00 0.00 29.99 28.90 1tei n HIS 121 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1tei s GLU 122 N -1.02 2.26 -0.09 1.57 2.02 -1.07 -4.88 118.70 117.48 1tei s GLU 122 Ca 0.00 -0.40 0.03 0.00 0.02 0.00 0.00 54.97 54.63 1tei s GLU 122 Cb 0.00 -5.06 -0.01 0.00 0.10 0.00 0.00 34.13 29.16 1tei s GLU 122 CO 0.00 -3.90 -0.20 0.99 0.02 0.00 0.00 175.26 172.17 1tei s THR 123 N 11.72 2.49 -0.10 3.63 2.01 -1.26 -2.46 115.64 131.67 1tei s THR 123 Ca 0.74 -0.89 -0.03 0.00 0.31 0.00 0.00 61.69 61.82 1tei s THR 123 Cb -0.06 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.44 1tei s THR 123 CO 0.06 0.56 0.03 0.20 -0.69 0.00 0.00 174.62 174.77 1tei s ASN 124 N 0.04 5.45 0.09 3.53 -0.87 0.43 -4.94 114.94 118.66 1tei s ASN 124 Ca -0.08 0.19 -0.09 0.00 -1.57 0.00 0.00 52.86 51.31 1tei s ASN 124 Cb -0.15 -1.62 0.00 0.00 -0.02 0.00 0.00 41.25 39.46 1tei s ASN 124 CO 0.05 0.36 0.21 0.00 -2.57 0.00 0.00 177.10 175.15 1tei s ALA 125 N -0.77 -0.31 -0.04 0.60 0.00 -1.26 -0.75 121.76 119.24 1tei s ALA 125 Ca 0.12 -0.53 -0.03 0.00 0.00 0.00 0.00 51.96 51.52 1tei s ALA 125 Cb -0.12 0.48 0.01 0.00 0.00 0.00 0.00 23.12 23.49 1tei s ALA 125 CO 0.02 -0.50 0.10 -1.17 0.00 0.00 0.00 175.76 174.21 1tei s LEU 126 N -2.77 1.61 -0.21 0.00 2.96 -0.67 -5.01 118.68 114.60 1tei s LEU 126 Ca 0.04 0.19 -0.14 0.00 -0.22 0.00 0.00 54.13 54.00 1tei s LEU 126 Cb 0.04 0.33 0.06 0.00 0.50 0.00 0.00 46.19 47.12 1tei s LEU 126 CO -0.10 -0.04 0.52 -2.28 -1.32 0.00 0.00 176.35 173.13 1tei s HIS 127 N 0.08 -0.74 0.02 5.38 5.65 -1.26 -1.30 115.29 123.12 1tei s HIS 127 Ca -0.00 1.57 0.00 0.00 0.25 0.00 0.00 55.06 56.89 1tei s HIS 127 Cb -0.01 0.36 -0.02 0.00 -1.18 0.00 0.00 32.58 31.73 1tei s HIS 127 CO -0.00 -0.38 -0.04 -0.59 -0.65 0.00 0.00 174.74 173.08 1tei s PHE 128 N 1.19 0.32 -0.09 3.88 -0.12 -0.79 -5.01 117.98 117.36 1tei s PHE 128 Ca -0.07 -0.46 -0.04 0.00 -0.05 0.00 0.00 56.93 56.31 1tei s PHE 128 Cb -0.06 -0.22 0.05 0.00 -0.63 0.00 0.00 43.02 42.16 1tei s PHE 128 CO -0.11 -0.15 0.18 1.41 -0.05 0.00 0.00 175.22 176.50 1tei s MET 129 N -1.31 0.08 -0.21 1.99 1.75 -1.26 -1.66 119.30 118.69 1tei s MET 129 Ca -0.13 0.54 -0.00 0.00 -1.25 0.00 0.00 55.69 54.85 1tei s MET 129 Cb -0.09 -0.19 0.02 0.00 2.84 0.00 0.00 34.83 37.41 1tei s MET 129 CO -0.01 -0.25 -0.13 -0.06 -0.65 0.00 0.00 175.02 173.92 1tei s PHE 130 N 1.91 2.90 -1.02 4.11 0.08 0.45 -4.93 117.98 121.48 1tei s PHE 130 Ca -0.02 -1.52 0.10 0.00 0.12 0.00 0.00 56.93 55.62 1tei s PHE 130 Cb -0.12 -1.99 0.02 0.00 -0.57 0.00 0.00 43.02 40.37 1tei s PHE 130 CO -0.07 -0.74 0.68 0.09 -0.10 0.00 0.00 175.22 175.09 1tei n ASN 131 N 4.66 1.38 -3.66 1.36 3.02 -1.26 -0.91 115.26 119.84 1tei n ASN 131 Ca -0.19 -1.19 -0.14 0.00 -0.03 0.00 0.00 54.58 53.03 1tei n ASN 131 Cb 0.49 0.35 -0.08 0.00 -0.61 0.00 0.00 39.78 39.93 1tei n ASN 131 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1tei s GLN 132 N -1.24 0.74 -0.06 3.52 0.74 -1.26 -4.77 119.66 117.34 1tei s GLN 132 Ca 0.09 0.87 0.03 0.00 0.05 0.00 0.00 55.36 56.41 1tei s GLN 132 Cb 0.08 0.36 -0.02 0.00 1.10 0.00 0.00 33.01 34.53 1tei s GLN 132 CO 0.22 -0.09 -0.14 -0.06 -0.55 0.00 0.00 175.29 174.67 1tei s PHE 133 N 0.32 2.72 0.45 1.67 0.08 0.39 -5.04 117.98 118.57 1tei s PHE 133 Ca -0.00 -0.23 0.07 0.00 0.12 0.00 0.00 56.93 56.89 1tei s PHE 133 Cb -0.04 -1.67 0.02 0.00 -0.57 0.00 0.00 43.02 40.76 1tei s PHE 133 CO 0.01 0.13 0.61 -1.54 -0.10 0.00 0.00 175.22 174.33 1tei s SER 134 N -0.56 5.56 0.38 1.36 1.04 -1.26 -4.04 113.70 116.18 1tei s SER 134 Ca 0.08 -0.42 0.08 0.00 0.48 0.00 0.00 55.95 56.17 1tei s SER 134 Cb -0.11 -0.59 0.76 0.00 0.10 0.00 0.00 66.02 66.18 1tei s SER 134 CO 0.01 -0.86 1.94 0.50 0.98 0.00 0.00 173.24 175.81 1tei h LYS 135 N 0.53 0.36 -3.06 4.02 3.64 -1.86 -3.23 116.57 116.97 1tei h LYS 135 Ca -0.39 -0.07 -0.62 0.00 -1.27 0.00 0.00 60.65 58.30 1tei h LYS 135 Cb 1.28 -0.06 -0.42 0.00 -0.41 0.00 0.00 32.23 32.63 1tei h LYS 135 CO 0.45 0.41 -0.56 -3.47 -2.27 0.00 0.00 179.45 174.01 1tei n ASP 136 N -4.32 3.10 -4.48 4.20 2.03 -1.26 -4.75 116.55 111.07 1tei n ASP 136 Ca 0.00 -3.23 -0.44 0.00 0.52 0.00 0.00 54.79 51.65 1tei n ASP 136 Cb 0.22 -0.76 -0.01 0.00 -0.72 0.00 0.00 41.12 39.85 1tei n ASP 136 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1tei s GLN 137 N -1.52 3.91 0.57 -0.67 2.00 -1.23 -4.88 119.66 117.84 1tei s GLN 137 Ca 0.26 -2.21 0.38 0.00 -2.00 0.00 0.00 55.36 51.78 1tei s GLN 137 Cb -0.03 -5.08 2.04 0.00 0.80 0.00 0.00 33.01 30.74 1tei s GLN 137 CO -0.16 -1.84 2.15 0.87 -0.50 0.00 0.00 175.29 175.81 1tei h LYS 138 N 7.83 0.00 -0.38 1.67 1.57 -1.94 -2.03 116.57 123.29 1tei h LYS 138 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1tei h LYS 138 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1tei h LYS 138 CO 1.23 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.71 1tei n ASP 139 N -2.83 2.58 -4.33 0.86 5.68 -1.26 -4.87 116.55 112.38 1tei n ASP 139 Ca -0.03 -1.91 -0.31 0.00 -0.50 0.00 0.00 54.79 52.04 1tei n ASP 139 Cb 0.08 -0.25 -0.16 0.00 -1.14 0.00 0.00 41.12 39.65 1tei n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1tei s LEU 140 N -1.28 2.20 -0.43 -2.12 1.43 -0.76 -0.39 118.68 117.32 1tei s LEU 140 Ca 0.35 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 52.90 1tei s LEU 140 Cb 0.19 -1.39 0.07 0.00 0.03 0.00 0.00 46.19 45.08 1tei s LEU 140 CO 0.26 0.30 0.31 -0.63 0.23 0.00 0.00 176.35 176.82 1tei s ILE 141 N -0.51 4.73 -0.04 -0.59 1.01 0.44 -4.86 121.20 121.38 1tei s ILE 141 Ca 0.07 -1.16 -0.20 0.00 0.00 0.00 0.00 60.65 59.36 1tei s ILE 141 Cb -0.11 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 1tei s ILE 141 CO 0.00 -0.49 0.59 -0.76 0.00 0.00 0.00 174.94 174.28 1tei s LEU 142 N 1.54 4.38 0.20 2.97 1.43 -1.26 -1.24 118.68 126.70 1tei s LEU 142 Ca 0.03 1.10 0.09 0.00 -1.03 0.00 0.00 54.13 54.32 1tei s LEU 142 Cb -0.23 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 1tei s LEU 142 CO 0.05 0.05 -0.18 -1.10 0.23 0.00 0.00 176.35 175.40 1tei s GLN 143 N 0.10 1.38 6.64 1.70 -0.21 -0.20 -4.99 119.66 124.08 1tei s GLN 143 Ca 0.31 -1.52 0.00 0.00 0.02 0.00 0.00 55.36 54.17 1tei s GLN 143 Cb -0.18 -1.42 0.00 0.00 1.00 0.00 0.00 33.01 32.41 1tei s GLN 143 CO 0.16 0.28 0.00 0.41 -2.12 0.00 0.00 175.29 174.02 1tei n GLY 144 N -0.01 3.03 0.43 3.09 0.00 -1.26 -2.01 105.19 108.45 1tei n GLY 144 Ca -0.11 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 45.72 1tei n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tei n ASP 145 N 2.79 1.30 -4.75 1.61 8.00 0.16 -4.93 116.55 120.73 1tei n ASP 145 Ca 0.00 -1.63 -0.41 0.00 0.71 0.00 0.00 54.79 53.46 1tei n ASP 145 Cb 0.00 -0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.00 1tei n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tei s ALA 146 N -1.85 3.70 0.04 2.24 0.00 -1.08 -4.35 121.76 120.47 1tei s ALA 146 Ca 0.32 1.45 -0.06 0.00 0.00 0.00 0.00 51.96 53.68 1tei s ALA 146 Cb 0.17 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1tei s ALA 146 CO 0.26 -0.86 0.10 0.95 0.00 0.00 0.00 175.76 176.20 1tei s THR 147 N 0.08 0.14 0.35 0.00 -4.23 -0.24 -4.72 115.64 107.02 1tei s THR 147 Ca 0.62 -1.15 0.06 0.00 -1.18 0.00 0.00 61.69 60.04 1tei s THR 147 Cb -0.45 -0.99 -0.07 0.00 1.34 0.00 0.00 72.50 72.33 1tei s THR 147 CO 0.45 -0.63 -0.00 0.42 -0.54 0.00 0.00 174.62 174.31 1tei s THR 148 N -2.84 1.71 0.00 3.99 -4.23 -1.26 -0.45 115.64 112.56 1tei s THR 148 Ca -0.03 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 1tei s THR 148 Cb 0.00 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1tei s THR 148 CO -0.06 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 1tei n GLY 149 N -0.78 3.01 3.55 3.99 0.00 -0.92 -4.51 105.19 109.53 1tei n GLY 149 Ca -0.04 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 1tei n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tei s THR 150 N -1.29 3.13 -0.61 2.61 2.01 -1.26 -2.17 115.64 118.07 1tei s THR 150 Ca 0.00 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.04 1tei s THR 150 Cb 0.00 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.17 1tei s THR 150 CO 0.00 -0.33 0.00 0.47 -0.69 0.00 0.00 174.62 174.07 1tei n ASP 151 N 15.25 -4.02 0.00 3.53 8.00 -1.26 -2.63 116.55 135.41 1tei n ASP 151 Ca 0.33 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.98 1tei n ASP 151 Cb 0.52 -2.02 0.00 0.00 -0.02 0.00 0.00 41.12 39.60 1tei n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tei n GLY 152 N -1.84 0.52 3.91 0.44 0.00 -0.92 -4.99 105.19 102.30 1tei n GLY 152 Ca -0.06 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.58 1tei n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1tei s ASN 153 N -2.15 4.97 -0.25 1.61 0.01 -1.08 -0.47 114.94 117.58 1tei s ASN 153 Ca 0.00 -0.87 -0.02 0.00 -0.71 0.00 0.00 52.86 51.25 1tei s ASN 153 Cb 0.00 -0.21 0.02 0.00 0.41 0.00 0.00 41.25 41.47 1tei s ASN 153 CO 0.00 -0.86 -0.05 -0.22 -1.51 0.00 0.00 177.10 174.46 1tei s LEU 154 N -4.24 3.24 -0.46 0.60 2.96 -0.71 -2.16 118.68 117.90 1tei s LEU 154 Ca 0.47 -0.83 -0.15 0.00 -0.22 0.00 0.00 54.13 53.39 1tei s LEU 154 Cb -0.03 -1.69 0.06 0.00 0.50 0.00 0.00 46.19 45.03 1tei s LEU 154 CO 0.28 -0.13 0.38 -1.61 -1.32 0.00 0.00 176.35 173.94 1tei s GLU 155 N 1.35 2.98 0.15 1.98 0.41 0.40 -0.91 118.70 125.05 1tei s GLU 155 Ca 0.01 -1.27 -0.13 0.00 -0.41 0.00 0.00 54.97 53.17 1tei s GLU 155 Cb -0.17 -4.10 0.01 0.00 -1.78 0.00 0.00 34.13 28.10 1tei s GLU 155 CO -0.04 -0.97 1.59 -0.07 -0.49 0.00 0.00 175.26 175.29 1tei h LEU 156 N 8.73 0.84 -9.50 1.80 3.38 -1.69 -0.61 115.31 118.25 1tei h LEU 156 Ca -0.28 -0.31 -0.57 0.00 0.09 0.00 0.00 57.88 56.81 1tei h LEU 156 Cb 1.11 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 41.53 1tei h LEU 156 CO 0.85 0.95 -0.66 0.42 0.09 0.00 0.00 178.44 180.08 1tei s THR 157 N -4.99 3.14 0.22 0.22 -4.23 -1.26 -2.64 115.64 106.09 1tei s THR 157 Ca -0.12 -2.01 -0.32 0.00 -1.18 0.00 0.00 61.69 58.06 1tei s THR 157 Cb 0.11 -2.74 -0.13 0.00 1.34 0.00 0.00 72.50 71.08 1tei s THR 157 CO 0.82 -0.35 1.49 -1.14 -0.54 0.00 0.00 174.62 174.90 1tei n ARG 158 N -0.86 2.15 -3.97 3.99 3.00 -1.26 -4.77 116.66 114.94 1tei n ARG 158 Ca -0.06 0.77 -0.16 0.00 -0.00 0.00 0.00 57.85 58.41 1tei n ARG 158 Cb 0.60 -2.48 -0.15 0.00 0.00 0.00 0.00 32.46 30.43 1tei n ARG 158 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1tei s VAL 159 N 0.28 0.20 0.71 5.15 1.01 -1.26 -1.74 120.40 124.75 1tei s VAL 159 Ca 0.71 -0.01 -0.11 0.00 0.00 0.00 0.00 61.98 62.57 1tei s VAL 159 Cb -0.64 -0.23 0.02 0.00 0.00 0.00 0.00 36.38 35.52 1tei s VAL 159 CO 0.45 0.11 1.08 -0.94 0.00 0.00 0.00 175.10 175.80 1tei s SER 160 N 0.51 5.33 0.30 3.32 1.04 0.09 -4.92 113.70 119.36 1tei s SER 160 Ca -0.05 1.33 0.06 0.00 0.48 0.00 0.00 55.95 57.77 1tei s SER 160 Cb -0.08 -2.17 0.79 0.00 0.10 0.00 0.00 66.02 64.66 1tei s SER 160 CO -0.01 -1.44 1.72 0.77 0.98 0.00 0.00 173.24 175.25 1tei h SER 161 N -0.72 0.50 0.00 7.02 4.64 -2.02 0.29 113.55 123.26 1tei h SER 161 Ca -0.45 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1tei h SER 161 Cb 1.24 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1tei h SER 161 CO 0.61 0.06 0.00 -0.46 -0.87 0.00 0.00 176.83 176.17 1tei n ASN 162 N -4.96 0.00 0.00 4.97 0.23 -1.26 -4.90 115.26 109.33 1tei n ASN 162 Ca 0.24 -1.64 0.00 0.00 -0.53 0.00 0.00 54.58 52.65 1tei n ASN 162 Cb 0.69 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.39 1tei n ASN 162 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1tei n GLY 163 N 0.60 0.71 3.78 4.83 0.00 0.10 -5.08 105.19 110.13 1tei n GLY 163 Ca 0.07 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1tei n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1tei s SER 164 N -2.15 5.66 0.36 1.61 1.04 -1.25 -4.85 113.70 114.12 1tei s SER 164 Ca 0.00 0.13 -0.26 0.00 0.48 0.00 0.00 55.95 56.30 1tei s SER 164 Cb 0.00 -1.61 -0.09 0.00 0.10 0.00 0.00 66.02 64.42 1tei s SER 164 CO 0.00 0.26 1.05 -2.16 0.98 0.00 0.00 173.24 173.37 1tei s PRO 165 N -1.81 4.33 0.07 4.02 0.04 -1.26 -0.73 135.00 139.66 1tei s PRO 165 Ca 0.24 1.56 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1tei s PRO 165 Cb -0.12 -2.73 -0.04 0.00 0.04 0.00 0.00 34.50 31.65 1tei s PRO 165 CO 0.15 0.00 0.17 -0.65 0.04 0.00 0.00 177.00 176.71 1tei s GLN 166 N -2.18 3.28 0.69 4.56 -1.52 -0.71 -4.81 119.66 118.97 1tei s GLN 166 Ca 0.54 -0.52 -0.08 0.00 -1.95 0.00 0.00 55.36 53.34 1tei s GLN 166 Cb -0.24 -2.95 0.04 0.00 -0.22 0.00 0.00 33.01 29.64 1tei s GLN 166 CO 0.30 0.60 1.03 0.20 -0.25 0.00 0.00 175.29 177.17 1tei s GLY 167 N -2.49 1.63 -1.35 3.09 0.00 -1.26 -4.36 107.32 102.58 1tei s GLY 167 Ca 0.33 -0.68 -0.00 0.00 0.00 0.00 0.00 44.72 44.38 1tei s GLY 167 CO 0.26 -0.30 0.57 1.44 0.00 0.00 0.00 173.10 175.07 1tei n SER 168 N -2.91 -0.75 -4.29 1.64 7.64 0.11 -4.86 113.62 110.20 1tei n SER 168 Ca 0.07 -0.91 -0.25 0.00 1.01 0.00 0.00 58.87 58.79 1tei n SER 168 Cb 0.59 -3.60 -0.13 0.00 -1.01 0.00 0.00 64.21 60.06 1tei n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1tei s SER 169 N -4.37 2.62 -0.04 6.43 0.15 -1.19 -4.93 113.70 112.37 1tei s SER 169 Ca 0.00 -0.66 -0.05 0.00 0.70 0.00 0.00 55.95 55.94 1tei s SER 169 Cb -0.00 -0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.16 1tei s SER 169 CO 0.85 0.09 0.12 0.68 1.20 0.00 0.00 173.24 176.18 1tei s VAL 170 N -1.08 0.02 -0.04 4.45 -7.23 -1.26 -1.07 120.40 114.19 1tei s VAL 170 Ca 0.08 -0.15 -0.28 0.00 -1.81 0.00 0.00 61.98 59.82 1tei s VAL 170 Cb -0.10 -0.23 0.06 0.00 0.56 0.00 0.00 36.38 36.67 1tei s VAL 170 CO 0.04 -0.08 0.61 -0.83 -0.31 0.00 0.00 175.10 174.53 1tei s GLY 171 N -0.23 -0.50 0.07 2.32 0.00 -0.98 0.35 107.32 108.36 1tei s GLY 171 Ca -0.03 1.13 -0.06 0.00 0.00 0.00 0.00 44.72 45.76 1tei s GLY 171 CO 0.00 0.80 0.11 0.50 0.00 0.00 0.00 173.10 174.52 1tei s ARG 172 N -1.24 0.75 -0.13 2.90 0.52 -0.85 -1.89 118.95 119.01 1tei s ARG 172 Ca -0.11 -1.03 -0.04 0.00 -0.52 0.00 0.00 55.73 54.03 1tei s ARG 172 Cb -0.01 0.29 0.06 0.00 0.52 0.00 0.00 34.95 35.82 1tei s ARG 172 CO 0.09 -0.21 0.20 0.00 0.02 0.00 0.00 175.30 175.40 1tei s ALA 173 N -3.80 -0.28 0.06 2.13 0.00 -0.57 -1.03 121.76 118.27 1tei s ALA 173 Ca 0.05 0.57 0.07 0.00 0.00 0.00 0.00 51.96 52.65 1tei s ALA 173 Cb 0.06 -0.99 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 1tei s ALA 173 CO -0.10 -0.75 -0.15 -0.51 0.00 0.00 0.00 175.76 174.24 1tei s LEU 174 N 2.33 2.78 0.21 0.00 1.02 -0.37 -1.18 118.68 123.47 1tei s LEU 174 Ca 0.03 -0.41 -0.30 0.00 0.02 0.00 0.00 54.13 53.47 1tei s LEU 174 Cb -0.13 -1.62 -0.09 0.00 0.02 0.00 0.00 46.19 44.37 1tei s LEU 174 CO -0.08 0.23 1.27 0.12 0.02 0.00 0.00 176.35 177.91 1tei s PHE 175 N -1.03 3.30 0.22 0.29 5.36 -0.59 -0.42 117.98 125.11 1tei s PHE 175 Ca 0.17 1.32 -0.09 0.00 -0.96 0.00 0.00 56.93 57.37 1tei s PHE 175 Cb -0.11 -3.55 0.32 0.00 -0.34 0.00 0.00 43.02 39.35 1tei s PHE 175 CO 0.08 -1.63 1.72 -0.92 -1.46 0.00 0.00 175.22 173.01 1tei h TYR 176 N 5.07 0.30 -3.67 10.12 3.20 -1.05 -3.43 116.97 127.50 1tei h TYR 176 Ca -0.45 0.03 -0.50 0.00 3.14 0.00 0.00 58.73 60.95 1tei h TYR 176 Cb 1.22 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.42 1tei h TYR 176 CO 0.61 0.01 0.25 0.00 -1.64 0.00 0.00 178.16 177.39 1tei s ALA 177 N -6.09 3.36 0.47 1.82 0.00 -1.26 -5.03 121.76 115.03 1tei s ALA 177 Ca -0.13 0.43 -0.23 0.00 0.00 0.00 0.00 51.96 52.03 1tei s ALA 177 Cb 0.18 -3.05 -0.07 0.00 0.00 0.00 0.00 23.12 20.18 1tei s ALA 177 CO 0.74 0.25 1.19 -2.14 0.00 0.00 0.00 175.76 175.81 1tei s PRO 178 N -1.51 3.69 -0.11 0.00 0.02 -1.26 -4.81 135.00 131.02 1tei s PRO 178 Ca 0.42 1.85 -0.01 0.00 0.02 0.00 0.00 61.00 63.28 1tei s PRO 178 Cb -0.22 -2.40 -0.02 0.00 0.02 0.00 0.00 34.50 31.87 1tei s PRO 178 CO 0.26 -0.63 -0.08 0.08 -0.33 0.00 0.00 177.00 176.30 1tei s VAL 179 N -1.50 3.53 -0.93 3.83 1.01 0.14 -4.93 120.40 121.54 1tei s VAL 179 Ca 0.64 -0.51 -0.19 0.00 0.00 0.00 0.00 61.98 61.91 1tei s VAL 179 Cb -0.30 -2.48 0.12 0.00 0.00 0.00 0.00 36.38 33.71 1tei s VAL 179 CO 0.37 0.55 1.16 -2.28 0.00 0.00 0.00 175.10 174.90 1tei s HIS 180 N -0.13 3.02 0.35 5.22 2.46 -1.26 -0.99 115.29 123.96 1tei s HIS 180 Ca 0.01 -1.28 0.10 0.00 0.47 0.00 0.00 55.06 54.36 1tei s HIS 180 Cb -0.13 -4.34 0.66 0.00 -0.13 0.00 0.00 32.58 28.64 1tei s HIS 180 CO 0.03 -1.56 1.81 0.97 -2.47 0.00 0.00 174.74 173.53 1tei h ILE 181 N 5.97 1.26 -3.26 0.89 6.09 -1.67 -3.47 117.51 123.32 1tei h ILE 181 Ca 0.15 -1.22 -0.01 0.00 -1.37 0.00 0.00 64.86 62.40 1tei h ILE 181 Cb 1.02 1.57 -0.10 0.00 0.47 0.00 0.00 36.82 39.78 1tei h ILE 181 CO 1.15 0.36 0.06 -1.66 -3.07 0.00 0.00 178.15 174.99 1tei s TRP 182 N -4.31 -0.15 -0.22 2.19 1.48 -1.23 -4.77 118.94 111.93 1tei s TRP 182 Ca -0.04 -0.19 -0.19 0.00 -1.06 0.00 0.00 56.10 54.62 1tei s TRP 182 Cb 0.14 0.43 0.06 0.00 -1.16 0.00 0.00 33.47 32.94 1tei s TRP 182 CO 0.74 -0.94 0.58 -2.00 -4.06 0.00 0.00 176.95 171.27 1tei s GLU 183 N -3.87 0.66 0.54 3.25 2.12 -1.26 -4.77 118.70 115.37 1tei s GLU 183 Ca 0.09 0.83 0.24 0.00 0.36 0.00 0.00 54.97 56.49 1tei s GLU 183 Cb -0.01 0.30 1.41 0.00 0.26 0.00 0.00 34.13 36.08 1tei s GLU 183 CO -0.03 -0.09 2.03 0.66 -0.54 0.00 0.00 175.26 177.29 1tei h SER 184 N 5.44 0.00 -0.45 -1.70 4.64 -2.01 -2.24 113.55 117.22 1tei h SER 184 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1tei h SER 184 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1tei h SER 184 CO 0.15 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.91 1tei n SER 185 N -4.32 3.94 -4.67 4.97 7.64 -1.26 -4.93 113.62 114.98 1tei n SER 185 Ca 0.07 -2.46 -0.39 0.00 1.01 0.00 0.00 58.87 57.10 1tei n SER 185 Cb 0.49 -0.55 -0.07 0.00 -1.01 0.00 0.00 64.21 63.07 1tei n SER 185 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tei s ALA 186 N -1.96 3.54 0.10 -0.43 0.00 -0.84 -3.20 121.76 118.96 1tei s ALA 186 Ca 0.38 -0.40 -0.15 0.00 0.00 0.00 0.00 51.96 51.79 1tei s ALA 186 Cb 0.26 -2.75 -0.08 0.00 0.00 0.00 0.00 23.12 20.56 1tei s ALA 186 CO 0.16 -0.35 1.43 0.28 0.00 0.00 0.00 175.76 177.28 1tei h VAL 187 N 5.05 1.30 -3.35 0.00 2.07 0.62 -3.45 116.25 118.48 1tei h VAL 187 Ca -0.35 -1.42 -0.21 0.00 0.82 0.00 0.00 66.70 65.53 1tei h VAL 187 Cb 1.16 1.55 -0.29 0.00 -1.52 0.00 0.00 31.29 32.20 1tei h VAL 187 CO 0.74 0.46 -0.58 -0.69 0.02 0.00 0.00 177.57 177.51 1tei s VAL 188 N -4.40 -0.02 -0.02 2.57 1.01 -1.13 -4.86 120.40 113.54 1tei s VAL 188 Ca -0.12 0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.95 1tei s VAL 188 Cb 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.26 1tei s VAL 188 CO 0.83 0.03 -0.08 0.00 0.00 0.00 0.00 175.10 175.87 1tei s ALA 189 N 0.50 0.79 0.04 5.51 0.00 -1.26 -0.09 121.76 127.24 1tei s ALA 189 Ca -0.04 -0.31 -0.27 0.00 0.00 0.00 0.00 51.96 51.35 1tei s ALA 189 Cb -0.05 -0.29 0.08 0.00 0.00 0.00 0.00 23.12 22.86 1tei s ALA 189 CO -0.02 0.13 0.71 -1.54 0.00 0.00 0.00 175.76 175.04 1tei s SER 190 N 0.17 -0.54 0.13 0.00 1.04 -0.48 0.30 113.70 114.31 1tei s SER 190 Ca -0.02 0.25 -0.07 0.00 0.48 0.00 0.00 55.95 56.58 1tei s SER 190 Cb -0.08 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 1tei s SER 190 CO 0.00 -0.74 0.21 0.72 0.98 0.00 0.00 173.24 174.41 1tei s PHE 191 N -2.63 0.38 -0.17 5.02 -0.12 -0.84 -0.53 117.98 119.09 1tei s PHE 191 Ca -0.02 -0.77 -0.14 0.00 -0.05 0.00 0.00 56.93 55.95 1tei s PHE 191 Cb -0.01 -0.13 0.05 0.00 -0.63 0.00 0.00 43.02 42.31 1tei s PHE 191 CO -0.04 -0.62 0.45 -2.00 -0.05 0.00 0.00 175.22 172.96 1tei s GLU 192 N -3.94 0.49 0.07 1.99 2.12 0.16 -2.06 118.70 117.53 1tei s GLU 192 Ca 0.13 0.70 0.04 0.00 0.36 0.00 0.00 54.97 56.20 1tei s GLU 192 Cb 0.05 0.16 -0.03 0.00 0.26 0.00 0.00 34.13 34.57 1tei s GLU 192 CO -0.04 -0.10 -0.12 0.00 -0.54 0.00 0.00 175.26 174.46 1tei s ALA 193 N 0.66 1.04 -0.11 6.30 0.00 0.05 -0.68 121.76 129.01 1tei s ALA 193 Ca -0.03 -0.97 -0.12 0.00 0.00 0.00 0.00 51.96 50.84 1tei s ALA 193 Cb -0.05 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.05 1tei s ALA 193 CO -0.04 0.11 0.33 0.99 0.00 0.00 0.00 175.76 177.14 1tei s THR 194 N -1.41 0.01 -0.09 0.00 2.01 -0.32 -0.64 115.64 115.19 1tei s THR 194 Ca -0.03 -0.05 -0.28 0.00 0.31 0.00 0.00 61.69 61.64 1tei s THR 194 Cb -0.09 -0.49 0.06 0.00 0.01 0.00 0.00 72.50 71.99 1tei s THR 194 CO 0.02 -0.03 0.64 0.72 -0.69 0.00 0.00 174.62 175.28 1tei s PHE 195 N 0.02 -0.63 -0.08 4.92 -0.12 -0.61 -0.47 117.98 121.02 1tei s PHE 195 Ca -0.01 1.20 0.01 0.00 -0.05 0.00 0.00 56.93 58.08 1tei s PHE 195 Cb -0.03 0.34 -0.03 0.00 -0.63 0.00 0.00 43.02 42.68 1tei s PHE 195 CO 0.01 -0.53 -0.10 0.95 -0.05 0.00 0.00 175.22 175.50 1tei s THR 196 N -0.84 3.40 0.29 -4.49 -4.23 -0.97 -0.65 115.64 108.16 1tei s THR 196 Ca -0.09 -0.58 0.03 0.00 -1.18 0.00 0.00 61.69 59.87 1tei s THR 196 Cb -0.02 -2.38 -0.06 0.00 1.34 0.00 0.00 72.50 71.38 1tei s THR 196 CO 0.07 0.58 0.07 0.72 -0.54 0.00 0.00 174.62 175.52 1tei s PHE 197 N -0.53 1.74 -0.23 3.99 -0.71 -0.63 -0.88 117.98 120.73 1tei s PHE 197 Ca 0.07 -1.06 -0.04 0.00 -1.04 0.00 0.00 56.93 54.87 1tei s PHE 197 Cb -0.12 -1.08 0.09 0.00 -1.21 0.00 0.00 43.02 40.71 1tei s PHE 197 CO 0.02 -0.15 0.17 -1.17 -1.34 0.00 0.00 175.22 172.75 1tei s LEU 198 N -3.39 0.17 -0.36 -1.99 2.96 0.03 -0.89 118.68 115.20 1tei s LEU 198 Ca 0.37 -0.71 -0.12 0.00 -0.22 0.00 0.00 54.13 53.45 1tei s LEU 198 Cb 0.08 0.04 0.01 0.00 0.50 0.00 0.00 46.19 46.81 1tei s LEU 198 CO 0.14 -0.37 0.22 -0.63 -1.32 0.00 0.00 176.35 174.38 1tei s ILE 199 N 2.22 4.88 -0.09 6.68 1.01 -1.26 -2.73 121.20 131.91 1tei s ILE 199 Ca 0.07 -0.55 0.04 0.00 0.00 0.00 0.00 60.65 60.20 1tei s ILE 199 Cb -0.16 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.71 1tei s ILE 199 CO -0.22 -0.12 -0.22 -0.75 0.00 0.00 0.00 174.94 173.64 1tei s LYS 200 N 1.63 2.80 -0.03 2.79 2.20 -1.24 -0.58 119.74 127.32 1tei s LYS 200 Ca 0.04 -0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 54.83 1tei s LYS 200 Cb -0.18 -2.15 0.03 0.00 -1.51 0.00 0.00 37.83 34.02 1tei s LYS 200 CO 0.08 0.18 0.05 0.45 -0.36 0.00 0.00 175.35 175.75 1tei s SER 201 N 0.33 0.05 0.22 1.43 0.15 -1.26 -0.02 113.70 114.61 1tei s SER 201 Ca -0.17 0.09 0.12 0.00 0.70 0.00 0.00 55.95 56.70 1tei s SER 201 Cb -0.17 -0.02 -0.01 0.00 -1.71 0.00 0.00 66.02 64.11 1tei s SER 201 CO 0.08 -0.14 1.40 -0.65 1.20 0.00 0.00 173.24 175.13 1tei h PRO 202 N 7.31 0.00 -6.95 5.44 0.11 -1.98 -3.47 132.00 132.46 1tei h PRO 202 Ca -0.45 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.18 1tei h PRO 202 Cb 1.12 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.27 1tei h PRO 202 CO 0.46 0.69 0.09 0.16 -0.21 0.00 0.00 178.00 179.19 1tei s ASP 203 N -6.56 5.97 0.12 -2.05 -4.77 -1.26 -5.03 116.67 103.09 1tei s ASP 203 Ca 0.03 0.74 -0.22 0.00 -3.30 0.00 0.00 52.55 49.80 1tei s ASP 203 Cb 0.09 -1.95 -0.04 0.00 -1.09 0.00 0.00 42.92 39.93 1tei s ASP 203 CO 0.77 -0.75 1.12 -1.54 0.70 0.00 0.00 175.17 175.47 1tei n SER 204 N -2.33 -0.75 -3.98 2.11 3.41 -1.26 -4.22 113.62 106.59 1tei n SER 204 Ca 0.02 1.30 -0.30 0.00 -0.26 0.00 0.00 58.87 59.62 1tei n SER 204 Cb 0.56 -0.18 -0.16 0.00 -0.26 0.00 0.00 64.21 64.18 1tei n SER 204 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1tei s HIS 205 N -5.39 2.29 0.73 7.33 3.76 -1.26 -5.14 115.29 117.62 1tei s HIS 205 Ca -0.09 -1.48 -0.11 0.00 -0.15 0.00 0.00 55.06 53.23 1tei s HIS 205 Cb 0.09 -1.59 0.03 0.00 1.11 0.00 0.00 32.58 32.22 1tei s HIS 205 CO 0.46 -0.72 1.07 -2.14 -0.85 0.00 0.00 174.74 172.56 1tei s PRO 206 N 1.44 2.63 -0.10 8.40 0.02 -1.26 -4.63 135.00 141.50 1tei s PRO 206 Ca -0.00 1.00 -0.30 0.00 0.02 0.00 0.00 61.00 61.72 1tei s PRO 206 Cb -0.16 -1.95 0.11 0.00 0.02 0.00 0.00 34.50 32.52 1tei s PRO 206 CO -0.08 -1.33 0.92 0.00 -0.33 0.00 0.00 177.00 176.18 1tei s ALA 207 N -3.00 -1.88 -0.08 -1.55 0.00 -1.17 -3.89 121.76 110.17 1tei s ALA 207 Ca 0.59 1.37 0.11 0.00 0.00 0.00 0.00 51.96 54.03 1tei s ALA 207 Cb -0.15 -0.27 -0.16 0.00 0.00 0.00 0.00 23.12 22.55 1tei s ALA 207 CO 0.55 -0.44 0.11 -0.25 0.00 0.00 0.00 175.76 175.73 1tei n ASP 208 N 0.44 2.19 0.00 0.00 9.92 0.43 -2.83 116.55 126.71 1tei n ASP 208 Ca -0.11 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.15 1tei n ASP 208 Cb 0.59 1.01 0.00 0.00 -0.64 0.00 0.00 41.12 42.08 1tei n ASP 208 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1tei n GLY 209 N 2.15 1.64 3.31 0.44 0.00 -1.20 -1.98 105.19 109.54 1tei n GLY 209 Ca -0.14 -1.59 -0.21 0.00 0.00 0.00 0.00 46.02 44.09 1tei n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tei s ILE 210 N -1.72 1.68 -0.13 -0.61 1.01 -0.87 -2.54 121.20 118.02 1tei s ILE 210 Ca 0.00 -1.85 -0.15 0.00 0.00 0.00 0.00 60.65 58.65 1tei s ILE 210 Cb 0.00 -1.75 0.04 0.00 0.01 0.00 0.00 42.46 40.76 1tei s ILE 210 CO 0.00 -0.33 0.40 0.00 0.00 0.00 0.00 174.94 175.01 1tei s ALA 211 N -2.04 -0.99 -0.14 9.38 0.00 0.71 -0.14 121.76 128.53 1tei s ALA 211 Ca 0.14 1.04 -0.09 0.00 0.00 0.00 0.00 51.96 53.04 1tei s ALA 211 Cb -0.06 -0.55 -0.05 0.00 0.00 0.00 0.00 23.12 22.47 1tei s ALA 211 CO 0.05 -0.21 0.17 0.12 0.00 0.00 0.00 175.76 175.90 1tei s PHE 212 N -0.03 3.53 0.14 0.00 5.36 -0.31 -0.37 117.98 126.30 1tei s PHE 212 Ca -0.02 0.50 -0.04 0.00 -0.96 0.00 0.00 56.93 56.41 1tei s PHE 212 Cb -0.03 -2.08 -0.03 0.00 -0.34 0.00 0.00 43.02 40.55 1tei s PHE 212 CO 0.01 0.53 0.14 -0.59 -1.46 0.00 0.00 175.22 173.86 1tei s PHE 213 N -0.42 0.68 -0.03 10.12 -0.12 0.02 -0.82 117.98 127.40 1tei s PHE 213 Ca 0.13 -1.05 0.03 0.00 -0.05 0.00 0.00 56.93 55.99 1tei s PHE 213 Cb -0.12 -0.31 0.00 0.00 -0.63 0.00 0.00 43.02 41.96 1tei s PHE 213 CO 0.03 -0.60 -0.11 0.42 -0.05 0.00 0.00 175.22 174.91 1tei s ILE 214 N -4.02 0.94 0.37 -4.49 1.01 -0.31 -0.91 121.20 113.79 1tei s ILE 214 Ca 0.21 -0.44 -0.05 0.00 0.00 0.00 0.00 60.65 60.38 1tei s ILE 214 Cb 0.06 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.71 1tei s ILE 214 CO 0.01 0.29 0.56 -0.94 0.00 0.00 0.00 174.94 174.86 1tei s SER 215 N 0.20 0.83 0.49 3.58 1.04 -0.30 -2.44 113.70 117.10 1tei s SER 215 Ca -0.04 -1.47 -0.22 0.00 0.48 0.00 0.00 55.95 54.69 1tei s SER 215 Cb -0.10 0.73 -0.07 0.00 0.10 0.00 0.00 66.02 66.68 1tei s SER 215 CO 0.01 -1.43 1.22 0.54 0.98 0.00 0.00 173.24 174.56 1tei s ASN 216 N -3.22 5.89 0.28 7.02 4.22 -1.23 -0.72 114.94 127.18 1tei s ASN 216 Ca 0.28 2.44 -0.01 0.00 -2.14 0.00 0.00 52.86 53.42 1tei s ASN 216 Cb -0.02 -2.61 0.63 0.00 1.28 0.00 0.00 41.25 40.54 1tei s ASN 216 CO 0.20 -1.12 1.61 0.40 -2.04 0.00 0.00 177.10 176.15 1tei h ILE 217 N 1.73 0.20 -0.18 0.54 2.04 -1.85 -2.30 117.51 117.69 1tei h ILE 217 Ca -0.50 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1tei h ILE 217 Cb 1.26 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1tei h ILE 217 CO 0.59 0.02 0.00 -0.90 0.00 0.00 0.00 178.15 177.86 1tei n ASP 218 N -5.38 1.60 -4.67 1.72 5.75 -1.26 -4.86 116.55 109.46 1tei n ASP 218 Ca 0.19 -2.11 -0.38 0.00 -0.01 0.00 0.00 54.79 52.48 1tei n ASP 218 Cb 0.64 -0.32 0.06 0.00 -1.03 0.00 0.00 41.12 40.47 1tei n ASP 218 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1tei n SER 219 N 0.11 1.46 -3.77 -1.12 2.88 -0.87 -5.03 113.62 107.28 1tei n SER 219 Ca 0.07 0.84 -0.10 0.00 -1.33 0.00 0.00 58.87 58.35 1tei n SER 219 Cb 0.32 -1.47 -0.06 0.00 -0.75 0.00 0.00 64.21 62.26 1tei n SER 219 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1tei s SER 220 N -1.24 -0.09 0.06 -3.46 1.04 -1.26 -5.09 113.70 103.66 1tei s SER 220 Ca 0.77 -0.53 -0.30 0.00 0.48 0.00 0.00 55.95 56.37 1tei s SER 220 Cb -0.41 0.45 -0.09 0.00 0.10 0.00 0.00 66.02 66.07 1tei s SER 220 CO 0.45 -0.86 1.89 -0.63 0.98 0.00 0.00 173.24 175.08 1tei s ILE 221 N -3.86 2.93 0.50 -1.02 1.01 -1.26 -4.97 121.20 114.53 1tei s ILE 221 Ca 0.07 0.10 -0.21 0.00 0.00 0.00 0.00 60.65 60.61 1tei s ILE 221 Cb 0.03 -3.07 -0.06 0.00 0.01 0.00 0.00 42.46 39.37 1tei s ILE 221 CO -0.08 -0.01 1.17 -2.84 0.00 0.00 0.00 174.94 173.18 1tei s PRO 222 N 3.88 3.53 0.34 2.79 0.02 -1.26 -4.97 135.00 139.33 1tei s PRO 222 Ca 0.85 1.76 -0.28 0.00 0.02 0.00 0.00 61.00 63.35 1tei s PRO 222 Cb -0.43 -2.24 -0.10 0.00 0.02 0.00 0.00 34.50 31.76 1tei s PRO 222 CO 0.39 -0.74 1.28 -1.12 -0.33 0.00 0.00 177.00 176.48 1tei s SER 223 N -1.48 6.72 -0.28 2.53 0.01 -1.26 -2.56 113.70 117.38 1tei s SER 223 Ca 0.68 2.63 0.00 0.00 1.31 0.00 0.00 55.95 60.57 1tei s SER 223 Cb -0.28 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.31 1tei s SER 223 CO 0.33 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 174.03 1tei n GLY 224 N 0.80 0.55 0.67 3.44 0.00 -1.26 -4.90 105.19 104.49 1tei n GLY 224 Ca 0.01 -0.26 0.01 0.00 0.00 0.00 0.00 46.02 45.77 1tei n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tei n SER 225 N 0.09 1.59 -2.19 1.61 3.41 -1.06 -4.84 113.62 112.23 1tei n SER 225 Ca -0.03 -2.12 -0.00 0.00 -0.26 0.00 0.00 58.87 56.46 1tei n SER 225 Cb 0.20 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 1tei n SER 225 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1tei n THR 226 N 0.08 0.00 -3.82 6.66 -2.24 -1.26 -0.16 114.28 113.53 1tei n THR 226 Ca 0.04 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1tei n THR 226 Cb 0.37 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 66.93 1tei n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tei n GLY 227 N 4.06 0.93 0.39 3.38 0.00 -0.57 -2.65 105.19 110.73 1tei n GLY 227 Ca 0.00 -0.70 0.10 0.00 0.00 0.00 0.00 46.02 45.43 1tei n GLY 227 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1tei h ARG 228 N 0.00 0.00 0.00 1.61 0.11 -1.90 0.08 114.38 114.28 1tei h ARG 228 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1tei h ARG 228 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1tei h ARG 228 CO 0.00 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.35 1tei n LEU 229 N -2.81 0.26 -1.36 0.08 4.77 -1.08 -4.91 117.00 111.95 1tei n LEU 229 Ca 0.06 0.55 -0.14 0.00 -0.03 0.00 0.00 56.01 56.45 1tei n LEU 229 Cb 1.03 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 1tei n LEU 229 CO 0.09 -0.25 -0.13 0.18 -1.33 0.00 0.00 177.39 175.95 1tei n LEU 230 N -1.77 -0.97 -0.69 2.23 4.77 0.01 -1.73 117.00 118.86 1tei n LEU 230 Ca 0.04 0.34 -0.09 0.00 -0.03 0.00 0.00 56.01 56.27 1tei n LEU 230 Cb 0.26 -2.09 -0.04 0.00 -2.33 0.00 0.00 43.42 39.22 1tei n LEU 230 CO 0.20 -0.74 -0.09 0.61 -1.33 0.00 0.00 177.39 176.05 1tei n GLY 231 N -0.23 1.05 0.01 -0.72 0.00 0.77 -4.01 105.19 102.06 1tei n GLY 231 Ca -0.14 -0.44 -0.01 0.00 0.00 0.00 0.00 46.02 45.44 1tei n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tei n LEU 232 N -1.03 0.93 -4.53 0.99 4.77 -0.70 -4.49 117.00 112.94 1tei n LEU 232 Ca -0.09 -0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.58 1tei n LEU 232 Cb 0.34 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.32 1tei n LEU 232 CO 0.14 0.18 -0.44 -0.36 -1.33 0.00 0.00 177.39 175.57 1tei s PHE 233 N -2.02 2.71 0.20 -1.77 0.08 -1.12 -4.84 117.98 111.21 1tei s PHE 233 Ca -0.01 -0.16 0.09 0.00 0.12 0.00 0.00 56.93 56.98 1tei s PHE 233 Cb 0.00 -1.51 0.13 0.00 -0.57 0.00 0.00 43.02 41.08 1tei s PHE 233 CO 0.04 0.33 1.48 -1.00 -0.10 0.00 0.00 175.22 175.96 1tei h PRO 234 N 4.37 0.00 -4.19 0.24 0.13 -1.92 -3.42 132.00 127.21 1tei h PRO 234 Ca -0.48 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.39 1tei h PRO 234 Cb 1.16 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.19 1tei h PRO 234 CO 0.51 0.76 -0.27 0.16 -0.23 0.00 0.00 178.00 178.93 1tei s ASP 235 N -6.77 0.73 -0.20 1.44 1.47 -1.26 -4.90 116.67 107.19 1tei s ASP 235 Ca -0.00 -1.41 0.07 0.00 1.18 0.00 0.00 52.55 52.39 1tei s ASP 235 Cb 0.11 0.60 0.51 0.00 -0.34 0.00 0.00 42.92 43.81 1tei s ASP 235 CO 0.78 -1.18 1.40 0.00 0.68 0.00 0.00 175.17 176.85 1tei n ALA 236 N -0.50 3.74 0.59 2.11 0.00 -1.26 -4.74 120.51 120.45 1tei n ALA 236 Ca 0.01 -1.44 0.05 0.00 0.00 0.00 0.00 53.44 52.06 1tei n ALA 236 Cb 0.62 -1.14 0.28 0.00 0.00 0.00 0.00 19.45 19.21 1tei n ALA 236 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79