#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sd3 s ARG 4 N 0.00 3.67 0.58 3.52 1.70 -1.26 -4.97 118.95 122.19 1sd3 s ARG 4 Ca 0.00 0.91 -0.18 0.00 -0.47 0.00 0.00 55.73 55.98 1sd3 s ARG 4 Cb 0.00 -2.09 -0.04 0.00 -0.57 0.00 0.00 34.95 32.25 1sd3 s ARG 4 CO 0.00 -0.51 1.14 -1.54 -1.08 0.00 0.00 175.30 173.31 1sd3 s SER 5 N -3.51 5.49 0.25 -2.89 1.04 -1.26 -4.76 113.70 108.07 1sd3 s SER 5 Ca 0.58 2.18 -0.15 0.00 0.48 0.00 0.00 55.95 59.04 1sd3 s SER 5 Cb -0.11 -2.58 -0.08 0.00 0.10 0.00 0.00 66.02 63.35 1sd3 s SER 5 CO 0.42 -1.38 0.67 -0.76 0.98 0.00 0.00 173.24 173.17 1sd3 s LEU 6 N -4.08 4.19 -0.30 2.42 1.43 0.38 -4.88 118.68 117.84 1sd3 s LEU 6 Ca 0.72 1.22 -0.14 0.00 -1.03 0.00 0.00 54.13 54.90 1sd3 s LEU 6 Cb -0.24 -3.76 -0.03 0.00 0.03 0.00 0.00 46.19 42.18 1sd3 s LEU 6 CO 0.31 -0.08 0.31 -0.63 0.23 0.00 0.00 176.35 176.49 1sd3 s ILE 7 N -1.76 5.22 -0.26 -0.59 -1.09 -1.26 -0.77 121.20 120.69 1sd3 s ILE 7 Ca 0.48 0.24 -0.05 0.00 -2.23 0.00 0.00 60.65 59.08 1sd3 s ILE 7 Cb -0.13 -3.69 -0.00 0.00 -1.58 0.00 0.00 42.46 37.06 1sd3 s ILE 7 CO 0.19 0.10 0.03 -0.69 -1.23 0.00 0.00 174.94 173.34 1sd3 s VAL 8 N 1.94 3.75 0.18 2.92 1.01 0.00 -0.10 120.40 130.09 1sd3 s VAL 8 Ca 0.11 -0.54 -0.12 0.00 0.00 0.00 0.00 61.98 61.43 1sd3 s VAL 8 Cb -0.16 -2.82 -0.07 0.00 0.00 0.00 0.00 36.38 33.33 1sd3 s VAL 8 CO 0.11 0.26 0.54 0.28 0.00 0.00 0.00 175.10 176.28 1sd3 s THR 9 N 1.50 4.91 0.13 3.92 -1.32 0.31 -0.48 115.64 124.61 1sd3 s THR 9 Ca 0.04 0.65 -0.04 0.00 -1.21 0.00 0.00 61.69 61.13 1sd3 s THR 9 Cb -0.16 -3.68 0.02 0.00 -1.51 0.00 0.00 72.50 67.17 1sd3 s THR 9 CO 0.00 0.11 0.24 1.07 -2.21 0.00 0.00 174.62 173.84 1sd3 n THR 10 N 0.41 0.00 -3.83 5.08 5.66 -0.35 -2.03 114.28 119.22 1sd3 n THR 10 Ca -0.03 -0.43 -0.12 0.00 -3.05 0.00 0.00 64.05 60.42 1sd3 n THR 10 Cb 0.52 0.35 -0.10 0.00 -1.55 0.00 0.00 70.33 69.55 1sd3 n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1sd3 s ILE 11 N -2.65 0.06 0.01 1.09 2.07 -1.26 -0.91 121.20 119.60 1sd3 s ILE 11 Ca 0.07 -0.46 -0.30 0.00 -1.41 0.00 0.00 60.65 58.54 1sd3 s ILE 11 Cb -0.01 -0.44 -0.07 0.00 0.13 0.00 0.00 42.46 42.08 1sd3 s ILE 11 CO 0.05 -0.25 1.55 -0.76 -1.91 0.00 0.00 174.94 173.62 1sd3 s LEU 12 N -0.97 4.33 -0.30 8.50 1.43 -1.26 -4.57 118.68 125.84 1sd3 s LEU 12 Ca -0.11 2.28 -0.05 0.00 -1.03 0.00 0.00 54.13 55.22 1sd3 s LEU 12 Cb -0.05 -3.56 0.19 0.00 0.03 0.00 0.00 46.19 42.80 1sd3 s LEU 12 CO 0.02 -0.83 0.78 -0.70 0.23 0.00 0.00 176.35 175.85 1sd3 s GLU 13 N 2.87 0.41 0.27 1.70 2.56 0.00 -4.98 118.70 121.53 1sd3 s GLU 13 Ca 0.70 0.65 -0.29 0.00 0.00 0.00 0.00 54.97 56.02 1sd3 s GLU 13 Cb -0.35 0.35 -0.09 0.00 2.00 0.00 0.00 34.13 36.04 1sd3 s GLU 13 CO 0.29 -0.51 1.15 -2.00 -0.56 0.00 0.00 175.26 173.63 1sd3 s GLU 14 N 2.90 4.57 -0.38 4.30 2.12 -1.25 -0.10 118.70 130.86 1sd3 s GLU 14 Ca 0.13 1.87 0.07 0.00 0.36 0.00 0.00 54.97 57.40 1sd3 s GLU 14 Cb -0.12 -3.19 0.65 0.00 0.26 0.00 0.00 34.13 31.73 1sd3 s GLU 14 CO -0.18 0.10 1.78 -0.35 -0.54 0.00 0.00 175.26 176.06 1sd3 n PRO 15 N 1.42 2.49 0.05 4.30 -0.04 -1.26 -4.91 135.00 137.05 1sd3 n PRO 15 Ca 0.00 -3.06 -0.20 0.00 -0.04 0.00 0.00 63.50 60.19 1sd3 n PRO 15 Cb 0.44 -2.10 -0.15 0.00 -0.04 0.00 0.00 33.50 31.66 1sd3 n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1sd3 h TYR 16 N 1.38 0.54 -3.00 0.54 -1.99 -0.84 -0.47 116.97 113.13 1sd3 h TYR 16 Ca 0.45 -0.40 -0.21 0.00 2.00 0.00 0.00 58.73 60.57 1sd3 h TYR 16 Cb 2.45 -0.02 -0.31 0.00 2.00 0.00 0.00 36.73 40.85 1sd3 h TYR 16 CO 1.37 1.35 -0.52 0.08 -0.00 0.00 0.00 178.16 180.45 1sd3 s VAL 17 N -2.44 -0.16 0.17 -2.88 1.01 0.23 -0.95 120.40 115.38 1sd3 s VAL 17 Ca -0.14 0.20 -0.18 0.00 0.00 0.00 0.00 61.98 61.86 1sd3 s VAL 17 Cb 0.01 -0.38 0.04 0.00 0.00 0.00 0.00 36.38 36.05 1sd3 s VAL 17 CO 0.83 0.08 0.51 -1.48 0.00 0.00 0.00 175.10 175.04 1sd3 s LEU 18 N 1.65 0.04 -0.02 3.92 2.34 -0.27 -0.82 118.68 125.53 1sd3 s LEU 18 Ca -0.05 -0.34 -0.30 0.00 0.06 0.00 0.00 54.13 53.49 1sd3 s LEU 18 Cb -0.11 2.15 -0.04 0.00 -0.56 0.00 0.00 46.19 47.63 1sd3 s LEU 18 CO -0.08 -0.98 1.26 -0.36 -1.06 0.00 0.00 176.35 175.12 1sd3 s PHE 19 N -3.83 3.14 0.22 3.48 0.40 -1.26 -1.25 117.98 118.88 1sd3 s PHE 19 Ca 0.06 1.11 -0.30 0.00 -0.60 0.00 0.00 56.93 57.20 1sd3 s PHE 19 Cb -0.00 -3.49 -0.09 0.00 0.51 0.00 0.00 43.02 39.94 1sd3 s PHE 19 CO -0.07 -1.65 1.23 0.21 0.70 0.00 0.00 175.22 175.64 1sd3 s LYS 20 N 2.04 4.47 -0.01 0.44 2.20 -0.16 -4.85 119.74 123.86 1sd3 s LYS 20 Ca 0.59 1.96 -0.13 0.00 -0.36 0.00 0.00 55.97 58.03 1sd3 s LYS 20 Cb -0.28 -3.19 -0.05 0.00 -1.51 0.00 0.00 37.83 32.80 1sd3 s LYS 20 CO 0.25 -0.10 0.37 0.15 -0.36 0.00 0.00 175.35 175.65 1sd3 s LYS 21 N -0.62 3.83 -0.09 4.03 1.02 -1.26 -4.90 119.74 121.75 1sd3 s LYS 21 Ca 0.52 0.31 -0.30 0.00 0.02 0.00 0.00 55.97 56.52 1sd3 s LYS 21 Cb -0.35 -3.20 0.11 0.00 -0.52 0.00 0.00 37.83 33.88 1sd3 s LYS 21 CO 0.40 0.70 0.93 0.45 -0.92 0.00 0.00 175.35 176.91 1sd3 s SER 22 N -1.12 -0.39 0.04 2.83 0.15 -1.26 -5.04 113.70 108.90 1sd3 s SER 22 Ca 0.23 0.26 -0.15 0.00 0.70 0.00 0.00 55.95 56.99 1sd3 s SER 22 Cb -0.16 0.35 -0.34 0.00 -1.71 0.00 0.00 66.02 64.17 1sd3 s SER 22 CO 0.12 -0.47 1.04 -2.24 1.20 0.00 0.00 173.24 172.89 1sd3 h ASP 23 N 2.36 0.82 -3.53 5.45 2.03 -2.07 -3.45 116.42 118.03 1sd3 h ASP 23 Ca -0.20 -0.85 -0.52 0.00 -0.73 0.00 0.00 57.03 54.72 1sd3 h ASP 23 Cb 1.19 -0.27 -0.03 0.00 -0.83 0.00 0.00 39.33 39.40 1sd3 h ASP 23 CO 0.31 1.66 0.07 -0.54 -1.03 0.00 0.00 179.24 179.71 1sd3 s LYS 24 N -2.68 4.18 0.27 4.15 -0.14 -1.26 -5.01 119.74 119.24 1sd3 s LYS 24 Ca -0.09 0.78 -0.30 0.00 -1.36 0.00 0.00 55.97 55.00 1sd3 s LYS 24 Cb 0.05 -2.86 -0.13 0.00 -1.68 0.00 0.00 37.83 33.21 1sd3 s LYS 24 CO 0.94 0.39 1.28 -2.30 -0.76 0.00 0.00 175.35 174.90 1sd3 n PRO 25 N 0.66 1.86 -4.32 -1.68 -0.02 -1.26 -4.99 135.00 125.25 1sd3 n PRO 25 Ca -0.02 0.66 -0.32 0.00 -2.02 0.00 0.00 63.50 61.79 1sd3 n PRO 25 Cb 0.51 -2.23 -0.09 0.00 -0.02 0.00 0.00 33.50 31.68 1sd3 n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1sd3 s LEU 26 N -0.12 3.42 0.14 2.45 1.43 -1.26 -5.13 118.68 119.62 1sd3 s LEU 26 Ca 0.63 -0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.73 1sd3 s LEU 26 Cb -0.65 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 1sd3 s LEU 26 CO 0.55 0.28 -0.12 -0.31 0.23 0.00 0.00 176.35 176.98 1sd3 s TYR 27 N -1.07 1.34 0.00 0.29 1.51 -1.26 -4.81 117.35 113.35 1sd3 s TYR 27 Ca 0.19 -0.65 0.00 0.00 -1.01 0.00 0.00 57.07 55.60 1sd3 s TYR 27 Cb -0.11 -0.68 0.00 0.00 -0.11 0.00 0.00 41.96 41.05 1sd3 s TYR 27 CO 0.10 0.13 0.00 0.41 -1.11 0.00 0.00 175.55 175.08 1sd3 n GLY 28 N 0.11 2.32 0.20 0.71 0.00 -1.26 -2.19 105.19 105.08 1sd3 n GLY 28 Ca -0.12 -0.36 0.14 0.00 0.00 0.00 0.00 46.02 45.68 1sd3 n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1sd3 h ASN 29 N 6.77 0.00 0.56 1.61 2.35 -1.96 -2.34 115.58 122.58 1sd3 h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1sd3 h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1sd3 h ASN 29 CO 0.00 0.00 0.00 -0.67 -1.65 0.00 0.00 177.43 175.11 1sd3 n ASP 30 N -2.52 0.00 0.14 5.81 2.03 -0.93 -2.70 116.55 118.37 1sd3 n ASP 30 Ca -0.00 0.31 0.13 0.00 0.52 0.00 0.00 54.79 55.75 1sd3 n ASP 30 Cb 0.15 -0.42 0.44 0.00 -0.72 0.00 0.00 41.12 40.57 1sd3 n ASP 30 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1sd3 h ARG 31 N 0.00 0.00 -6.12 -0.67 3.08 -1.51 -3.44 114.38 105.72 1sd3 h ARG 31 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1sd3 h ARG 31 Cb 0.28 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.20 1sd3 h ARG 31 CO 0.00 0.00 -0.72 -0.06 -1.07 0.00 0.00 179.97 178.12 1sd3 s PHE 32 N -3.23 2.38 0.24 3.04 0.40 -1.10 -0.99 117.98 118.72 1sd3 s PHE 32 Ca 0.07 -0.38 -0.19 0.00 -0.60 0.00 0.00 56.93 55.84 1sd3 s PHE 32 Cb 0.10 -1.16 0.02 0.00 0.51 0.00 0.00 43.02 42.50 1sd3 s PHE 32 CO 0.53 0.65 0.62 -1.83 0.70 0.00 0.00 175.22 175.89 1sd3 s GLU 33 N -3.57 1.59 0.00 0.44 -1.05 -0.38 -4.68 118.70 111.06 1sd3 s GLU 33 Ca 0.31 -0.95 0.00 0.00 -0.15 0.00 0.00 54.97 54.19 1sd3 s GLU 33 Cb -0.03 0.56 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 1sd3 s GLU 33 CO 0.16 -0.70 0.00 0.41 0.95 0.00 0.00 175.26 176.08 1sd3 n GLY 34 N -0.41 1.95 0.19 -3.83 0.00 -1.26 -1.11 105.19 100.72 1sd3 n GLY 34 Ca -0.06 -2.00 -0.06 0.00 0.00 0.00 0.00 46.02 43.89 1sd3 n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1sd3 h TYR 35 N 0.00 -0.33 0.00 1.61 3.20 -0.59 -0.77 116.97 120.10 1sd3 h TYR 35 Ca 0.00 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 1sd3 h TYR 35 Cb 0.00 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1sd3 h TYR 35 CO 0.00 -0.21 -0.27 0.00 -1.64 0.00 0.00 178.16 176.04 1sd3 h ILE 37 N 0.00 1.34 -0.48 0.00 1.08 -1.37 -0.46 117.51 117.63 1sd3 h ILE 37 Ca -0.00 -2.13 -0.11 0.00 -0.39 0.00 0.00 64.86 62.22 1sd3 h ILE 37 Cb 0.69 2.12 -0.01 0.00 -3.07 0.00 0.00 36.82 36.54 1sd3 h ILE 37 CO 0.04 0.65 -0.14 0.44 -0.69 0.00 0.00 178.15 178.44 1sd3 h ASP 38 N 0.36 0.96 -0.03 1.72 3.32 -0.88 -1.63 116.42 120.24 1sd3 h ASP 38 Ca -0.05 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 56.63 1sd3 h ASP 38 Cb 1.39 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.67 1sd3 h ASP 38 CO 0.14 1.11 0.02 0.25 -1.72 0.00 0.00 179.24 179.04 1sd3 h LEU 39 N 0.80 0.04 -0.79 1.55 5.85 -1.11 -1.80 115.31 119.84 1sd3 h LEU 39 Ca 0.12 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.86 1sd3 h LEU 39 Cb 0.70 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.65 1sd3 h LEU 39 CO 0.05 0.09 0.45 0.25 -0.34 0.00 0.00 178.44 178.94 1sd3 h LEU 40 N -0.02 0.64 -0.16 2.25 5.85 -0.99 -0.49 115.31 122.40 1sd3 h LEU 40 Ca 0.01 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1sd3 h LEU 40 Cb 0.06 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1sd3 h LEU 40 CO -0.00 0.37 0.09 -0.09 -0.34 0.00 0.00 178.44 178.48 1sd3 h ARG 41 N 0.77 0.19 -0.83 1.25 2.43 -0.92 -1.41 114.38 115.85 1sd3 h ARG 41 Ca 0.38 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.53 1sd3 h ARG 41 Cb 0.33 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 1sd3 h ARG 41 CO -0.24 0.12 0.48 0.93 -1.51 0.00 0.00 179.97 179.75 1sd3 h GLU 42 N 0.19 1.15 -0.65 0.20 4.39 -0.67 -2.43 114.58 116.76 1sd3 h GLU 42 Ca 0.06 -0.12 0.02 0.00 0.34 0.00 0.00 59.36 59.66 1sd3 h GLU 42 Cb -0.01 -0.23 -0.04 0.00 -0.10 0.00 0.00 28.75 28.37 1sd3 h GLU 42 CO -0.03 0.83 0.41 -0.07 -1.16 0.00 0.00 179.01 178.99 1sd3 h LEU 43 N 1.15 0.68 -1.10 1.33 3.38 -0.71 -1.52 115.31 118.52 1sd3 h LEU 43 Ca 0.30 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 1sd3 h LEU 43 Cb -0.00 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1sd3 h LEU 43 CO -0.05 0.48 0.24 0.77 0.09 0.00 0.00 178.44 179.96 1sd3 h SER 44 N 0.81 0.80 0.75 -0.43 4.64 -0.79 -0.54 113.55 118.80 1sd3 h SER 44 Ca 0.26 -0.11 -0.25 0.00 -0.47 0.00 0.00 61.79 61.22 1sd3 h SER 44 Cb -0.01 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 61.85 1sd3 h SER 44 CO -0.09 0.72 -1.29 0.71 -0.87 0.00 0.00 176.83 176.01 1sd3 h THR 45 N 0.87 1.38 -0.16 2.95 1.35 -1.29 0.09 112.91 118.11 1sd3 h THR 45 Ca 0.21 -3.11 -0.10 0.00 -0.55 0.00 0.00 66.41 62.86 1sd3 h THR 45 Cb 0.17 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 1sd3 h THR 45 CO -0.02 0.82 -0.29 0.40 -0.25 0.00 0.00 175.52 176.18 1sd3 h ILE 46 N 0.02 1.36 0.00 6.82 2.04 -1.16 -3.30 117.51 123.28 1sd3 h ILE 46 Ca -0.13 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.19 1sd3 h ILE 46 Cb 1.89 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 39.93 1sd3 h ILE 46 CO 0.13 0.46 -0.76 -0.07 0.00 0.00 0.00 178.15 177.91 1sd3 h LEU 47 N 0.10 0.00 -2.79 1.44 3.38 -1.21 -3.49 115.31 112.73 1sd3 h LEU 47 Ca 0.01 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1sd3 h LEU 47 Cb 0.88 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.65 1sd3 h LEU 47 CO 0.07 0.10 -0.10 0.61 0.09 0.00 0.00 178.44 179.20 1sd3 n GLY 48 N 1.31 0.62 3.13 0.83 0.00 -0.12 -5.06 105.19 105.90 1sd3 n GLY 48 Ca 0.02 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 1sd3 n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1sd3 s PHE 49 N -3.05 0.29 0.33 1.61 -0.12 -0.37 -5.04 117.98 111.64 1sd3 s PHE 49 Ca 0.05 -0.71 0.08 0.00 -0.05 0.00 0.00 56.93 56.29 1sd3 s PHE 49 Cb -0.01 -0.20 -0.04 0.00 -0.63 0.00 0.00 43.02 42.15 1sd3 s PHE 49 CO 0.09 -0.41 0.20 0.95 -0.05 0.00 0.00 175.22 176.00 1sd3 s THR 50 N -3.34 3.34 0.29 -4.49 -4.23 -1.26 -4.60 115.64 101.35 1sd3 s THR 50 Ca 0.01 -1.55 -0.19 0.00 -1.18 0.00 0.00 61.69 58.79 1sd3 s THR 50 Cb 0.03 -3.08 0.02 0.00 1.34 0.00 0.00 72.50 70.81 1sd3 s THR 50 CO -0.08 -0.20 0.68 -0.72 -0.54 0.00 0.00 174.62 173.76 1sd3 s TYR 51 N -2.35 -0.03 -0.00 3.99 -0.85 -1.26 -0.47 117.35 116.37 1sd3 s TYR 51 Ca 0.38 -0.43 0.02 0.00 -0.52 0.00 0.00 57.07 56.52 1sd3 s TYR 51 Cb -0.04 0.62 -0.01 0.00 0.38 0.00 0.00 41.96 42.91 1sd3 s TYR 51 CO 0.24 -1.23 -0.06 -1.21 -1.52 0.00 0.00 175.55 171.77 1sd3 s GLU 52 N -3.73 0.44 -0.11 -3.49 2.02 0.05 -4.84 118.70 109.04 1sd3 s GLU 52 Ca 0.14 -0.23 -0.14 0.00 0.02 0.00 0.00 54.97 54.76 1sd3 s GLU 52 Cb -0.05 -0.41 -0.05 0.00 0.10 0.00 0.00 34.13 33.72 1sd3 s GLU 52 CO 0.08 0.11 0.34 0.42 0.02 0.00 0.00 175.26 176.24 1sd3 s ILE 53 N -0.21 5.23 -0.01 -1.63 1.01 -1.26 -0.82 121.20 123.51 1sd3 s ILE 53 Ca 0.01 0.67 0.06 0.00 0.00 0.00 0.00 60.65 61.39 1sd3 s ILE 53 Cb -0.03 -3.67 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1sd3 s ILE 53 CO -0.00 0.44 -0.19 -0.60 0.00 0.00 0.00 174.94 174.59 1sd3 s ARG 54 N 0.01 1.51 -0.16 2.79 3.52 0.37 -4.94 118.95 122.06 1sd3 s ARG 54 Ca 0.20 -0.68 -0.16 0.00 -0.13 0.00 0.00 55.73 54.96 1sd3 s ARG 54 Cb -0.14 -1.47 -0.04 0.00 -1.56 0.00 0.00 34.95 31.74 1sd3 s ARG 54 CO 0.07 0.40 0.39 -0.51 -0.81 0.00 0.00 175.30 174.84 1sd3 s LEU 55 N -0.46 4.22 -0.25 -0.88 1.43 -1.26 -1.21 118.68 120.27 1sd3 s LEU 55 Ca 0.07 0.61 -0.41 0.00 -1.03 0.00 0.00 54.13 53.37 1sd3 s LEU 55 Cb -0.07 -2.53 -0.17 0.00 0.03 0.00 0.00 46.19 43.45 1sd3 s LEU 55 CO -0.01 0.01 1.63 0.55 0.23 0.00 0.00 176.35 178.76 1sd3 n VAL 56 N 3.86 0.19 -0.19 -1.59 3.14 -0.09 -4.84 118.33 118.82 1sd3 n VAL 56 Ca -0.09 -0.03 -0.00 0.00 -2.96 0.00 0.00 64.34 61.25 1sd3 n VAL 56 Cb 0.51 -0.98 0.09 0.00 -1.06 0.00 0.00 33.84 32.41 1sd3 n VAL 56 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 1sd3 h GLU 57 N 6.24 0.25 -0.07 1.45 4.57 -1.94 -2.05 114.58 123.03 1sd3 h GLU 57 Ca -0.46 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1sd3 h GLU 57 Cb 1.34 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 1sd3 h GLU 57 CO 0.92 0.17 0.00 -0.40 -1.18 0.00 0.00 179.01 178.52 1sd3 n ASP 58 N -5.11 0.93 -1.30 1.04 5.75 -1.26 -4.93 116.55 111.66 1sd3 n ASP 58 Ca 0.08 -1.51 -0.16 0.00 -0.01 0.00 0.00 54.79 53.19 1sd3 n ASP 58 Cb 0.29 -0.04 -0.06 0.00 -1.03 0.00 0.00 41.12 40.28 1sd3 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1sd3 n GLY 59 N 1.01 1.39 3.49 6.12 0.00 -0.77 -4.95 105.19 111.48 1sd3 n GLY 59 Ca 0.17 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 1sd3 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sd3 s LYS 60 N -3.53 1.76 -0.08 1.61 1.02 -1.26 -5.05 119.74 114.21 1sd3 s LYS 60 Ca 0.00 -1.54 -0.16 0.00 0.02 0.00 0.00 55.97 54.29 1sd3 s LYS 60 Cb 0.00 -1.92 -0.13 0.00 -0.52 0.00 0.00 37.83 35.27 1sd3 s LYS 60 CO 0.00 0.38 0.60 1.88 -0.92 0.00 0.00 175.35 177.30 1sd3 h TYR 61 N 2.73 -0.16 0.00 3.18 -1.99 -1.87 -2.29 116.97 116.57 1sd3 h TYR 61 Ca -0.44 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.28 1sd3 h TYR 61 Cb 1.23 0.05 0.00 0.00 2.00 0.00 0.00 36.73 40.01 1sd3 h TYR 61 CO 0.72 0.24 0.00 0.41 -0.00 0.00 0.00 178.16 179.52 1sd3 n GLY 62 N 1.04 3.13 3.18 3.88 0.00 -0.61 -1.26 105.19 114.55 1sd3 n GLY 62 Ca -0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 1sd3 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sd3 s ALA 63 N 0.00 0.02 -0.09 4.61 0.00 -1.23 -4.57 121.76 120.50 1sd3 s ALA 63 Ca 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 51.96 50.99 1sd3 s ALA 63 Cb 0.00 0.46 -0.05 0.00 0.00 0.00 0.00 23.12 23.53 1sd3 s ALA 63 CO 0.00 -0.48 0.37 -1.14 0.00 0.00 0.00 175.76 174.51 1sd3 s GLN 64 N -3.89 4.09 0.16 0.00 0.74 -1.26 -2.42 119.66 117.08 1sd3 s GLN 64 Ca 0.07 0.28 -0.30 0.00 0.05 0.00 0.00 55.36 55.46 1sd3 s GLN 64 Cb 0.06 -3.33 -0.08 0.00 1.10 0.00 0.00 33.01 30.76 1sd3 s GLN 64 CO -0.10 0.43 1.21 0.34 -0.55 0.00 0.00 175.29 176.62 1sd3 s ASP 65 N -0.19 7.07 0.21 6.67 -1.08 0.52 -4.92 116.67 124.95 1sd3 s ASP 65 Ca 0.21 2.20 -0.10 0.00 -0.52 0.00 0.00 52.55 54.35 1sd3 s ASP 65 Cb -0.15 -2.60 0.16 0.00 -1.46 0.00 0.00 42.92 38.87 1sd3 s ASP 65 CO 0.09 -0.41 1.88 0.44 0.52 0.00 0.00 175.17 177.69 1sd3 h ASP 66 N 5.60 0.87 0.00 -0.34 3.32 -1.94 0.15 116.42 124.09 1sd3 h ASP 66 Ca -0.44 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1sd3 h ASP 66 Cb 1.21 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1sd3 h ASP 66 CO 0.76 0.63 0.00 0.52 -1.72 0.00 0.00 179.24 179.44 1sd3 n VAL 67 N -4.56 0.00 0.56 -1.35 0.31 -1.26 -4.28 118.33 107.75 1sd3 n VAL 67 Ca 0.07 0.33 0.07 0.00 -0.01 0.00 0.00 64.34 64.80 1sd3 n VAL 67 Cb 0.02 -0.78 0.32 0.00 -0.91 0.00 0.00 33.84 32.49 1sd3 n VAL 67 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1sd3 n ASN 68 N -0.24 0.00 0.00 4.52 0.23 -1.26 -4.87 115.26 113.64 1sd3 n ASN 68 Ca 0.00 0.31 0.00 0.00 -0.53 0.00 0.00 54.58 54.36 1sd3 n ASN 68 Cb 0.00 -0.40 0.00 0.00 -2.08 0.00 0.00 39.78 37.30 1sd3 n ASN 68 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1sd3 n GLY 69 N -0.09 0.20 3.84 4.83 0.00 0.04 -4.96 105.19 109.04 1sd3 n GLY 69 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1sd3 n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sd3 s GLN 70 N -1.19 4.05 0.47 1.61 -0.21 -1.26 -4.39 119.66 118.73 1sd3 s GLN 70 Ca 0.00 0.96 -0.03 0.00 0.02 0.00 0.00 55.36 56.31 1sd3 s GLN 70 Cb 0.00 -2.20 -0.02 0.00 1.00 0.00 0.00 33.01 31.79 1sd3 s GLN 70 CO 0.00 -0.12 0.73 -1.58 -2.12 0.00 0.00 175.29 172.19 1sd3 s TRP 71 N -2.38 3.40 0.00 0.91 0.52 -1.26 -0.35 118.94 119.78 1sd3 s TRP 71 Ca 0.59 0.53 0.00 0.00 0.02 0.00 0.00 56.10 57.24 1sd3 s TRP 71 Cb -0.10 -2.30 0.00 0.00 -1.15 0.00 0.00 33.47 29.92 1sd3 s TRP 71 CO 0.23 -0.32 0.00 0.27 0.02 0.00 0.00 176.95 177.15 1sd3 n ASN 72 N -2.17 0.79 0.00 2.95 0.23 -1.01 -4.67 115.26 111.37 1sd3 n ASN 72 Ca 0.00 -0.62 0.00 0.00 -0.53 0.00 0.00 54.58 53.43 1sd3 n ASN 72 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 1sd3 n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1sd3 n GLY 73 N 1.96 0.99 0.33 4.83 0.00 -1.26 -1.90 105.19 110.14 1sd3 n GLY 73 Ca 0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 46.02 45.29 1sd3 n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1sd3 h MET 74 N 0.00 0.97 -0.41 1.61 2.86 -0.57 -2.05 114.93 117.34 1sd3 h MET 74 Ca 0.00 -0.12 0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1sd3 h MET 74 Cb 0.00 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 31.42 1sd3 h MET 74 CO 0.00 0.73 0.10 0.28 1.06 0.00 0.00 176.91 179.08 1sd3 h VAL 75 N 0.97 0.80 -0.28 -2.22 2.07 -1.56 -1.62 116.25 114.41 1sd3 h VAL 75 Ca 0.24 -0.08 -0.10 0.00 0.82 0.00 0.00 66.70 67.58 1sd3 h VAL 75 Cb 0.07 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1sd3 h VAL 75 CO -0.03 0.04 -0.25 -0.09 0.02 0.00 0.00 177.57 177.26 1sd3 h ARG 76 N 0.23 0.55 -0.46 1.57 9.65 -0.95 -1.81 114.38 123.16 1sd3 h ARG 76 Ca 0.20 -0.21 -0.03 0.00 -1.10 0.00 0.00 59.98 58.84 1sd3 h ARG 76 Cb 0.23 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 1sd3 h ARG 76 CO -0.25 0.76 0.16 0.93 2.80 0.00 0.00 179.97 184.37 1sd3 h GLU 77 N 0.48 0.67 -0.16 0.20 5.08 -0.67 -1.30 114.58 118.88 1sd3 h GLU 77 Ca 0.07 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1sd3 h GLU 77 Cb 0.69 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1sd3 h GLU 77 CO 0.05 0.57 -0.31 -0.07 -1.00 0.00 0.00 179.01 178.26 1sd3 h LEU 78 N 0.66 0.54 -0.55 1.33 3.38 -0.92 0.35 115.31 120.12 1sd3 h LEU 78 Ca 0.16 -0.55 0.06 0.00 0.09 0.00 0.00 57.88 57.64 1sd3 h LEU 78 Cb 0.17 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1sd3 h LEU 78 CO -0.01 0.99 0.25 0.40 0.09 0.00 0.00 178.44 180.16 1sd3 h ILE 79 N 0.12 0.90 -0.17 1.22 2.04 -0.95 -1.30 117.51 119.36 1sd3 h ILE 79 Ca 0.01 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1sd3 h ILE 79 Cb 0.90 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1sd3 h ILE 79 CO 0.07 0.09 0.00 0.47 0.00 0.00 0.00 178.15 178.78 1sd3 n ASP 80 N -4.92 1.12 -3.79 1.72 8.00 -0.52 -4.90 116.55 113.27 1sd3 n ASP 80 Ca 0.06 -2.03 -0.28 0.00 0.71 0.00 0.00 54.79 53.24 1sd3 n ASP 80 Cb 0.18 -0.18 0.04 0.00 -0.02 0.00 0.00 41.12 41.14 1sd3 n ASP 80 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1sd3 n HIS 81 N 0.04 -2.42 1.20 1.24 8.25 -0.49 -4.85 115.22 118.19 1sd3 n HIS 81 Ca 0.06 0.90 0.13 0.00 -0.26 0.00 0.00 57.72 58.55 1sd3 n HIS 81 Cb 0.20 -4.22 0.35 0.00 1.12 0.00 0.00 29.99 27.44 1sd3 n HIS 81 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1sd3 n LYS 82 N -4.71 0.72 -3.74 -0.41 5.02 0.12 -4.86 118.16 110.30 1sd3 n LYS 82 Ca 0.03 -0.43 -0.14 0.00 -2.02 0.00 0.00 58.31 55.75 1sd3 n LYS 82 Cb 0.54 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.97 1sd3 n LYS 82 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sd3 s ALA 83 N -2.57 -0.86 -0.02 7.82 0.00 -1.21 -4.97 121.76 119.95 1sd3 s ALA 83 Ca 0.22 0.44 0.05 0.00 0.00 0.00 0.00 51.96 52.67 1sd3 s ALA 83 Cb 0.19 0.03 -0.25 0.00 0.00 0.00 0.00 23.12 23.10 1sd3 s ALA 83 CO 0.55 -0.26 0.76 -0.44 0.00 0.00 0.00 175.76 176.36 1sd3 h ASP 84 N 3.89 0.17 -5.17 0.00 3.32 -0.84 -3.43 116.42 114.36 1sd3 h ASP 84 Ca -0.29 -0.29 -0.11 0.00 0.02 0.00 0.00 57.03 56.35 1sd3 h ASP 84 Cb 1.17 -0.06 -0.15 0.00 0.22 0.00 0.00 39.33 40.51 1sd3 h ASP 84 CO 0.39 1.25 -0.54 -0.76 -1.72 0.00 0.00 179.24 177.87 1sd3 s LEU 85 N -6.56 1.95 -0.22 1.55 1.43 -1.09 -4.30 118.68 111.43 1sd3 s LEU 85 Ca -0.08 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 1sd3 s LEU 85 Cb 0.08 0.58 0.06 0.00 0.03 0.00 0.00 46.19 46.94 1sd3 s LEU 85 CO 0.82 -0.61 -0.04 0.00 0.23 0.00 0.00 176.35 176.75 1sd3 s ALA 86 N -3.52 1.77 -0.31 4.21 0.00 -0.19 -0.53 121.76 123.19 1sd3 s ALA 86 Ca 0.03 -1.20 0.01 0.00 0.00 0.00 0.00 51.96 50.80 1sd3 s ALA 86 Cb 0.04 -1.36 0.07 0.00 0.00 0.00 0.00 23.12 21.88 1sd3 s ALA 86 CO -0.09 -1.13 0.01 0.08 0.00 0.00 0.00 175.76 174.63 1sd3 s VAL 87 N 1.49 2.63 0.17 0.00 1.01 -0.86 -1.33 120.40 123.50 1sd3 s VAL 87 Ca -0.04 -1.79 -0.22 0.00 0.00 0.00 0.00 61.98 59.93 1sd3 s VAL 87 Cb -0.18 -2.67 0.08 0.00 0.00 0.00 0.00 36.38 33.61 1sd3 s VAL 87 CO -0.07 -0.29 1.04 0.00 0.00 0.00 0.00 175.10 175.78 1sd3 n ALA 88 N 4.48 -2.72 -1.58 5.51 0.00 -1.26 -4.59 120.51 120.35 1sd3 n ALA 88 Ca -0.08 -1.00 -0.41 0.00 0.00 0.00 0.00 53.44 51.96 1sd3 n ALA 88 Cb 0.42 0.53 -0.01 0.00 0.00 0.00 0.00 19.45 20.40 1sd3 n ALA 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1sd3 n PRO 89 N -0.73 2.88 -3.24 0.00 -0.04 -1.26 -4.69 135.00 127.92 1sd3 n PRO 89 Ca -0.02 -2.43 -0.42 0.00 -0.04 0.00 0.00 63.50 60.60 1sd3 n PRO 89 Cb 0.57 -3.15 -0.08 0.00 -0.04 0.00 0.00 33.50 30.81 1sd3 n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1sd3 s LEU 90 N 1.68 4.41 0.17 1.53 2.96 -1.26 -5.00 118.68 123.15 1sd3 s LEU 90 Ca 0.52 -0.11 -0.31 0.00 -0.22 0.00 0.00 54.13 54.01 1sd3 s LEU 90 Cb 0.15 -2.57 -0.09 0.00 0.50 0.00 0.00 46.19 44.18 1sd3 s LEU 90 CO -0.07 -0.51 1.41 0.00 -1.32 0.00 0.00 176.35 175.86 1sd3 s ALA 91 N 2.39 3.61 -0.28 5.97 0.00 -1.26 -1.57 121.76 130.62 1sd3 s ALA 91 Ca 0.18 1.19 -0.27 0.00 0.00 0.00 0.00 51.96 53.06 1sd3 s ALA 91 Cb -0.15 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.43 1sd3 s ALA 91 CO 0.14 -0.64 0.97 0.42 0.00 0.00 0.00 175.76 176.64 1sd3 s ILE 92 N 0.68 4.66 0.07 0.00 1.01 0.10 -4.89 121.20 122.83 1sd3 s ILE 92 Ca 0.63 1.66 0.03 0.00 0.00 0.00 0.00 60.65 62.96 1sd3 s ILE 92 Cb -0.39 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 37.76 1sd3 s ILE 92 CO 0.35 -0.30 -0.08 0.42 0.00 0.00 0.00 174.94 175.32 1sd3 s THR 93 N 3.27 0.72 0.15 2.92 -4.23 -1.26 -4.55 115.64 112.66 1sd3 s THR 93 Ca 0.41 -1.49 -0.18 0.00 -1.18 0.00 0.00 61.69 59.25 1sd3 s THR 93 Cb -0.14 -1.14 0.03 0.00 1.34 0.00 0.00 72.50 72.60 1sd3 s THR 93 CO 0.11 -0.56 1.69 0.22 -0.54 0.00 0.00 174.62 175.54 1sd3 h TYR 94 N 3.80 -0.10 -0.52 3.99 3.20 -1.99 0.21 116.97 125.56 1sd3 h TYR 94 Ca -0.36 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.51 1sd3 h TYR 94 Cb 1.19 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.52 1sd3 h TYR 94 CO 0.63 -0.10 0.23 -0.39 -1.64 0.00 0.00 178.16 176.89 1sd3 h VAL 95 N 0.04 1.18 -0.17 1.81 -1.51 -2.01 -2.52 116.25 113.06 1sd3 h VAL 95 Ca 0.15 -0.54 -0.19 0.00 -1.23 0.00 0.00 66.70 64.88 1sd3 h VAL 95 Cb 0.22 0.53 0.00 0.00 -2.13 0.00 0.00 31.29 29.91 1sd3 h VAL 95 CO -0.29 0.22 -0.67 0.03 -1.23 0.00 0.00 177.57 175.63 1sd3 h ARG 96 N 0.74 0.68 0.00 5.19 3.08 -1.79 -2.99 114.38 119.29 1sd3 h ARG 96 Ca 0.18 -0.50 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1sd3 h ARG 96 Cb 0.11 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1sd3 h ARG 96 CO -0.02 1.12 0.00 0.93 -1.07 0.00 0.00 179.97 180.93 1sd3 h GLU 97 N 0.49 0.00 0.00 0.04 5.08 -0.53 0.39 114.58 120.05 1sd3 h GLU 97 Ca -0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1sd3 h GLU 97 Cb 1.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 1sd3 h GLU 97 CO 0.13 0.00 -0.28 0.87 -1.00 0.00 0.00 179.01 178.73 1sd3 h LYS 98 N 0.00 0.00 0.00 2.33 1.57 -1.40 -3.37 116.57 115.70 1sd3 h LYS 98 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1sd3 h LYS 98 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1sd3 h LYS 98 CO 0.00 0.28 -1.17 1.33 -0.57 0.00 0.00 179.45 179.32 1sd3 n VAL 99 N -3.24 0.03 -4.22 0.50 0.24 -0.03 -5.07 118.33 106.54 1sd3 n VAL 99 Ca 0.02 -0.09 -0.13 0.00 -2.04 0.00 0.00 64.34 62.10 1sd3 n VAL 99 Cb 0.58 0.21 -0.10 0.00 -1.47 0.00 0.00 33.84 33.06 1sd3 n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1sd3 s ILE 100 N -2.22 0.23 0.15 1.34 -4.36 -0.27 -4.23 121.20 111.83 1sd3 s ILE 100 Ca -0.01 -1.98 0.05 0.00 -0.26 0.00 0.00 60.65 58.45 1sd3 s ILE 100 Cb 0.02 -2.37 -0.04 0.00 1.25 0.00 0.00 42.46 41.32 1sd3 s ILE 100 CO 0.14 -0.17 0.12 -1.81 0.24 0.00 0.00 174.94 173.46 1sd3 s ASP 101 N -3.17 5.46 0.07 4.36 1.01 -0.67 -4.16 116.67 119.58 1sd3 s ASP 101 Ca 0.33 -0.14 0.06 0.00 0.71 0.00 0.00 52.55 53.52 1sd3 s ASP 101 Cb 0.07 -1.41 -0.03 0.00 1.01 0.00 0.00 42.92 42.56 1sd3 s ASP 101 CO 0.09 0.08 -0.17 -0.36 0.21 0.00 0.00 175.17 175.02 1sd3 s PHE 102 N -1.70 1.50 0.91 4.23 0.40 -1.26 -1.31 117.98 120.76 1sd3 s PHE 102 Ca 0.30 -0.41 -0.14 0.00 -0.60 0.00 0.00 56.93 56.08 1sd3 s PHE 102 Cb -0.10 -0.85 0.17 0.00 0.51 0.00 0.00 43.02 42.74 1sd3 s PHE 102 CO 0.23 0.11 1.27 -1.54 0.70 0.00 0.00 175.22 175.99 1sd3 s SER 103 N -1.61 3.52 0.77 1.36 1.04 -0.49 -4.96 113.70 113.33 1sd3 s SER 103 Ca 0.03 0.35 -0.13 0.00 0.48 0.00 0.00 55.95 56.69 1sd3 s SER 103 Cb -0.09 -0.53 0.06 0.00 0.10 0.00 0.00 66.02 65.56 1sd3 s SER 103 CO 0.03 -2.48 1.13 -0.54 0.98 0.00 0.00 173.24 172.36 1sd3 s LYS 104 N -5.77 2.09 0.52 4.02 -0.14 -1.26 -4.57 119.74 114.62 1sd3 s LYS 104 Ca 0.71 1.44 -0.21 0.00 -1.36 0.00 0.00 55.97 56.55 1sd3 s LYS 104 Cb -0.06 -1.86 -0.06 0.00 -1.68 0.00 0.00 37.83 34.18 1sd3 s LYS 104 CO 0.51 -1.81 1.23 -1.25 -0.76 0.00 0.00 175.35 173.27 1sd3 s PRO 105 N -4.42 3.39 0.00 -1.68 0.04 -1.26 -4.58 135.00 126.50 1sd3 s PRO 105 Ca 0.67 1.90 0.15 0.00 0.04 0.00 0.00 61.00 63.76 1sd3 s PRO 105 Cb -0.22 -2.24 0.10 0.00 0.04 0.00 0.00 34.50 32.18 1sd3 s PRO 105 CO 0.50 -0.89 0.95 1.97 0.04 0.00 0.00 177.00 179.57 1sd3 n PHE 106 N -0.92 0.00 -3.60 0.56 1.16 0.24 -4.95 117.46 109.94 1sd3 n PHE 106 Ca 0.10 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.56 1sd3 n PHE 106 Cb 0.48 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.28 1sd3 n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1sd3 s MET 107 N -1.38 0.65 0.13 3.97 0.00 -1.25 -5.00 119.30 116.43 1sd3 s MET 107 Ca 0.17 0.50 0.08 0.00 0.00 0.00 0.00 55.69 56.43 1sd3 s MET 107 Cb 0.13 0.31 -0.04 0.00 0.00 0.00 0.00 34.83 35.23 1sd3 s MET 107 CO 0.23 -0.14 -0.09 0.95 0.00 0.00 0.00 175.02 175.97 1sd3 s THR 108 N -0.29 3.35 0.05 10.11 -4.23 -1.26 -0.89 115.64 122.48 1sd3 s THR 108 Ca -0.01 -1.39 -0.04 0.00 -1.18 0.00 0.00 61.69 59.07 1sd3 s THR 108 Cb -0.03 -2.61 0.01 0.00 1.34 0.00 0.00 72.50 71.22 1sd3 s THR 108 CO -0.01 0.03 0.20 0.00 -0.54 0.00 0.00 174.62 174.30 1sd3 n LEU 109 N 0.44 0.00 -3.47 4.79 -0.00 -0.23 -4.88 117.00 113.66 1sd3 n LEU 109 Ca -0.12 -0.38 -0.13 0.00 -0.00 0.00 0.00 56.01 55.38 1sd3 n LEU 109 Cb 0.53 0.65 -0.03 0.00 -0.00 0.00 0.00 43.42 44.57 1sd3 n LEU 109 CO 0.34 -0.13 0.46 -0.83 -0.00 0.00 0.00 177.39 177.24 1sd3 s GLY 110 N -1.97 -0.57 0.36 1.47 0.00 -1.26 -1.03 107.32 104.32 1sd3 s GLY 110 Ca 0.04 0.87 -0.27 0.00 0.00 0.00 0.00 44.72 45.36 1sd3 s GLY 110 CO 0.02 0.46 1.16 -0.42 0.00 0.00 0.00 173.10 174.32 1sd3 s ILE 111 N -2.79 3.22 0.15 0.90 1.01 -1.25 -0.34 121.20 122.10 1sd3 s ILE 111 Ca -0.02 1.10 -0.02 0.00 0.00 0.00 0.00 60.65 61.71 1sd3 s ILE 111 Cb -0.01 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.82 1sd3 s ILE 111 CO -0.05 0.17 0.23 -0.24 0.00 0.00 0.00 174.94 175.05 1sd3 n SER 112 N 0.48 -0.65 -4.44 3.58 2.88 0.01 0.26 113.62 115.73 1sd3 n SER 112 Ca 0.02 -1.78 -0.33 0.00 -1.33 0.00 0.00 58.87 55.45 1sd3 n SER 112 Cb 0.45 1.18 -0.13 0.00 -0.75 0.00 0.00 64.21 64.96 1sd3 n SER 112 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1sd3 s ILE 113 N -2.60 3.29 -0.14 2.46 1.01 -1.25 -1.59 121.20 122.39 1sd3 s ILE 113 Ca 0.11 -0.59 -0.04 0.00 0.00 0.00 0.00 60.65 60.13 1sd3 s ILE 113 Cb -0.01 -2.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 1sd3 s ILE 113 CO 0.08 0.54 -0.01 -0.22 0.00 0.00 0.00 174.94 175.33 1sd3 s LEU 114 N 0.01 3.45 0.34 2.97 2.96 0.77 0.04 118.68 129.23 1sd3 s LEU 114 Ca -0.03 -0.01 -0.17 0.00 -0.22 0.00 0.00 54.13 53.70 1sd3 s LEU 114 Cb -0.14 -1.83 0.04 0.00 0.50 0.00 0.00 46.19 44.76 1sd3 s LEU 114 CO 0.04 0.23 0.74 -0.47 -1.32 0.00 0.00 176.35 175.56 1sd3 s TYR 115 N 0.01 0.07 0.56 5.38 5.04 -0.77 -0.96 117.35 126.69 1sd3 s TYR 115 Ca 0.02 -0.64 -0.15 0.00 -2.44 0.00 0.00 57.07 53.86 1sd3 s TYR 115 Cb -0.13 0.72 -0.06 0.00 0.35 0.00 0.00 41.96 42.85 1sd3 s TYR 115 CO 0.02 -1.41 1.02 1.03 -1.34 0.00 0.00 175.55 174.87 1sd3 s ARG 116 N -2.97 3.65 0.89 4.97 0.52 -1.26 -0.86 118.95 123.88 1sd3 s ARG 116 Ca 0.15 1.01 -0.14 0.00 -0.52 0.00 0.00 55.73 56.23 1sd3 s ARG 116 Cb -0.05 -2.09 0.14 0.00 0.52 0.00 0.00 34.95 33.47 1sd3 s ARG 116 CO 0.10 -0.52 1.24 0.15 0.02 0.00 0.00 175.30 176.29 1sd3 s LYS 117 N -4.27 1.29 -1.32 3.54 1.02 0.04 -4.38 119.74 115.66 1sd3 s LYS 117 Ca 0.60 -0.10 0.00 0.00 0.02 0.00 0.00 55.97 56.48 1sd3 s LYS 117 Cb -0.12 -1.89 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 1sd3 s LYS 117 CO 0.37 -2.02 0.00 0.41 -0.92 0.00 0.00 175.35 173.19 1sd3 n GLY 118 N -3.40 0.46 3.58 -3.33 0.00 -1.26 -5.03 105.19 96.22 1sd3 n GLY 118 Ca 0.11 -0.32 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 1sd3 n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sd3 s THR 119 N -2.63 2.23 -2.17 2.61 -4.23 -1.26 -5.03 115.64 105.16 1sd3 s THR 119 Ca 0.00 -2.10 0.28 0.00 -1.18 0.00 0.00 61.69 58.69 1sd3 s THR 119 Cb 0.00 -2.78 0.71 0.00 1.34 0.00 0.00 72.50 71.78 1sd3 s THR 119 CO 0.00 -0.14 1.96 -0.81 -0.54 0.00 0.00 174.62 175.09 1sd3 n PRO 120 N -0.88 1.26 -2.58 3.99 -0.04 -1.26 -4.80 135.00 130.69 1sd3 n PRO 120 Ca -0.05 -0.38 -0.43 0.00 -0.04 0.00 0.00 63.50 62.60 1sd3 n PRO 120 Cb 0.64 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 32.63 1sd3 n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1sd3 s ILE 121 N -1.98 4.45 0.00 0.52 -1.09 -1.26 -4.86 121.20 116.98 1sd3 s ILE 121 Ca 0.41 1.69 0.00 0.00 -2.23 0.00 0.00 60.65 60.52 1sd3 s ILE 121 Cb 0.20 -4.30 0.00 0.00 -1.58 0.00 0.00 42.46 36.78 1sd3 s ILE 121 CO 0.33 -0.38 0.39 -0.67 -1.23 0.00 0.00 174.94 173.38 1sd3 n ASP 122 N 6.86 0.79 -3.44 3.58 2.03 -1.26 -4.91 116.55 120.19 1sd3 n ASP 122 Ca 0.13 -0.95 -0.06 0.00 0.52 0.00 0.00 54.79 54.43 1sd3 n ASP 122 Cb 0.47 0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 1sd3 n ASP 122 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1sd3 s SER 123 N -0.09 -0.11 0.20 1.67 1.04 -1.26 -3.33 113.70 111.83 1sd3 s SER 123 Ca 0.00 -0.75 -0.08 0.00 0.48 0.00 0.00 55.95 55.60 1sd3 s SER 123 Cb 0.00 0.67 0.13 0.00 0.10 0.00 0.00 66.02 66.92 1sd3 s SER 123 CO 0.00 -1.29 1.69 0.00 0.98 0.00 0.00 173.24 174.61 1sd3 h ALA 124 N 2.00 0.92 -1.00 5.32 0.00 -1.98 -2.38 119.26 122.14 1sd3 h ALA 124 Ca -0.26 -0.28 0.09 0.00 0.00 0.00 0.00 54.91 54.46 1sd3 h ALA 124 Cb 1.24 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 1sd3 h ALA 124 CO 0.32 0.66 0.64 -0.44 0.00 0.00 0.00 179.25 180.42 1sd3 h ASP 125 N 0.98 0.98 -0.28 0.00 3.32 -1.96 0.19 116.42 119.64 1sd3 h ASP 125 Ca 0.19 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 1sd3 h ASP 125 Cb 0.48 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1sd3 h ASP 125 CO 0.02 0.57 0.16 0.44 -1.72 0.00 0.00 179.24 178.71 1sd3 h ASP 126 N 1.08 0.36 0.07 6.45 3.32 -1.82 -1.22 116.42 124.66 1sd3 h ASP 126 Ca 0.46 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 57.34 1sd3 h ASP 126 Cb 0.33 -0.09 0.02 0.00 0.22 0.00 0.00 39.33 39.80 1sd3 h ASP 126 CO -0.22 0.29 -0.65 -0.07 -1.72 0.00 0.00 179.24 176.87 1sd3 h LEU 127 N 0.41 0.45 -1.65 1.55 3.38 -0.68 -3.34 115.31 115.43 1sd3 h LEU 127 Ca 0.11 -0.87 -0.03 0.00 0.09 0.00 0.00 57.88 57.17 1sd3 h LEU 127 Cb 0.01 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1sd3 h LEU 127 CO -0.02 1.27 -0.15 0.00 0.09 0.00 0.00 178.44 179.63 1sd3 h ALA 128 N 0.18 1.17 -0.05 1.53 0.00 -0.46 -2.81 119.26 118.83 1sd3 h ALA 128 Ca -0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1sd3 h ALA 128 Cb 1.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1sd3 h ALA 128 CO 0.12 0.19 0.00 0.36 0.00 0.00 0.00 179.25 179.92 1sd3 n LYS 129 N -3.52 1.37 -4.15 0.00 2.85 -0.49 -4.86 118.16 109.36 1sd3 n LYS 129 Ca -0.01 -0.54 -0.11 0.00 -1.05 0.00 0.00 58.31 56.60 1sd3 n LYS 129 Cb 0.30 -1.42 -0.10 0.00 -0.65 0.00 0.00 35.03 33.16 1sd3 n LYS 129 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 1sd3 s GLN 130 N -1.95 0.79 0.00 -1.58 1.03 -1.06 -5.06 119.66 111.83 1sd3 s GLN 130 Ca 0.37 -1.24 0.00 0.00 0.04 0.00 0.00 55.36 54.53 1sd3 s GLN 130 Cb 0.18 -0.24 0.00 0.00 0.03 0.00 0.00 33.01 32.99 1sd3 s GLN 130 CO 0.30 -0.00 0.69 0.25 -2.54 0.00 0.00 175.29 173.99 1sd3 n THR 131 N 0.22 0.44 0.10 3.63 -2.24 -1.26 -4.82 114.28 110.35 1sd3 n THR 131 Ca -0.14 -0.67 -0.05 0.00 -2.27 0.00 0.00 64.05 60.93 1sd3 n THR 131 Cb 0.60 0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 69.64 1sd3 n THR 131 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1sd3 h LYS 132 N 0.00 -0.30 -6.38 -0.78 3.64 -1.97 -3.43 116.57 107.36 1sd3 h LYS 132 Ca 0.00 0.02 -0.54 0.00 -1.27 0.00 0.00 60.65 58.86 1sd3 h LYS 132 Cb 0.31 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1sd3 h LYS 132 CO 0.00 -0.20 0.37 -1.50 -2.27 0.00 0.00 179.45 175.86 1sd3 s ILE 133 N -2.58 4.87 0.53 2.00 2.07 -1.26 -5.03 121.20 121.80 1sd3 s ILE 133 Ca -0.05 2.03 -0.06 0.00 -1.41 0.00 0.00 60.65 61.16 1sd3 s ILE 133 Cb 0.00 -4.31 -0.03 0.00 0.13 0.00 0.00 42.46 38.26 1sd3 s ILE 133 CO 0.14 0.15 0.85 -1.61 -1.91 0.00 0.00 174.94 172.55 1sd3 s GLU 134 N 1.10 3.43 0.05 3.50 2.02 -1.01 -4.89 118.70 122.90 1sd3 s GLU 134 Ca 0.51 0.25 -0.13 0.00 0.02 0.00 0.00 54.97 55.62 1sd3 s GLU 134 Cb -0.21 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 31.74 1sd3 s GLU 134 CO 0.26 -0.37 0.30 1.52 0.02 0.00 0.00 175.26 177.00 1sd3 s TYR 135 N -2.87 -0.09 0.00 1.61 -0.85 -1.26 -0.40 117.35 113.50 1sd3 s TYR 135 Ca 0.50 -0.09 0.00 0.00 -0.52 0.00 0.00 57.07 56.96 1sd3 s TYR 135 Cb -0.10 0.09 0.00 0.00 0.38 0.00 0.00 41.96 42.33 1sd3 s TYR 135 CO 0.46 -0.52 0.00 0.41 -1.52 0.00 0.00 175.55 174.39 1sd3 n GLY 136 N 0.47 2.50 3.74 5.49 0.00 -0.99 -4.75 105.19 111.66 1sd3 n GLY 136 Ca -0.18 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 1sd3 n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sd3 s ALA 137 N -1.00 -0.39 0.04 4.61 0.00 -1.25 -0.74 121.76 123.03 1sd3 s ALA 137 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 50.70 1sd3 s ALA 137 Cb 0.00 0.74 -0.05 0.00 0.00 0.00 0.00 23.12 23.82 1sd3 s ALA 137 CO 0.00 -0.95 1.12 0.08 0.00 0.00 0.00 175.76 176.01 1sd3 s VAL 138 N -2.24 4.34 0.35 0.00 1.01 -1.26 -1.45 120.40 121.15 1sd3 s VAL 138 Ca 0.19 1.68 -0.28 0.00 0.00 0.00 0.00 61.98 63.57 1sd3 s VAL 138 Cb -0.04 -4.08 -0.11 0.00 0.00 0.00 0.00 36.38 32.15 1sd3 s VAL 138 CO 0.14 0.13 1.40 -0.70 0.00 0.00 0.00 175.10 176.07 1sd3 s GLU 139 N 1.01 4.23 -1.69 2.72 2.12 0.89 -3.05 118.70 124.94 1sd3 s GLU 139 Ca 0.56 2.39 -0.02 0.00 0.36 0.00 0.00 54.97 58.26 1sd3 s GLU 139 Cb -0.26 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.11 1sd3 s GLU 139 CO 0.29 -0.36 0.25 -0.25 -0.54 0.00 0.00 175.26 174.65 1sd3 n ASP 140 N 0.71 -5.98 -4.82 -1.70 8.00 -1.26 -4.79 116.55 106.70 1sd3 n ASP 140 Ca 0.01 -0.13 -0.29 0.00 0.71 0.00 0.00 54.79 55.09 1sd3 n ASP 140 Cb 0.40 -4.92 -0.05 0.00 -0.02 0.00 0.00 41.12 36.54 1sd3 n ASP 140 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1sd3 s GLY 141 N -2.32 2.63 0.35 0.44 0.00 -1.17 -1.58 107.32 105.67 1sd3 s GLY 141 Ca 0.13 -1.04 0.07 0.00 0.00 0.00 0.00 44.72 43.88 1sd3 s GLY 141 CO 0.16 -2.04 1.85 0.00 0.00 0.00 0.00 173.10 173.06 1sd3 h ALA 142 N 1.10 1.36 -0.26 3.20 0.00 -1.88 -2.38 119.26 120.40 1sd3 h ALA 142 Ca -0.41 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.18 1sd3 h ALA 142 Cb 1.30 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1sd3 h ALA 142 CO 0.66 0.44 -0.09 1.15 0.00 0.00 0.00 179.25 181.41 1sd3 h THR 143 N 0.30 1.29 -0.46 0.00 2.02 -1.95 -0.79 112.91 113.32 1sd3 h THR 143 Ca 0.06 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 66.10 1sd3 h THR 143 Cb 0.48 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.36 1sd3 h THR 143 CO 0.03 0.36 0.29 -0.03 0.37 0.00 0.00 175.52 176.54 1sd3 h MET 144 N 0.25 0.62 -0.60 6.66 -1.53 -1.72 -2.51 114.93 116.10 1sd3 h MET 144 Ca 0.06 -0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.25 1sd3 h MET 144 Cb 0.58 -0.13 -0.03 0.00 -0.55 0.00 0.00 31.60 31.46 1sd3 h MET 144 CO 0.03 0.43 0.27 1.15 0.14 0.00 0.00 176.91 178.94 1sd3 h THR 145 N 0.62 1.20 -0.22 -0.77 2.02 -1.32 -1.05 112.91 113.40 1sd3 h THR 145 Ca 0.17 -0.60 0.03 0.00 0.77 0.00 0.00 66.41 66.78 1sd3 h THR 145 Cb -0.04 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 1sd3 h THR 145 CO -0.03 0.24 0.03 0.15 0.37 0.00 0.00 175.52 176.28 1sd3 h PHE 146 N 0.85 0.04 -0.33 3.16 3.57 -0.71 -0.85 116.94 122.68 1sd3 h PHE 146 Ca 0.21 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.60 1sd3 h PHE 146 Cb 0.12 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1sd3 h PHE 146 CO 0.01 0.00 -0.29 0.74 -2.23 0.00 0.00 178.31 176.55 1sd3 h PHE 147 N 0.11 0.78 0.00 0.41 -1.00 -1.17 -0.89 116.94 115.18 1sd3 h PHE 147 Ca 0.10 -0.19 -0.05 0.00 2.81 0.00 0.00 57.97 60.64 1sd3 h PHE 147 Cb 0.11 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.48 1sd3 h PHE 147 CO -0.16 0.89 -0.23 -0.22 -1.61 0.00 0.00 178.31 176.99 1sd3 h LYS 148 N 0.58 0.00 -0.00 1.51 3.64 -0.78 -3.03 116.57 118.49 1sd3 h LYS 148 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1sd3 h LYS 148 Cb 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1sd3 h LYS 148 CO 0.06 0.23 -0.80 1.63 -2.27 0.00 0.00 179.45 178.30 1sd3 n LYS 149 N -4.16 0.98 -1.88 1.90 5.02 -0.36 -5.01 118.16 114.65 1sd3 n LYS 149 Ca -0.02 -0.14 -0.37 0.00 -2.02 0.00 0.00 58.31 55.76 1sd3 n LYS 149 Cb 0.29 -1.37 0.04 0.00 -0.02 0.00 0.00 35.03 33.97 1sd3 n LYS 149 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1sd3 s SER 150 N -2.66 5.18 0.00 4.39 0.15 -0.35 -4.93 113.70 115.47 1sd3 s SER 150 Ca 0.08 2.60 0.05 0.00 0.70 0.00 0.00 55.95 59.38 1sd3 s SER 150 Cb 0.14 -2.62 0.06 0.00 -1.71 0.00 0.00 66.02 61.89 1sd3 s SER 150 CO 0.72 -1.62 0.75 0.29 1.20 0.00 0.00 173.24 174.58 1sd3 n LYS 151 N -1.31 0.36 -2.58 5.44 5.02 -1.26 -4.60 118.16 119.22 1sd3 n LYS 151 Ca 0.12 -0.98 -0.43 0.00 -2.02 0.00 0.00 58.31 55.00 1sd3 n LYS 151 Cb 0.47 -1.10 -0.02 0.00 -0.02 0.00 0.00 35.03 34.37 1sd3 n LYS 151 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1sd3 s ILE 152 N -0.52 4.46 0.06 -0.18 1.01 -1.26 -4.90 121.20 119.87 1sd3 s ILE 152 Ca 0.06 1.72 -0.11 0.00 0.00 0.00 0.00 60.65 62.32 1sd3 s ILE 152 Cb 0.04 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 1sd3 s ILE 152 CO 0.06 -0.36 0.78 -1.54 0.00 0.00 0.00 174.94 173.88 1sd3 n SER 153 N 6.81 -0.39 -0.17 3.58 3.41 -1.26 -0.07 113.62 125.53 1sd3 n SER 153 Ca 0.13 0.86 -0.01 0.00 -0.26 0.00 0.00 58.87 59.59 1sd3 n SER 153 Cb 0.46 -0.19 0.07 0.00 -0.26 0.00 0.00 64.21 64.30 1sd3 n SER 153 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1sd3 h THR 154 N 0.00 0.65 0.00 6.66 2.02 -2.00 -0.66 112.91 119.58 1sd3 h THR 154 Ca 0.06 -0.06 -0.10 0.00 0.77 0.00 0.00 66.41 67.07 1sd3 h THR 154 Cb 0.15 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1sd3 h THR 154 CO -0.35 0.03 -0.48 1.88 0.37 0.00 0.00 175.52 176.98 1sd3 h TYR 155 N 0.19 0.00 -0.26 3.16 0.99 -1.31 -1.71 116.97 118.03 1sd3 h TYR 155 Ca 0.27 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.94 1sd3 h TYR 155 Cb 0.39 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.11 1sd3 h TYR 155 CO -0.27 0.48 -0.09 0.22 -0.00 0.00 0.00 178.16 178.50 1sd3 h ASP 156 N 0.00 0.52 0.91 3.88 1.82 0.79 -1.65 116.42 122.69 1sd3 h ASP 156 Ca -0.00 -0.38 -0.11 0.00 -0.39 0.00 0.00 57.03 56.14 1sd3 h ASP 156 Cb 0.92 -0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.77 1sd3 h ASP 156 CO 0.06 0.78 -0.53 0.07 -1.61 0.00 0.00 179.24 178.02 1sd3 h LYS 157 N 0.25 0.00 -0.33 0.28 2.10 -1.10 -2.17 116.57 115.60 1sd3 h LYS 157 Ca 0.06 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.61 1sd3 h LYS 157 Cb 0.57 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 1sd3 h LYS 157 CO 0.03 0.53 -0.22 0.52 -2.00 0.00 0.00 179.45 178.30 1sd3 h MET 158 N 0.00 0.63 -0.24 0.07 2.86 -1.16 -1.70 114.93 115.39 1sd3 h MET 158 Ca -0.01 -0.24 -0.19 0.00 -2.06 0.00 0.00 59.70 57.20 1sd3 h MET 158 Cb 1.12 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.74 1sd3 h MET 158 CO 0.07 0.81 -0.59 2.35 1.06 0.00 0.00 176.91 180.60 1sd3 h TRP 159 N 0.56 1.01 -0.99 -0.22 2.91 -1.08 -1.26 115.95 116.88 1sd3 h TRP 159 Ca 0.08 -0.38 0.07 0.00 1.13 0.00 0.00 58.89 59.80 1sd3 h TRP 159 Cb 0.68 -0.18 -0.07 0.00 -0.51 0.00 0.00 29.16 29.08 1sd3 h TRP 159 CO 0.03 1.19 0.64 0.00 -1.03 0.00 0.00 178.44 179.27 1sd3 h ALA 160 N 0.72 1.40 0.50 2.65 0.00 -1.14 0.24 119.26 123.62 1sd3 h ALA 160 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1sd3 h ALA 160 Cb 1.20 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1sd3 h ALA 160 CO 0.13 0.40 -0.24 0.35 0.00 0.00 0.00 179.25 179.88 1sd3 h PHE 161 N 1.13 -0.62 -0.19 0.00 3.57 -1.04 -2.17 116.94 117.61 1sd3 h PHE 161 Ca 0.44 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.97 1sd3 h PHE 161 Cb 0.22 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.13 1sd3 h PHE 161 CO -0.01 -0.30 -0.07 0.52 -2.23 0.00 0.00 178.31 176.22 1sd3 h MET 162 N -0.91 -0.03 -0.81 1.11 2.86 -0.78 -2.65 114.93 113.72 1sd3 h MET 162 Ca -0.07 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.65 1sd3 h MET 162 Cb 0.60 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.20 1sd3 h MET 162 CO 0.11 -0.02 0.47 1.03 1.06 0.00 0.00 176.91 179.57 1sd3 h SER 163 N -0.03 0.71 0.75 1.22 0.87 -0.58 0.36 113.55 116.85 1sd3 h SER 163 Ca 0.10 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1sd3 h SER 163 Cb 0.18 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1sd3 h SER 163 CO -0.21 0.43 0.00 0.77 -0.53 0.00 0.00 176.83 177.29 1sd3 h SER 164 N 0.83 0.00 0.00 6.23 4.64 -1.05 -2.78 113.55 121.42 1sd3 h SER 164 Ca 0.37 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.63 1sd3 h SER 164 Cb 0.26 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.22 1sd3 h SER 164 CO -0.21 0.00 -0.65 0.54 -0.87 0.00 0.00 176.83 175.64 1sd3 n ARG 165 N -2.90 1.00 -0.38 4.77 1.74 -0.49 -4.93 116.66 115.47 1sd3 n ARG 165 Ca 0.00 -2.77 -0.03 0.00 -0.77 0.00 0.00 57.85 54.28 1sd3 n ARG 165 Cb 0.24 -1.04 0.01 0.00 -1.02 0.00 0.00 32.46 30.65 1sd3 n ARG 165 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1sd3 n ARG 166 N -0.57 -0.27 0.26 5.56 0.63 0.12 -0.73 116.66 121.66 1sd3 n ARG 166 Ca 0.14 1.49 0.13 0.00 -0.92 0.00 0.00 57.85 58.69 1sd3 n ARG 166 Cb 0.84 -2.21 0.71 0.00 0.45 0.00 0.00 32.46 32.25 1sd3 n ARG 166 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1sd3 h GLN 167 N 0.00 0.00 0.00 -0.14 4.20 -1.87 -1.28 115.11 116.02 1sd3 h GLN 167 Ca 0.30 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.80 1sd3 h GLN 167 Cb 0.54 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 1sd3 h GLN 167 CO -0.96 0.12 -1.68 0.43 -0.67 0.00 0.00 178.83 176.08 1sd3 n SER 168 N -3.61 0.65 -0.01 1.46 7.64 0.09 -4.61 113.62 115.22 1sd3 n SER 168 Ca -0.02 0.29 0.03 0.00 1.01 0.00 0.00 58.87 60.19 1sd3 n SER 168 Cb 0.25 0.40 -0.08 0.00 -1.01 0.00 0.00 64.21 63.77 1sd3 n SER 168 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1sd3 n VAL 169 N -2.85 0.14 -3.03 0.44 0.24 -0.26 -4.95 118.33 108.06 1sd3 n VAL 169 Ca -0.14 -0.26 -0.40 0.00 -2.04 0.00 0.00 64.34 61.49 1sd3 n VAL 169 Cb 0.91 0.05 -0.05 0.00 -1.47 0.00 0.00 33.84 33.29 1sd3 n VAL 169 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1sd3 s LEU 170 N -3.91 4.30 0.42 1.34 1.43 -0.49 -3.78 118.68 117.99 1sd3 s LEU 170 Ca -0.04 1.18 0.07 0.00 -1.03 0.00 0.00 54.13 54.31 1sd3 s LEU 170 Cb 0.06 -3.09 -0.03 0.00 0.03 0.00 0.00 46.19 43.16 1sd3 s LEU 170 CO 0.41 -0.15 0.33 0.68 0.23 0.00 0.00 176.35 177.85 1sd3 s VAL 171 N 0.97 2.52 -0.87 -1.59 -7.23 -0.53 -4.80 120.40 108.87 1sd3 s VAL 171 Ca 0.37 -1.44 0.25 0.00 -1.81 0.00 0.00 61.98 59.35 1sd3 s VAL 171 Cb -0.18 -2.96 0.06 0.00 0.56 0.00 0.00 36.38 33.87 1sd3 s VAL 171 CO 0.17 0.00 1.47 0.29 -0.31 0.00 0.00 175.10 176.72 1sd3 n LYS 172 N -1.48 0.11 -3.60 4.82 4.76 -1.26 -0.07 118.16 121.44 1sd3 n LYS 172 Ca 0.02 0.04 -0.09 0.00 -2.87 0.00 0.00 58.31 55.41 1sd3 n LYS 172 Cb 0.63 -1.57 -0.02 0.00 -1.84 0.00 0.00 35.03 32.22 1sd3 n LYS 172 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1sd3 s SER 173 N -3.46 -0.38 0.23 4.39 1.04 -1.26 -4.82 113.70 109.43 1sd3 s SER 173 Ca 0.10 -0.22 -0.08 0.00 0.48 0.00 0.00 55.95 56.24 1sd3 s SER 173 Cb 0.16 0.56 0.20 0.00 0.10 0.00 0.00 66.02 67.05 1sd3 s SER 173 CO 0.68 -0.97 1.87 0.78 0.98 0.00 0.00 173.24 176.57 1sd3 h ASN 174 N 2.00 1.07 -0.63 7.02 2.35 -1.96 -1.94 115.58 123.49 1sd3 h ASN 174 Ca -0.26 -0.08 0.07 0.00 -0.55 0.00 0.00 56.30 55.49 1sd3 h ASN 174 Cb 1.27 -0.27 -0.06 0.00 0.05 0.00 0.00 38.32 39.30 1sd3 h ASN 174 CO 0.31 0.83 0.30 -0.08 -1.65 0.00 0.00 177.43 177.14 1sd3 h GLU 175 N 1.22 0.53 -0.73 0.81 4.81 -1.99 0.12 114.58 119.35 1sd3 h GLU 175 Ca 0.31 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.46 1sd3 h GLU 175 Cb -0.03 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1sd3 h GLU 175 CO -0.06 0.35 0.27 1.49 -0.73 0.00 0.00 179.01 180.33 1sd3 h GLU 176 N 0.54 1.11 -0.55 1.92 4.81 -1.82 -2.36 114.58 118.24 1sd3 h GLU 176 Ca 0.30 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1sd3 h GLU 176 Cb 0.28 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1sd3 h GLU 176 CO -0.23 0.93 0.27 0.78 -0.73 0.00 0.00 179.01 180.03 1sd3 h GLY 177 N 1.06 0.84 1.00 1.92 0.00 -0.43 -0.66 103.07 106.80 1sd3 h GLY 177 Ca 0.24 -0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.17 1sd3 h GLY 177 CO -0.01 0.39 0.58 -2.22 0.00 0.00 0.00 176.54 175.27 1sd3 h ILE 178 N 0.73 1.22 -0.39 2.60 2.04 -0.57 -1.00 117.51 122.14 1sd3 h ILE 178 Ca 0.19 -0.40 -0.12 0.00 1.00 0.00 0.00 64.86 65.53 1sd3 h ILE 178 Cb 0.10 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 1sd3 h ILE 178 CO -0.03 0.21 -0.23 1.56 0.00 0.00 0.00 178.15 179.67 1sd3 h GLN 179 N 1.17 0.79 -0.16 2.37 1.08 -1.16 -1.66 115.11 117.54 1sd3 h GLN 179 Ca 0.32 -0.32 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1sd3 h GLN 179 Cb -0.13 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 1sd3 h GLN 179 CO -0.07 0.94 0.02 -0.09 -0.95 0.00 0.00 178.83 178.68 1sd3 h ARG 180 N 0.68 0.22 0.10 1.46 9.65 -0.30 -1.37 114.38 124.82 1sd3 h ARG 180 Ca 0.09 -0.03 -0.27 0.00 -1.10 0.00 0.00 59.98 58.68 1sd3 h ARG 180 Cb 0.75 -0.04 0.01 0.00 -1.39 0.00 0.00 29.97 29.30 1sd3 h ARG 180 CO 0.06 0.23 -1.16 0.28 2.80 0.00 0.00 179.97 182.17 1sd3 h VAL 181 N 0.22 1.40 0.00 0.20 2.07 -0.73 -2.92 116.25 116.49 1sd3 h VAL 181 Ca 0.06 -2.70 0.00 0.00 0.82 0.00 0.00 66.70 64.88 1sd3 h VAL 181 Cb 0.12 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 1sd3 h VAL 181 CO -0.00 0.80 0.00 0.18 0.02 0.00 0.00 177.57 178.57 1sd3 n LEU 182 N -3.67 0.32 0.00 2.57 4.77 -0.67 -3.99 117.00 116.33 1sd3 n LEU 182 Ca -0.10 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1sd3 n LEU 182 Cb 0.96 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1sd3 n LEU 182 CO 0.54 -0.09 0.33 0.35 -1.33 0.00 0.00 177.39 177.20 1sd3 n THR 183 N -1.80 0.41 -3.65 -5.08 -2.24 -0.57 -5.08 114.28 96.26 1sd3 n THR 183 Ca 0.06 -0.63 -0.07 0.00 -2.27 0.00 0.00 64.05 61.14 1sd3 n THR 183 Cb 0.36 0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 69.45 1sd3 n THR 183 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1sd3 s SER 184 N -0.41 -0.32 -1.12 3.42 1.04 -1.10 -5.05 113.70 110.15 1sd3 s SER 184 Ca 0.00 -0.27 -0.22 0.00 0.48 0.00 0.00 55.95 55.93 1sd3 s SER 184 Cb 0.00 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 1sd3 s SER 184 CO 0.00 -0.95 1.87 -0.62 0.98 0.00 0.00 173.24 174.52 1sd3 s ASP 185 N -2.79 5.44 -0.05 7.02 -1.08 -1.26 -4.59 116.67 119.35 1sd3 s ASP 185 Ca 0.08 -1.53 -0.04 0.00 -0.52 0.00 0.00 52.55 50.55 1sd3 s ASP 185 Cb -0.02 -2.58 0.02 0.00 -1.46 0.00 0.00 42.92 38.88 1sd3 s ASP 185 CO -0.02 -2.59 0.13 -0.47 0.52 0.00 0.00 175.17 172.74 1sd3 s TYR 186 N 9.31 -0.15 -0.09 -5.34 5.04 -1.26 -2.41 117.35 122.45 1sd3 s TYR 186 Ca 0.65 0.40 -0.01 0.00 -2.44 0.00 0.00 57.07 55.67 1sd3 s TYR 186 Cb -0.01 -0.02 -0.03 0.00 0.35 0.00 0.00 41.96 42.25 1sd3 s TYR 186 CO 0.07 -0.11 -0.05 0.00 -1.34 0.00 0.00 175.55 174.12 1sd3 s ALA 187 N 0.58 3.03 -0.14 3.97 0.00 0.47 -4.45 121.76 125.21 1sd3 s ALA 187 Ca -0.04 -0.86 -0.00 0.00 0.00 0.00 0.00 51.96 51.06 1sd3 s ALA 187 Cb -0.06 -1.34 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 1sd3 s ALA 187 CO -0.03 0.49 -0.13 0.12 0.00 0.00 0.00 175.76 176.21 1sd3 s PHE 188 N -0.55 2.81 -0.44 0.00 5.36 -0.13 -2.34 117.98 122.69 1sd3 s PHE 188 Ca 0.08 -0.80 -0.24 0.00 -0.96 0.00 0.00 56.93 55.02 1sd3 s PHE 188 Cb -0.12 -1.87 0.02 0.00 -0.34 0.00 0.00 43.02 40.71 1sd3 s PHE 188 CO 0.02 -0.32 0.84 -0.51 -1.46 0.00 0.00 175.22 173.79 1sd3 s LEU 189 N 0.57 4.14 0.21 6.12 2.01 0.08 -0.16 118.68 131.65 1sd3 s LEU 189 Ca -0.08 0.04 -0.03 0.00 0.01 0.00 0.00 54.13 54.07 1sd3 s LEU 189 Cb -0.16 -3.07 -0.03 0.00 0.01 0.00 0.00 46.19 42.94 1sd3 s LEU 189 CO 0.03 -0.95 0.20 0.00 1.01 0.00 0.00 176.35 176.65 1sd3 s MET 190 N 3.45 1.27 0.22 1.70 0.23 -0.62 -4.53 119.30 121.02 1sd3 s MET 190 Ca 0.33 -1.55 -0.30 0.00 -1.03 0.00 0.00 55.69 53.15 1sd3 s MET 190 Cb -0.11 0.31 -0.08 0.00 -1.53 0.00 0.00 34.83 33.41 1sd3 s MET 190 CO 0.23 -0.44 1.15 -1.21 -2.03 0.00 0.00 175.02 172.72 1sd3 s GLU 191 N -4.13 4.55 0.31 3.16 2.02 -1.26 -0.81 118.70 122.54 1sd3 s GLU 191 Ca 0.35 1.83 0.07 0.00 0.02 0.00 0.00 54.97 57.24 1sd3 s GLU 191 Cb 0.05 -3.23 0.79 0.00 0.10 0.00 0.00 34.13 31.85 1sd3 s GLU 191 CO 0.11 0.04 1.76 0.66 0.02 0.00 0.00 175.26 177.85 1sd3 h SER 192 N 4.70 0.73 -0.38 -0.19 4.64 -1.00 -1.11 113.55 120.93 1sd3 h SER 192 Ca -0.45 0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 60.95 1sd3 h SER 192 Cb 1.21 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.27 1sd3 h SER 192 CO 0.71 0.20 0.14 0.71 -0.87 0.00 0.00 176.83 177.73 1sd3 h THR 193 N 0.69 1.18 0.18 2.95 1.35 -1.90 -0.12 112.91 117.25 1sd3 h THR 193 Ca 0.60 -0.62 -0.30 0.00 -0.55 0.00 0.00 66.41 65.54 1sd3 h THR 193 Cb 1.02 0.70 0.02 0.00 -1.73 0.00 0.00 68.15 68.16 1sd3 h THR 193 CO -0.42 0.23 -1.35 0.74 -0.25 0.00 0.00 175.52 174.48 1sd3 h THR 194 N 0.64 1.41 -0.69 6.82 2.02 -1.64 -3.09 112.91 118.38 1sd3 h THR 194 Ca 0.15 -2.90 0.04 0.00 0.77 0.00 0.00 66.41 64.47 1sd3 h THR 194 Cb 0.19 2.99 -0.05 0.00 -1.74 0.00 0.00 68.15 69.54 1sd3 h THR 194 CO -0.01 0.86 0.41 0.40 0.37 0.00 0.00 175.52 177.55 1sd3 h ILE 195 N 0.11 1.04 -0.69 3.11 2.04 -0.92 -0.20 117.51 121.99 1sd3 h ILE 195 Ca -0.19 -0.27 0.09 0.00 1.00 0.00 0.00 64.86 65.50 1sd3 h ILE 195 Cb 2.06 0.18 -0.07 0.00 -0.74 0.00 0.00 36.82 38.25 1sd3 h ILE 195 CO 0.24 0.14 0.33 -0.08 0.00 0.00 0.00 178.15 178.78 1sd3 h GLU 196 N 0.78 0.54 -0.39 2.37 4.81 -1.04 0.48 114.58 122.14 1sd3 h GLU 196 Ca 0.29 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.40 1sd3 h GLU 196 Cb 0.10 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1sd3 h GLU 196 CO -0.14 0.36 -0.11 0.35 -0.73 0.00 0.00 179.01 178.74 1sd3 h PHE 197 N 0.56 0.86 -0.04 0.92 3.57 -1.21 -3.09 116.94 118.50 1sd3 h PHE 197 Ca 0.34 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1sd3 h PHE 197 Cb 0.38 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 1sd3 h PHE 197 CO -0.12 0.90 -0.00 0.28 -2.23 0.00 0.00 178.31 177.14 1sd3 h VAL 198 N 0.57 1.27 -0.07 1.41 2.07 -0.39 -3.19 116.25 117.91 1sd3 h VAL 198 Ca 0.10 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1sd3 h VAL 198 Cb 0.63 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1sd3 h VAL 198 CO 0.04 0.22 -0.03 0.71 0.02 0.00 0.00 177.57 178.53 1sd3 h THR 199 N -0.25 1.07 0.00 2.57 1.35 -1.01 0.70 112.91 117.33 1sd3 h THR 199 Ca 0.01 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1sd3 h THR 199 Cb 0.36 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.83 1sd3 h THR 199 CO 0.00 0.09 0.00 0.00 -0.25 0.00 0.00 175.52 175.36 1sd3 n GLN 200 N -4.45 0.13 0.00 4.72 6.02 -1.17 -3.08 117.38 119.56 1sd3 n GLN 200 Ca -0.02 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1sd3 n GLN 200 Cb 0.15 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 29.69 1sd3 n GLN 200 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1sd3 n ARG 201 N -1.96 -0.80 -3.42 -1.09 1.74 -0.29 -4.83 116.66 106.02 1sd3 n ARG 201 Ca 0.04 -0.51 -0.28 0.00 -0.77 0.00 0.00 57.85 56.33 1sd3 n ARG 201 Cb 0.26 -0.97 -0.11 0.00 -1.02 0.00 0.00 32.46 30.62 1sd3 n ARG 201 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1sd3 s ASN 202 N -0.04 2.04 0.09 0.55 0.01 0.08 -5.00 114.94 112.68 1sd3 s ASN 202 Ca 0.00 -2.66 0.06 0.00 -0.71 0.00 0.00 52.86 49.55 1sd3 s ASN 202 Cb 0.00 -0.39 0.31 0.00 0.41 0.00 0.00 41.25 41.59 1sd3 s ASN 202 CO 0.00 -0.23 1.16 0.00 -1.51 0.00 0.00 177.10 176.52 1sd3 n ASN 204 N -1.69 0.60 -4.95 0.00 3.02 -1.26 -4.91 115.26 106.07 1sd3 n ASN 204 Ca -0.00 -0.04 -0.21 0.00 -0.03 0.00 0.00 54.58 54.29 1sd3 n ASN 204 Cb 0.03 0.25 -0.02 0.00 -0.61 0.00 0.00 39.78 39.43 1sd3 n ASN 204 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1sd3 s LEU 205 N -3.71 4.13 0.13 3.41 1.43 -0.13 -0.78 118.68 123.16 1sd3 s LEU 205 Ca 0.08 -0.06 -0.24 0.00 -1.03 0.00 0.00 54.13 52.87 1sd3 s LEU 205 Cb 0.15 -2.73 0.07 0.00 0.03 0.00 0.00 46.19 43.72 1sd3 s LEU 205 CO 0.72 -0.15 0.63 0.28 0.23 0.00 0.00 176.35 178.05 1sd3 s THR 206 N -2.06 0.00 0.32 5.49 -1.32 -0.04 -4.76 115.64 113.28 1sd3 s THR 206 Ca 0.36 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.59 1sd3 s THR 206 Cb -0.09 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.80 1sd3 s THR 206 CO 0.29 0.00 0.94 -1.58 -2.21 0.00 0.00 174.62 172.05 1sd3 s GLN 207 N -3.42 4.57 -0.23 7.08 0.74 -1.26 -1.84 119.66 125.29 1sd3 s GLN 207 Ca -0.00 1.31 -0.04 0.00 0.05 0.00 0.00 55.36 56.68 1sd3 s GLN 207 Cb -0.01 -2.79 -0.00 0.00 1.10 0.00 0.00 33.01 31.30 1sd3 s GLN 207 CO -0.10 0.28 -0.04 0.42 -0.55 0.00 0.00 175.29 175.30 1sd3 s ILE 208 N -1.62 3.35 0.00 -2.34 -1.09 0.11 -4.93 121.20 114.68 1sd3 s ILE 208 Ca 0.50 -0.57 0.00 0.00 -2.23 0.00 0.00 60.65 58.35 1sd3 s ILE 208 Cb -0.18 -2.56 0.00 0.00 -1.58 0.00 0.00 42.46 38.14 1sd3 s ILE 208 CO 0.23 0.37 0.00 0.61 -1.23 0.00 0.00 174.94 174.93 1sd3 n GLY 209 N 4.79 -1.20 0.00 6.18 0.00 -1.21 -3.77 105.19 109.97 1sd3 n GLY 209 Ca -0.18 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1sd3 n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sd3 n GLY 210 N 0.00 3.10 3.73 -0.02 0.00 -1.26 -4.92 105.19 105.82 1sd3 n GLY 210 Ca 0.00 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 1sd3 n GLY 210 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sd3 s LEU 211 N 0.00 4.38 0.37 0.99 1.43 -1.26 -4.63 118.68 119.96 1sd3 s LEU 211 Ca 0.00 1.32 0.21 0.00 -1.03 0.00 0.00 54.13 54.63 1sd3 s LEU 211 Cb 0.00 -3.17 0.23 0.00 0.03 0.00 0.00 46.19 43.29 1sd3 s LEU 211 CO 0.00 -0.07 1.51 0.40 0.23 0.00 0.00 176.35 178.43 1sd3 h ILE 212 N 4.49 0.24 -2.99 -0.59 2.04 -0.52 -3.48 117.51 116.70 1sd3 h ILE 212 Ca -0.42 -1.35 -0.04 0.00 1.00 0.00 0.00 64.86 64.05 1sd3 h ILE 212 Cb 1.20 2.08 0.01 0.00 -0.74 0.00 0.00 36.82 39.37 1sd3 h ILE 212 CO 0.73 0.14 0.24 -0.90 0.00 0.00 0.00 178.15 178.36 1sd3 n ASP 213 N -3.10 -2.15 -3.98 1.72 5.75 -1.26 -4.93 116.55 108.60 1sd3 n ASP 213 Ca 0.03 -2.53 -0.19 0.00 -0.01 0.00 0.00 54.79 52.09 1sd3 n ASP 213 Cb 0.59 3.60 -0.15 0.00 -1.03 0.00 0.00 41.12 44.13 1sd3 n ASP 213 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1sd3 s SER 214 N -2.98 1.00 0.34 -1.12 0.15 -1.26 -3.89 113.70 105.94 1sd3 s SER 214 Ca 0.16 -0.15 -0.14 0.00 0.70 0.00 0.00 55.95 56.52 1sd3 s SER 214 Cb -0.05 -0.25 0.05 0.00 -1.71 0.00 0.00 66.02 64.07 1sd3 s SER 214 CO 0.12 0.05 0.73 2.29 1.20 0.00 0.00 173.24 177.63 1sd3 n LYS 215 N 3.27 0.97 -4.12 5.44 2.85 -0.20 -4.99 118.16 121.40 1sd3 n LYS 215 Ca -0.18 -1.92 -0.09 0.00 -1.05 0.00 0.00 58.31 55.07 1sd3 n LYS 215 Cb 0.55 2.42 -0.10 0.00 -0.65 0.00 0.00 35.03 37.25 1sd3 n LYS 215 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1sd3 s GLY 216 N -2.88 0.80 -0.12 2.58 0.00 -1.26 -1.06 107.32 105.37 1sd3 s GLY 216 Ca 0.15 -1.35 -0.07 0.00 0.00 0.00 0.00 44.72 43.45 1sd3 s GLY 216 CO 0.10 -1.31 0.13 -0.19 0.00 0.00 0.00 173.10 171.84 1sd3 s TYR 217 N -4.01 3.57 0.13 1.90 4.12 -0.06 -0.73 117.35 122.28 1sd3 s TYR 217 Ca 0.19 0.51 -0.04 0.00 0.02 0.00 0.00 57.07 57.75 1sd3 s TYR 217 Cb 0.07 -1.95 -0.03 0.00 -1.52 0.00 0.00 41.96 38.54 1sd3 s TYR 217 CO -0.02 0.70 0.12 0.20 0.02 0.00 0.00 175.55 176.57 1sd3 s GLY 218 N -0.95 0.76 0.03 0.71 0.00 -0.61 -0.59 107.32 106.67 1sd3 s GLY 218 Ca 0.15 -1.24 -0.28 0.00 0.00 0.00 0.00 44.72 43.34 1sd3 s GLY 218 CO 0.04 -1.19 0.90 0.14 0.00 0.00 0.00 173.10 172.99 1sd3 s VAL 219 N -4.00 4.76 0.10 1.40 1.01 -1.26 -4.38 120.40 118.01 1sd3 s VAL 219 Ca 0.20 1.92 -0.05 0.00 0.00 0.00 0.00 61.98 64.04 1sd3 s VAL 219 Cb 0.06 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 1sd3 s VAL 219 CO -0.00 0.25 0.34 -0.83 0.00 0.00 0.00 175.10 174.86 1sd3 s GLY 220 N 0.50 2.25 0.07 4.51 0.00 -0.45 -1.39 107.32 112.82 1sd3 s GLY 220 Ca 0.46 -0.56 -0.03 0.00 0.00 0.00 0.00 44.72 44.59 1sd3 s GLY 220 CO 0.26 -0.45 0.03 -0.51 0.00 0.00 0.00 173.10 172.44 1sd3 s THR 221 N -1.53 0.19 0.64 0.90 -4.23 -0.42 -1.02 115.64 110.18 1sd3 s THR 221 Ca 0.36 -1.65 -0.17 0.00 -1.18 0.00 0.00 61.69 59.04 1sd3 s THR 221 Cb -0.13 -1.51 -0.01 0.00 1.34 0.00 0.00 72.50 72.19 1sd3 s THR 221 CO 0.22 -0.87 1.22 -2.84 -0.54 0.00 0.00 174.62 171.81 1sd3 s PRO 222 N -3.91 2.66 0.30 3.99 0.02 -1.26 -1.66 135.00 135.13 1sd3 s PRO 222 Ca 0.08 1.83 -0.29 0.00 0.02 0.00 0.00 61.00 62.63 1sd3 s PRO 222 Cb 0.07 -1.89 -0.12 0.00 0.02 0.00 0.00 34.50 32.58 1sd3 s PRO 222 CO -0.09 -1.45 1.39 -0.12 -0.33 0.00 0.00 177.00 176.39 1sd3 n MET 223 N -2.00 2.23 -0.38 5.54 1.56 -1.26 -1.76 117.12 121.05 1sd3 n MET 223 Ca 0.14 0.79 0.00 0.00 -0.27 0.00 0.00 57.70 58.36 1sd3 n MET 223 Cb 0.50 -2.44 0.00 0.00 2.15 0.00 0.00 33.22 33.43 1sd3 n MET 223 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1sd3 n GLY 224 N 1.41 1.72 3.71 -5.12 0.00 -1.26 -4.96 105.19 100.69 1sd3 n GLY 224 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1sd3 n GLY 224 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sd3 n SER 225 N 0.00 3.54 0.04 1.61 2.88 -0.72 -4.87 113.62 116.11 1sd3 n SER 225 Ca 0.00 1.12 0.08 0.00 -1.33 0.00 0.00 58.87 58.74 1sd3 n SER 225 Cb 0.00 -1.53 0.36 0.00 -0.75 0.00 0.00 64.21 62.29 1sd3 n SER 225 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1sd3 n PRO 226 N 2.68 0.06 0.16 -1.46 -0.04 -1.26 -2.67 135.00 132.46 1sd3 n PRO 226 Ca 0.12 0.31 0.04 0.00 -0.04 0.00 0.00 63.50 63.93 1sd3 n PRO 226 Cb 0.34 -1.62 0.05 0.00 -0.04 0.00 0.00 33.50 32.23 1sd3 n PRO 226 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1sd3 h TYR 227 N 0.00 0.00 0.02 0.54 0.05 -1.96 -3.37 116.97 112.24 1sd3 h TYR 227 Ca 0.00 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.81 1sd3 h TYR 227 Cb 0.28 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.98 1sd3 h TYR 227 CO 0.00 0.40 -0.24 -0.09 -1.05 0.00 0.00 178.16 177.18 1sd3 h ARG 228 N 0.00 -0.37 -0.06 4.88 1.12 -1.90 0.58 114.38 118.64 1sd3 h ARG 228 Ca -0.00 0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 58.80 1sd3 h ARG 228 Cb 1.31 0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 31.34 1sd3 h ARG 228 CO 0.05 -0.24 -0.37 -0.44 -3.11 0.00 0.00 179.97 175.86 1sd3 h ASP 229 N -0.38 0.12 -0.46 -3.80 3.32 -1.80 -1.77 116.42 111.64 1sd3 h ASP 229 Ca 0.06 -0.04 -0.12 0.00 0.02 0.00 0.00 57.03 56.94 1sd3 h ASP 229 Cb 0.45 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1sd3 h ASP 229 CO -0.20 0.49 -0.19 0.11 -1.72 0.00 0.00 179.24 177.73 1sd3 h LYS 230 N 0.10 0.95 -0.24 3.56 1.57 -1.61 -2.30 116.57 118.60 1sd3 h LYS 230 Ca 0.01 -0.40 -0.11 0.00 -1.87 0.00 0.00 60.65 58.29 1sd3 h LYS 230 Cb 0.71 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1sd3 h LYS 230 CO 0.05 1.06 -0.30 0.82 -0.57 0.00 0.00 179.45 180.51 1sd3 h ILE 231 N 0.79 1.28 -0.67 1.86 2.04 -0.62 -2.06 117.51 120.13 1sd3 h ILE 231 Ca 0.11 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 1sd3 h ILE 231 Cb 0.76 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 1sd3 h ILE 231 CO 0.06 0.43 0.35 0.74 0.00 0.00 0.00 178.15 179.73 1sd3 h THR 232 N 0.43 1.22 -0.67 -0.27 2.02 -1.12 0.04 112.91 114.56 1sd3 h THR 232 Ca 0.05 -0.56 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 1sd3 h THR 232 Cb 0.74 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1sd3 h THR 232 CO 0.06 0.24 0.35 0.40 0.37 0.00 0.00 175.52 176.94 1sd3 h ILE 233 N 0.92 1.21 -0.41 3.11 2.04 -1.03 -1.05 117.51 122.31 1sd3 h ILE 233 Ca 0.23 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1sd3 h ILE 233 Cb 0.07 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 1sd3 h ILE 233 CO -0.03 0.24 0.14 0.00 0.00 0.00 0.00 178.15 178.50 1sd3 h ALA 234 N 1.17 0.53 -0.44 1.87 0.00 -0.90 -2.17 119.26 119.32 1sd3 h ALA 234 Ca 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1sd3 h ALA 234 Cb 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1sd3 h ALA 234 CO -0.04 0.16 0.17 0.82 0.00 0.00 0.00 179.25 180.37 1sd3 h ILE 235 N 0.52 1.21 -0.45 0.00 2.04 -0.73 -1.48 117.51 118.62 1sd3 h ILE 235 Ca 0.13 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 1sd3 h ILE 235 Cb 0.23 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1sd3 h ILE 235 CO -0.01 0.24 0.15 -0.07 0.00 0.00 0.00 178.15 178.46 1sd3 h LEU 236 N 0.57 0.59 -0.26 1.44 3.38 -1.13 0.82 115.31 120.72 1sd3 h LEU 236 Ca 0.15 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1sd3 h LEU 236 Cb 0.20 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1sd3 h LEU 236 CO -0.01 0.56 -0.05 -0.61 0.09 0.00 0.00 178.44 178.42 1sd3 h GLN 237 N 0.64 0.50 -0.53 1.13 4.15 -1.01 -0.42 115.11 119.57 1sd3 h GLN 237 Ca 0.15 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.35 1sd3 h GLN 237 Cb 0.18 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.81 1sd3 h GLN 237 CO -0.01 0.71 0.20 -0.07 -1.93 0.00 0.00 178.83 177.73 1sd3 h LEU 238 N 0.26 0.71 0.06 -2.39 3.38 -0.76 -1.86 115.31 114.71 1sd3 h LEU 238 Ca 0.07 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1sd3 h LEU 238 Cb 0.51 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1sd3 h LEU 238 CO 0.02 0.65 -0.03 -0.61 0.09 0.00 0.00 178.44 178.56 1sd3 h GLN 239 N 0.76 -0.08 -0.96 1.13 5.75 -0.65 -0.31 115.11 120.76 1sd3 h GLN 239 Ca 0.18 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.72 1sd3 h GLN 239 Cb 0.17 0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.69 1sd3 h GLN 239 CO -0.02 0.31 0.63 1.49 -2.65 0.00 0.00 178.83 178.59 1sd3 h GLU 240 N -0.49 1.20 0.00 1.69 4.81 -0.89 -1.55 114.58 119.35 1sd3 h GLU 240 Ca -0.01 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1sd3 h GLU 240 Cb 0.43 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1sd3 h GLU 240 CO 0.01 0.79 0.00 -0.85 -0.73 0.00 0.00 179.01 178.24 1sd3 n GLU 241 N -4.43 0.58 -0.75 1.92 0.28 -0.72 -4.89 120.64 112.63 1sd3 n GLU 241 Ca 0.12 0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1sd3 n GLU 241 Cb 0.08 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.45 1sd3 n GLU 241 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1sd3 n GLY 242 N 1.08 0.75 0.32 -1.84 0.00 -0.58 -4.94 105.19 99.97 1sd3 n GLY 242 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1sd3 n GLY 242 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1sd3 h LYS 243 N 2.63 1.13 -0.34 1.61 1.63 -1.28 -1.56 116.57 120.38 1sd3 h LYS 243 Ca 0.00 -0.29 -0.05 0.00 -0.85 0.00 0.00 60.65 59.46 1sd3 h LYS 243 Cb 0.00 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.47 1sd3 h LYS 243 CO 0.00 1.01 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.94 1sd3 h LEU 244 N 1.06 0.51 -0.48 5.20 3.38 -1.79 0.10 115.31 123.29 1sd3 h LEU 244 Ca 0.21 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1sd3 h LEU 244 Cb 0.42 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1sd3 h LEU 244 CO 0.01 0.58 -0.32 -0.74 0.09 0.00 0.00 178.44 178.07 1sd3 h HIS 245 N 0.52 1.08 -0.67 1.13 2.76 -1.77 -1.74 115.15 116.45 1sd3 h HIS 245 Ca 0.11 -0.29 -0.08 0.00 -2.20 0.00 0.00 60.37 57.90 1sd3 h HIS 245 Cb 0.35 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.04 1sd3 h HIS 245 CO 0.01 1.11 0.10 1.98 -1.30 0.00 0.00 177.93 179.83 1sd3 h MET 246 N 0.77 1.12 -0.49 5.26 1.85 -0.69 -1.87 114.93 120.87 1sd3 h MET 246 Ca 0.08 -0.30 -0.09 0.00 -0.61 0.00 0.00 59.70 58.78 1sd3 h MET 246 Cb 0.89 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 32.77 1sd3 h MET 246 CO 0.08 1.02 -0.06 0.52 -0.40 0.00 0.00 176.91 178.08 1sd3 h MET 247 N 1.04 0.87 -0.29 0.39 2.07 -0.85 -1.30 114.93 116.87 1sd3 h MET 247 Ca 0.20 -0.27 -0.02 0.00 -2.07 0.00 0.00 59.70 57.54 1sd3 h MET 247 Cb 0.45 -0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 30.09 1sd3 h MET 247 CO 0.01 0.90 0.08 -0.22 1.07 0.00 0.00 176.91 178.76 1sd3 h LYS 248 N 0.79 0.45 -0.79 1.72 1.63 -1.01 -2.33 116.57 117.04 1sd3 h LYS 248 Ca 0.14 -0.10 -0.04 0.00 -0.85 0.00 0.00 60.65 59.80 1sd3 h LYS 248 Cb 0.55 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 1sd3 h LYS 248 CO 0.03 0.52 0.35 0.93 -3.45 0.00 0.00 179.45 177.83 1sd3 h GLU 249 N 0.30 1.16 -0.38 1.90 4.39 -1.17 -0.91 114.58 119.86 1sd3 h GLU 249 Ca 0.09 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 1sd3 h GLU 249 Cb 0.26 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1sd3 h GLU 249 CO -0.00 0.91 0.23 -0.22 -1.16 0.00 0.00 179.01 178.77 1sd3 h LYS 250 N 1.13 0.52 0.00 2.33 3.64 -1.08 -0.90 116.57 122.22 1sd3 h LYS 250 Ca 0.27 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1sd3 h LYS 250 Cb 0.16 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1sd3 h LYS 250 CO -0.03 0.40 -0.56 0.91 -2.27 0.00 0.00 179.45 177.90 1sd3 n TRP 251 N -4.77 0.54 -0.12 1.91 7.02 -0.89 -4.43 117.44 116.70 1sd3 n TRP 251 Ca -0.00 0.16 -0.25 0.00 -1.02 0.00 0.00 57.50 56.38 1sd3 n TRP 251 Cb 0.06 -0.65 -0.08 0.00 -2.42 0.00 0.00 31.31 28.21 1sd3 n TRP 251 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1sd3 n TRP 252 N -2.08 0.00 -0.22 -5.99 8.01 -0.36 -4.83 117.44 111.97 1sd3 n TRP 252 Ca 0.04 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.23 1sd3 n TRP 252 Cb 0.43 -0.86 0.00 0.00 -2.01 0.00 0.00 31.31 28.87 1sd3 n TRP 252 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.69 179.57