#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 3.44 0.41 3.52 1.70 -1.26 -4.97 118.95 121.79 1sd3 s ARG 4 Ca 0.00 0.83 -0.25 0.00 -0.47 0.00 0.00 55.73 55.84 1sd3 s ARG 4 Cb 0.00 -2.06 -0.08 0.00 -0.57 0.00 0.00 34.95 32.24 1sd3 s ARG 4 CO 0.00 -0.70 1.17 -1.54 -1.08 0.00 0.00 175.30 173.15 1sd3 s SER 5 N -3.97 6.48 0.37 -2.89 1.04 -1.26 -4.76 113.70 108.70 1sd3 s SER 5 Ca 0.56 2.33 -0.21 0.00 0.48 0.00 0.00 55.95 59.12 1sd3 s SER 5 Cb -0.12 -2.61 -0.10 0.00 0.10 0.00 0.00 66.02 63.29 1sd3 s SER 5 CO 0.52 -0.71 0.89 -0.76 0.98 0.00 0.00 173.24 174.17 1sd3 s LEU 6 N -2.57 4.10 -0.30 2.42 1.43 0.24 -4.85 118.68 119.15 1sd3 s LEU 6 Ca 0.58 1.63 -0.14 0.00 -1.03 0.00 0.00 54.13 55.17 1sd3 s LEU 6 Cb -0.30 -4.24 -0.03 0.00 0.03 0.00 0.00 46.19 41.64 1sd3 s LEU 6 CO 0.38 -0.23 0.30 -0.63 0.23 0.00 0.00 176.35 176.40 1sd3 s ILE 7 N -1.95 5.23 -0.25 -0.59 -1.09 -1.26 -1.04 121.20 120.25 1sd3 s ILE 7 Ca 0.56 0.23 -0.06 0.00 -2.23 0.00 0.00 60.65 59.15 1sd3 s ILE 7 Cb -0.12 -3.68 -0.01 0.00 -1.58 0.00 0.00 42.46 37.07 1sd3 s ILE 7 CO 0.17 0.11 0.03 -0.69 -1.23 0.00 0.00 174.94 173.33 1sd3 s VAL 8 N 1.92 3.88 0.13 2.92 1.01 -0.21 -0.13 120.40 129.92 1sd3 s VAL 8 Ca 0.11 -0.45 -0.11 0.00 0.00 0.00 0.00 61.98 61.53 1sd3 s VAL 8 Cb -0.16 -2.86 -0.06 0.00 0.00 0.00 0.00 36.38 33.29 1sd3 s VAL 8 CO 0.11 0.29 0.49 0.28 0.00 0.00 0.00 175.10 176.26 1sd3 s THR 9 N 1.53 4.97 0.19 3.92 -1.32 0.56 -0.45 115.64 125.04 1sd3 s THR 9 Ca 0.05 0.59 -0.05 0.00 -1.21 0.00 0.00 61.69 61.07 1sd3 s THR 9 Cb -0.15 -3.68 0.02 0.00 -1.51 0.00 0.00 72.50 67.18 1sd3 s THR 9 CO 0.01 0.20 0.34 1.07 -2.21 0.00 0.00 174.62 174.03 1sd3 n THR 10 N 0.66 0.00 -3.88 5.08 5.66 -0.28 -1.85 114.28 119.68 1sd3 n THR 10 Ca -0.05 -0.65 -0.11 0.00 -3.05 0.00 0.00 64.05 60.19 1sd3 n THR 10 Cb 0.52 0.52 -0.11 0.00 -1.55 0.00 0.00 70.33 69.71 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 -2.58 0.06 -0.07 1.09 2.07 -1.26 -0.86 121.20 119.66 1sd3 s ILE 11 Ca 0.11 -0.53 -0.30 0.00 -1.41 0.00 0.00 60.65 58.52 1sd3 s ILE 11 Cb -0.02 -0.33 -0.05 0.00 0.13 0.00 0.00 42.46 42.19 1sd3 s ILE 11 CO 0.08 -0.29 1.59 -0.76 -1.91 0.00 0.00 174.94 173.65 1sd3 s LEU 12 N -0.97 4.30 -0.30 8.50 1.43 -1.26 -4.56 118.68 125.82 1sd3 s LEU 12 Ca -0.11 2.16 -0.02 0.00 -1.03 0.00 0.00 54.13 55.14 1sd3 s LEU 12 Cb -0.06 -3.54 0.19 0.00 0.03 0.00 0.00 46.19 42.81 1sd3 s LEU 12 CO 0.01 -0.90 0.67 -0.70 0.23 0.00 0.00 176.35 175.66 1sd3 s GLU 13 N 3.90 0.51 0.25 1.70 2.56 -0.26 -4.98 118.70 122.38 1sd3 s GLU 13 Ca 0.71 0.83 -0.30 0.00 0.00 0.00 0.00 54.97 56.21 1sd3 s GLU 13 Cb -0.32 0.45 -0.09 0.00 2.00 0.00 0.00 34.13 36.17 1sd3 s GLU 13 CO 0.27 -0.62 1.19 -2.00 -0.56 0.00 0.00 175.26 173.55 1sd3 s GLU 14 N 2.87 4.52 -0.35 4.30 2.12 -1.25 -0.01 118.70 130.90 1sd3 s GLU 14 Ca 0.17 1.92 0.08 0.00 0.36 0.00 0.00 54.97 57.50 1sd3 s GLU 14 Cb -0.13 -3.19 0.68 0.00 0.26 0.00 0.00 34.13 31.75 1sd3 s GLU 14 CO -0.20 -0.00 1.78 -0.35 -0.54 0.00 0.00 175.26 175.94 1sd3 n PRO 15 N 1.69 3.00 0.08 4.30 -0.04 -1.26 -4.91 135.00 137.87 1sd3 n PRO 15 Ca 0.02 -3.07 -0.22 0.00 -0.04 0.00 0.00 63.50 60.19 1sd3 n PRO 15 Cb 0.44 -2.14 -0.15 0.00 -0.04 0.00 0.00 33.50 31.61 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 1.91 0.70 -3.05 0.54 -1.99 -0.77 -1.19 116.97 113.12 1sd3 h TYR 16 Ca 0.36 -0.51 -0.22 0.00 2.00 0.00 0.00 58.73 60.36 1sd3 h TYR 16 Cb 2.37 -0.03 -0.31 0.00 2.00 0.00 0.00 36.73 40.76 1sd3 h TYR 16 CO 1.31 1.42 -0.53 0.08 -0.00 0.00 0.00 178.16 180.44 1sd3 s VAL 17 N -2.49 -0.12 0.16 -2.88 1.01 0.40 -1.28 120.40 115.21 1sd3 s VAL 17 Ca -0.12 0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.86 1sd3 s VAL 17 Cb 0.02 -0.36 0.04 0.00 0.00 0.00 0.00 36.38 36.09 1sd3 s VAL 17 CO 0.87 0.08 0.50 -1.48 0.00 0.00 0.00 175.10 175.06 1sd3 s LEU 18 N 1.50 0.04 -0.04 3.92 2.34 -0.24 -1.10 118.68 125.10 1sd3 s LEU 18 Ca -0.07 -0.30 -0.30 0.00 0.06 0.00 0.00 54.13 53.52 1sd3 s LEU 18 Cb -0.11 2.14 -0.04 0.00 -0.56 0.00 0.00 46.19 47.63 1sd3 s LEU 18 CO -0.08 -0.96 1.23 -0.36 -1.06 0.00 0.00 176.35 175.12 1sd3 s PHE 19 N -3.82 3.14 0.22 3.48 0.40 -1.26 -1.16 117.98 118.98 1sd3 s PHE 19 Ca 0.05 1.15 -0.30 0.00 -0.60 0.00 0.00 56.93 57.23 1sd3 s PHE 19 Cb 0.00 -3.46 -0.08 0.00 0.51 0.00 0.00 43.02 39.99 1sd3 s PHE 19 CO -0.09 -1.49 1.16 0.21 0.70 0.00 0.00 175.22 175.71 1sd3 s LYS 20 N 2.22 4.55 0.10 0.44 2.20 -0.38 -4.85 119.74 124.01 1sd3 s LYS 20 Ca 0.57 1.84 -0.06 0.00 -0.36 0.00 0.00 55.97 57.96 1sd3 s LYS 20 Cb -0.26 -3.23 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 1sd3 s LYS 20 CO 0.23 0.02 0.36 0.15 -0.36 0.00 0.00 175.35 175.75 1sd3 s LYS 21 N -0.67 3.64 -0.22 4.03 1.02 -1.26 -4.90 119.74 121.38 1sd3 s LYS 21 Ca 0.50 -0.03 -0.27 0.00 0.02 0.00 0.00 55.97 56.18 1sd3 s LYS 21 Cb -0.32 -2.93 0.12 0.00 -0.52 0.00 0.00 37.83 34.18 1sd3 s LYS 21 CO 0.38 0.52 0.97 0.45 -0.92 0.00 0.00 175.35 176.76 1sd3 s SER 22 N -2.16 -0.45 0.42 2.83 0.15 -1.26 -5.02 113.70 108.21 1sd3 s SER 22 Ca 0.37 0.71 0.19 0.00 0.70 0.00 0.00 55.95 57.92 1sd3 s SER 22 Cb -0.13 0.67 0.95 0.00 -1.71 0.00 0.00 66.02 65.81 1sd3 s SER 22 CO 0.22 -0.27 1.89 -2.24 1.20 0.00 0.00 173.24 174.04 1sd3 h ASP 23 N 3.53 0.00 -2.04 5.45 2.03 -2.07 -3.44 116.42 119.88 1sd3 h ASP 23 Ca -0.24 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.52 1sd3 h ASP 23 Cb 1.17 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.59 1sd3 h ASP 23 CO 0.20 0.28 -0.56 -1.59 -1.03 0.00 0.00 179.24 176.54 1sd3 s LYS 24 N -4.04 2.49 0.39 4.15 -2.85 -1.26 -5.09 119.74 113.53 1sd3 s LYS 24 Ca -0.02 -1.38 -0.27 0.00 -1.00 0.00 0.00 55.97 53.29 1sd3 s LYS 24 Cb 0.13 -2.28 -0.10 0.00 -2.06 0.00 0.00 37.83 33.52 1sd3 s LYS 24 CO 0.67 0.25 1.46 -2.30 0.10 0.00 0.00 175.35 175.53 1sd3 n PRO 25 N -1.10 2.54 -4.33 1.78 -0.02 -1.26 -5.02 135.00 127.59 1sd3 n PRO 25 Ca -0.05 0.89 -0.30 0.00 -2.02 0.00 0.00 63.50 62.02 1sd3 n PRO 25 Cb 0.60 -2.64 -0.10 0.00 -0.02 0.00 0.00 33.50 31.33 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 -2.15 3.03 0.11 2.45 1.43 -1.26 -5.12 118.68 117.17 1sd3 s LEU 26 Ca 0.55 -0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 1sd3 s LEU 26 Cb -0.47 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 1sd3 s LEU 26 CO 0.62 0.21 -0.11 -0.31 0.23 0.00 0.00 176.35 176.99 1sd3 s TYR 27 N -1.13 1.20 0.00 0.29 1.51 -1.26 -4.81 117.35 113.14 1sd3 s TYR 27 Ca 0.20 -0.63 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1sd3 s TYR 27 Cb -0.11 -0.64 0.00 0.00 -0.11 0.00 0.00 41.96 41.10 1sd3 s TYR 27 CO 0.11 0.06 0.00 0.41 -1.11 0.00 0.00 175.55 175.02 1sd3 n GLY 28 N 0.49 2.65 0.28 0.71 0.00 -1.26 -1.87 105.19 106.19 1sd3 n GLY 28 Ca -0.15 -0.22 0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 3.58 0.00 0.56 1.61 2.35 -1.96 -2.39 115.58 119.33 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 0.47 -1.65 0.00 0.00 177.43 176.25 1sd3 n ASP 30 N -2.93 0.57 0.14 5.81 8.00 -0.78 -2.60 116.55 124.75 1sd3 n ASP 30 Ca -0.01 0.66 0.13 0.00 0.71 0.00 0.00 54.79 56.28 1sd3 n ASP 30 Cb 0.18 -0.78 0.48 0.00 -0.02 0.00 0.00 41.12 40.99 1sd3 n ASP 30 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1sd3 h ARG 31 N 0.00 0.00 -6.18 -1.24 3.08 -1.52 -3.44 114.38 105.08 1sd3 h ARG 31 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1sd3 h ARG 31 Cb 0.28 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.19 1sd3 h ARG 31 CO 0.00 0.00 -0.76 -0.06 -1.07 0.00 0.00 179.97 178.08 1sd3 s PHE 32 N -3.29 2.25 0.23 3.04 0.40 -1.07 -1.25 117.98 118.28 1sd3 s PHE 32 Ca 0.06 -0.35 -0.16 0.00 -0.60 0.00 0.00 56.93 55.88 1sd3 s PHE 32 Cb 0.10 -0.98 0.01 0.00 0.51 0.00 0.00 43.02 42.66 1sd3 s PHE 32 CO 0.46 0.68 0.53 -1.83 0.70 0.00 0.00 175.22 175.76 1sd3 s GLU 33 N -3.47 1.51 0.00 0.44 -1.05 -0.31 -4.69 118.70 111.12 1sd3 s GLU 33 Ca 0.29 -1.05 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 1sd3 s GLU 33 Cb -0.05 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.15 1sd3 s GLU 33 CO 0.14 -0.64 0.00 0.41 0.95 0.00 0.00 175.26 176.12 1sd3 n GLY 34 N -0.37 2.35 0.22 -3.83 0.00 -1.26 -1.07 105.19 101.23 1sd3 n GLY 34 Ca -0.06 -1.95 -0.08 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.45 0.00 1.61 3.20 -0.88 -0.09 116.97 120.36 1sd3 h TYR 35 Ca 0.00 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 1sd3 h TYR 35 Cb 0.00 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1sd3 h TYR 35 CO 0.00 -0.25 -0.22 0.00 -1.64 0.00 0.00 178.16 176.04 1sd3 h ILE 37 N 0.00 1.34 -0.52 0.00 1.08 -1.34 -0.58 117.51 117.48 1sd3 h ILE 37 Ca -0.00 -2.16 -0.09 0.00 -0.39 0.00 0.00 64.86 62.21 1sd3 h ILE 37 Cb 0.56 2.16 -0.02 0.00 -3.07 0.00 0.00 36.82 36.46 1sd3 h ILE 37 CO 0.03 0.66 -0.04 0.44 -0.69 0.00 0.00 178.15 178.55 1sd3 h ASP 38 N 0.37 0.93 0.14 1.72 3.32 -0.64 -1.72 116.42 120.55 1sd3 h ASP 38 Ca -0.06 -0.33 -0.01 0.00 0.02 0.00 0.00 57.03 56.66 1sd3 h ASP 38 Cb 1.45 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1sd3 h ASP 38 CO 0.16 1.03 -0.07 0.25 -1.72 0.00 0.00 179.24 178.89 1sd3 h LEU 39 N 0.81 -0.16 -0.65 1.55 5.85 -1.02 -1.75 115.31 119.93 1sd3 h LEU 39 Ca 0.14 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.94 1sd3 h LEU 39 Cb 0.58 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.58 1sd3 h LEU 39 CO 0.03 -0.09 0.28 0.25 -0.34 0.00 0.00 178.44 178.58 1sd3 h LEU 40 N -0.22 0.33 -0.38 2.25 5.85 -1.01 -0.39 115.31 121.75 1sd3 h LEU 40 Ca -0.02 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.80 1sd3 h LEU 40 Cb 0.17 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1sd3 h LEU 40 CO 0.03 0.19 0.18 -0.09 -0.34 0.00 0.00 178.44 178.41 1sd3 h ARG 41 N 0.50 0.36 -0.63 1.25 2.43 -1.00 -1.11 114.38 116.17 1sd3 h ARG 41 Ca 0.32 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.47 1sd3 h ARG 41 Cb 0.37 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1sd3 h ARG 41 CO -0.29 0.24 0.39 0.93 -1.51 0.00 0.00 179.97 179.73 1sd3 h GLU 42 N 0.37 0.85 -0.76 0.20 4.39 -0.46 -2.38 114.58 116.78 1sd3 h GLU 42 Ca 0.16 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.82 1sd3 h GLU 42 Cb 0.08 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.51 1sd3 h GLU 42 CO -0.12 0.60 0.49 -0.07 -1.16 0.00 0.00 179.01 178.74 1sd3 h LEU 43 N 0.86 0.82 -1.31 1.33 3.38 -0.62 -1.34 115.31 118.42 1sd3 h LEU 43 Ca 0.23 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 1sd3 h LEU 43 Cb -0.05 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1sd3 h LEU 43 CO -0.04 0.57 -0.11 0.77 0.09 0.00 0.00 178.44 179.72 1sd3 h SER 44 N 0.97 0.31 0.45 -0.43 4.64 -0.72 -0.79 113.55 117.99 1sd3 h SER 44 Ca 0.30 -0.07 -0.30 0.00 -0.47 0.00 0.00 61.79 61.25 1sd3 h SER 44 Cb -0.02 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 1sd3 h SER 44 CO -0.10 0.46 -1.60 0.71 -0.87 0.00 0.00 176.83 175.43 1sd3 h THR 45 N 0.32 1.04 -0.22 2.95 1.35 -1.19 -0.38 112.91 116.78 1sd3 h THR 45 Ca 0.06 -2.75 -0.06 0.00 -0.55 0.00 0.00 66.41 63.12 1sd3 h THR 45 Cb 0.39 2.64 -0.01 0.00 -1.73 0.00 0.00 68.15 69.44 1sd3 h THR 45 CO 0.02 0.76 -0.09 0.40 -0.25 0.00 0.00 175.52 176.36 1sd3 h ILE 46 N 0.05 1.30 0.00 6.82 2.04 -1.17 -3.27 117.51 123.27 1sd3 h ILE 46 Ca -0.26 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1sd3 h ILE 46 Cb 2.00 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 39.65 1sd3 h ILE 46 CO 0.13 0.35 -0.68 0.18 0.00 0.00 0.00 178.15 178.13 1sd3 n LEU 47 N -4.55 0.61 -1.97 1.44 4.77 -0.31 -5.01 117.00 111.98 1sd3 n LEU 47 Ca -0.04 0.09 -0.04 0.00 -0.03 0.00 0.00 56.01 55.99 1sd3 n LEU 47 Cb 0.32 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1sd3 n LEU 47 CO 0.39 0.03 0.02 0.61 -1.33 0.00 0.00 177.39 177.11 1sd3 n GLY 48 N 1.40 0.26 3.15 -0.72 0.00 -0.56 -5.05 105.19 103.67 1sd3 n GLY 48 Ca 0.04 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.10 0.19 0.32 1.61 -0.12 -0.26 -5.04 117.98 111.59 1sd3 s PHE 49 Ca 0.11 -0.54 0.08 0.00 -0.05 0.00 0.00 56.93 56.53 1sd3 s PHE 49 Cb -0.01 -0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.22 1sd3 s PHE 49 CO 0.20 -0.43 0.23 0.95 -0.05 0.00 0.00 175.22 176.12 1sd3 s THR 50 N -3.13 3.58 0.28 -4.49 -4.23 -1.26 -4.62 115.64 101.77 1sd3 s THR 50 Ca -0.01 -1.47 -0.20 0.00 -1.18 0.00 0.00 61.69 58.84 1sd3 s THR 50 Cb 0.02 -3.16 0.02 0.00 1.34 0.00 0.00 72.50 70.71 1sd3 s THR 50 CO -0.07 -0.22 0.69 -0.72 -0.54 0.00 0.00 174.62 173.76 1sd3 s TYR 51 N -2.30 -0.11 -0.01 3.99 -0.85 -1.26 -0.59 117.35 116.22 1sd3 s TYR 51 Ca 0.38 -0.34 0.02 0.00 -0.52 0.00 0.00 57.07 56.62 1sd3 s TYR 51 Cb -0.05 0.64 -0.00 0.00 0.38 0.00 0.00 41.96 42.92 1sd3 s TYR 51 CO 0.25 -1.21 -0.07 -1.21 -1.52 0.00 0.00 175.55 171.79 1sd3 s GLU 52 N -3.92 0.60 -0.12 -3.49 2.02 -0.20 -4.86 118.70 108.73 1sd3 s GLU 52 Ca 0.13 -0.25 -0.18 0.00 0.02 0.00 0.00 54.97 54.69 1sd3 s GLU 52 Cb -0.05 -0.58 -0.04 0.00 0.10 0.00 0.00 34.13 33.55 1sd3 s GLU 52 CO 0.07 0.15 0.46 0.42 0.02 0.00 0.00 175.26 176.38 1sd3 s ILE 53 N -0.12 5.20 -0.03 -1.63 1.01 -1.26 -1.05 121.20 123.32 1sd3 s ILE 53 Ca 0.02 0.91 0.06 0.00 0.00 0.00 0.00 60.65 61.64 1sd3 s ILE 53 Cb -0.03 -3.80 -0.01 0.00 0.01 0.00 0.00 42.46 38.63 1sd3 s ILE 53 CO -0.00 0.33 -0.20 -0.60 0.00 0.00 0.00 174.94 174.47 1sd3 s ARG 54 N 0.59 1.77 -0.13 2.79 3.52 0.40 -4.95 118.95 122.94 1sd3 s ARG 54 Ca 0.25 -0.72 -0.19 0.00 -0.13 0.00 0.00 55.73 54.94 1sd3 s ARG 54 Cb -0.15 -1.65 -0.04 0.00 -1.56 0.00 0.00 34.95 31.56 1sd3 s ARG 54 CO 0.10 0.39 0.50 -0.51 -0.81 0.00 0.00 175.30 174.97 1sd3 s LEU 55 N -0.34 4.25 -0.18 -0.88 1.43 -1.26 -1.12 118.68 120.58 1sd3 s LEU 55 Ca 0.04 0.81 -0.39 0.00 -1.03 0.00 0.00 54.13 53.57 1sd3 s LEU 55 Cb -0.09 -2.72 -0.15 0.00 0.03 0.00 0.00 46.19 43.25 1sd3 s LEU 55 CO 0.00 -0.04 1.68 0.55 0.23 0.00 0.00 176.35 178.77 1sd3 n VAL 56 N 3.85 0.27 -0.31 -1.59 3.14 -0.04 -4.85 118.33 118.80 1sd3 n VAL 56 Ca -0.06 -0.05 0.01 0.00 -2.96 0.00 0.00 64.34 61.28 1sd3 n VAL 56 Cb 0.51 -1.23 0.15 0.00 -1.06 0.00 0.00 33.84 32.21 1sd3 n VAL 56 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1sd3 h GLU 57 N 6.92 0.93 -0.20 1.45 5.08 -1.93 -2.23 114.58 124.60 1sd3 h GLU 57 Ca -0.47 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1sd3 h GLU 57 Cb 1.31 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1sd3 h GLU 57 CO 0.92 0.62 0.00 -0.40 -1.00 0.00 0.00 179.01 179.15 1sd3 n ASP 58 N -4.63 1.42 -1.93 1.42 5.75 -1.26 -4.92 116.55 112.41 1sd3 n ASP 58 Ca 0.13 -1.80 -0.20 0.00 -0.01 0.00 0.00 54.79 52.90 1sd3 n ASP 58 Cb 0.20 -0.13 -0.05 0.00 -1.03 0.00 0.00 41.12 40.11 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 1.02 0.76 3.47 6.12 0.00 -0.84 -4.94 105.19 110.78 1sd3 n GLY 59 Ca 0.13 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 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 -4.35 1.69 -0.10 1.61 1.02 -1.26 -5.05 119.74 113.30 1sd3 s LYS 60 Ca 0.00 -1.63 -0.12 0.00 0.02 0.00 0.00 55.97 54.24 1sd3 s LYS 60 Cb 0.00 -1.85 -0.10 0.00 -0.52 0.00 0.00 37.83 35.36 1sd3 s LYS 60 CO 0.00 0.36 0.39 1.88 -0.92 0.00 0.00 175.35 177.07 1sd3 h TYR 61 N 2.61 -0.07 0.00 3.18 -1.99 -1.87 -2.41 116.97 116.41 1sd3 h TYR 61 Ca -0.43 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.30 1sd3 h TYR 61 Cb 1.24 0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.99 1sd3 h TYR 61 CO 0.75 0.27 0.00 0.41 -0.00 0.00 0.00 178.16 179.59 1sd3 n GLY 62 N 1.43 3.17 3.22 3.88 0.00 -0.61 -1.07 105.19 115.22 1sd3 n GLY 62 Ca -0.04 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.42 -0.08 4.61 0.00 -1.24 -4.57 121.76 120.06 1sd3 s ALA 63 Ca 0.00 -0.37 -0.19 0.00 0.00 0.00 0.00 51.96 51.41 1sd3 s ALA 63 Cb 0.00 0.44 -0.05 0.00 0.00 0.00 0.00 23.12 23.51 1sd3 s ALA 63 CO 0.00 -0.48 0.51 -1.14 0.00 0.00 0.00 175.76 174.65 1sd3 s GLN 64 N -3.34 4.30 0.26 0.00 0.74 -1.26 -2.51 119.66 117.85 1sd3 s GLN 64 Ca 0.01 0.53 -0.29 0.00 0.05 0.00 0.00 55.36 55.65 1sd3 s GLN 64 Cb 0.02 -3.40 -0.10 0.00 1.10 0.00 0.00 33.01 30.64 1sd3 s GLN 64 CO -0.08 0.25 1.29 0.34 -0.55 0.00 0.00 175.29 176.54 1sd3 s ASP 65 N 0.30 6.88 0.19 6.67 -1.08 0.65 -4.92 116.67 125.37 1sd3 s ASP 65 Ca 0.27 2.51 -0.10 0.00 -0.52 0.00 0.00 52.55 54.72 1sd3 s ASP 65 Cb -0.16 -2.63 0.11 0.00 -1.46 0.00 0.00 42.92 38.78 1sd3 s ASP 65 CO 0.12 -0.49 1.74 0.44 0.52 0.00 0.00 175.17 177.50 1sd3 h ASP 66 N 4.40 0.99 0.05 -0.34 3.32 -1.96 -0.79 116.42 122.09 1sd3 h ASP 66 Ca -0.47 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.39 1sd3 h ASP 66 Cb 1.22 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1sd3 h ASP 66 CO 0.71 0.92 -0.02 0.58 -1.72 0.00 0.00 179.24 179.71 1sd3 h VAL 67 N 1.00 0.00 -0.01 -1.35 2.07 -1.98 -3.39 116.25 112.59 1sd3 h VAL 67 Ca 0.23 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1sd3 h VAL 67 Cb 0.26 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1sd3 h VAL 67 CO -0.01 0.00 -0.11 -0.46 0.02 0.00 0.00 177.57 177.00 1sd3 n ASN 68 N -2.47 1.43 0.00 0.57 0.23 -1.26 -4.95 115.26 108.81 1sd3 n ASN 68 Ca -0.01 -1.30 0.00 0.00 -0.53 0.00 0.00 54.58 52.74 1sd3 n ASN 68 Cb 0.03 0.07 0.00 0.00 -2.08 0.00 0.00 39.78 37.79 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 1.26 0.19 3.81 4.83 0.00 -0.30 -4.97 105.19 110.01 1sd3 n GLY 69 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.24 4.33 0.46 1.61 -1.52 -1.26 -4.48 119.66 117.55 1sd3 s GLN 70 Ca 0.00 1.09 -0.03 0.00 -1.95 0.00 0.00 55.36 54.47 1sd3 s GLN 70 Cb 0.00 -2.54 -0.03 0.00 -0.22 0.00 0.00 33.01 30.22 1sd3 s GLN 70 CO 0.00 0.17 0.73 -1.58 -0.25 0.00 0.00 175.29 174.36 1sd3 s TRP 71 N -1.85 3.47 0.00 0.91 0.52 -1.26 -0.25 118.94 120.48 1sd3 s TRP 71 Ca 0.54 0.61 0.00 0.00 0.02 0.00 0.00 56.10 57.27 1sd3 s TRP 71 Cb -0.14 -2.26 0.00 0.00 -1.15 0.00 0.00 33.47 29.93 1sd3 s TRP 71 CO 0.19 -0.26 0.00 0.27 0.02 0.00 0.00 176.95 177.17 1sd3 n ASN 72 N -2.16 0.71 0.00 2.95 0.23 -1.05 -4.68 115.26 111.26 1sd3 n ASN 72 Ca -0.00 -0.73 0.00 0.00 -0.53 0.00 0.00 54.58 53.32 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 1.79 0.97 0.26 4.83 0.00 -1.26 -1.92 105.19 109.85 1sd3 n GLY 73 Ca 0.00 -0.70 -0.01 0.00 0.00 0.00 0.00 46.02 45.31 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 0.48 -0.30 1.61 2.86 -0.56 -2.25 114.93 116.78 1sd3 h MET 74 Ca 0.00 -0.13 0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1sd3 h MET 74 Cb 0.00 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.57 1sd3 h MET 74 CO 0.00 0.59 0.08 0.28 1.06 0.00 0.00 176.91 178.92 1sd3 h VAL 75 N 0.45 0.88 -0.35 -2.22 2.07 -1.54 -1.70 116.25 113.84 1sd3 h VAL 75 Ca 0.09 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.47 1sd3 h VAL 75 Cb 0.46 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1sd3 h VAL 75 CO 0.03 0.03 -0.10 -0.09 0.02 0.00 0.00 177.57 177.47 1sd3 h ARG 76 N 0.19 0.59 -0.09 1.57 9.65 -1.03 -1.41 114.38 123.85 1sd3 h ARG 76 Ca 0.14 -0.17 -0.06 0.00 -1.10 0.00 0.00 59.98 58.78 1sd3 h ARG 76 Cb 0.13 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 1sd3 h ARG 76 CO -0.16 0.68 -0.23 0.93 2.80 0.00 0.00 179.97 183.99 1sd3 h GLU 77 N 0.55 0.16 -0.07 0.20 5.08 -0.82 -0.72 114.58 118.96 1sd3 h GLU 77 Ca 0.10 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.20 1sd3 h GLU 77 Cb 0.49 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.74 1sd3 h GLU 77 CO 0.03 0.38 -0.80 -0.07 -1.00 0.00 0.00 179.01 177.56 1sd3 h LEU 78 N 0.15 0.82 -0.46 1.33 3.38 -0.82 0.40 115.31 120.10 1sd3 h LEU 78 Ca 0.03 -0.69 0.02 0.00 0.09 0.00 0.00 57.88 57.32 1sd3 h LEU 78 Cb 0.49 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1sd3 h LEU 78 CO 0.03 1.39 0.28 0.40 0.09 0.00 0.00 178.44 180.63 1sd3 h ILE 79 N 0.32 1.07 -0.10 1.22 2.04 -0.87 -1.89 117.51 119.29 1sd3 h ILE 79 Ca -0.08 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1sd3 h ILE 79 Cb 1.45 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 1sd3 h ILE 79 CO 0.16 0.10 0.00 0.47 0.00 0.00 0.00 178.15 178.88 1sd3 n ASP 80 N -4.81 0.61 -3.61 1.72 8.00 -0.31 -4.90 116.55 113.25 1sd3 n ASP 80 Ca 0.02 -1.87 -0.27 0.00 0.71 0.00 0.00 54.79 53.38 1sd3 n ASP 80 Cb 0.06 -0.07 0.03 0.00 -0.02 0.00 0.00 41.12 41.12 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 -0.22 -2.27 1.28 1.24 8.25 -0.71 -4.84 115.22 117.95 1sd3 n HIS 81 Ca 0.07 0.78 0.13 0.00 -0.26 0.00 0.00 57.72 58.44 1sd3 n HIS 81 Cb 0.11 -4.09 0.42 0.00 1.12 0.00 0.00 29.99 27.55 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 -4.47 0.87 -3.69 -0.41 5.02 0.14 -4.86 118.16 110.76 1sd3 n LYS 82 Ca 0.00 -0.49 -0.14 0.00 -2.02 0.00 0.00 58.31 55.66 1sd3 n LYS 82 Cb 0.55 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.99 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 -2.47 -1.03 -0.04 7.82 0.00 -1.18 -4.97 121.76 119.89 1sd3 s ALA 83 Ca 0.26 0.53 0.05 0.00 0.00 0.00 0.00 51.96 52.80 1sd3 s ALA 83 Cb 0.19 0.11 -0.24 0.00 0.00 0.00 0.00 23.12 23.18 1sd3 s ALA 83 CO 0.50 -0.32 0.66 -0.44 0.00 0.00 0.00 175.76 176.17 1sd3 h ASP 84 N 3.53 0.16 -5.17 0.00 3.32 -0.86 -3.43 116.42 113.97 1sd3 h ASP 84 Ca -0.29 -0.31 -0.11 0.00 0.02 0.00 0.00 57.03 56.33 1sd3 h ASP 84 Cb 1.17 -0.05 -0.16 0.00 0.22 0.00 0.00 39.33 40.51 1sd3 h ASP 84 CO 0.41 1.28 -0.55 -0.76 -1.72 0.00 0.00 179.24 177.89 1sd3 s LEU 85 N -6.50 1.99 -0.24 1.55 1.43 -1.08 -4.32 118.68 111.52 1sd3 s LEU 85 Ca -0.09 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 1sd3 s LEU 85 Cb 0.08 0.54 0.06 0.00 0.03 0.00 0.00 46.19 46.90 1sd3 s LEU 85 CO 0.82 -0.60 -0.04 0.00 0.23 0.00 0.00 176.35 176.76 1sd3 s ALA 86 N -3.46 1.89 -0.35 4.21 0.00 -0.17 -0.33 121.76 123.56 1sd3 s ALA 86 Ca 0.02 -1.35 -0.00 0.00 0.00 0.00 0.00 51.96 50.63 1sd3 s ALA 86 Cb 0.04 -1.44 0.09 0.00 0.00 0.00 0.00 23.12 21.81 1sd3 s ALA 86 CO -0.08 -1.23 0.09 0.08 0.00 0.00 0.00 175.76 174.61 1sd3 s VAL 87 N 1.43 2.85 0.22 0.00 1.01 -0.77 -1.30 120.40 123.84 1sd3 s VAL 87 Ca -0.04 -1.93 -0.21 0.00 0.00 0.00 0.00 61.98 59.80 1sd3 s VAL 87 Cb -0.19 -2.89 0.07 0.00 0.00 0.00 0.00 36.38 33.38 1sd3 s VAL 87 CO -0.07 -0.47 1.01 0.00 0.00 0.00 0.00 175.10 175.57 1sd3 n ALA 88 N 4.50 -2.59 -1.49 5.51 0.00 -1.26 -4.59 120.51 120.59 1sd3 n ALA 88 Ca -0.04 -1.08 -0.40 0.00 0.00 0.00 0.00 53.44 51.92 1sd3 n ALA 88 Cb 0.42 0.64 -0.02 0.00 0.00 0.00 0.00 19.45 20.50 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 -0.71 2.74 -3.22 0.00 -0.04 -1.26 -4.69 135.00 127.82 1sd3 n PRO 89 Ca -0.03 -2.32 -0.42 0.00 -0.04 0.00 0.00 63.50 60.69 1sd3 n PRO 89 Cb 0.59 -3.08 -0.08 0.00 -0.04 0.00 0.00 33.50 30.90 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 1.50 4.44 0.21 1.53 2.96 -1.26 -5.00 118.68 123.06 1sd3 s LEU 90 Ca 0.53 -0.17 -0.31 0.00 -0.22 0.00 0.00 54.13 53.96 1sd3 s LEU 90 Cb 0.15 -2.60 -0.10 0.00 0.50 0.00 0.00 46.19 44.14 1sd3 s LEU 90 CO -0.05 -0.56 1.48 0.00 -1.32 0.00 0.00 176.35 175.90 1sd3 s ALA 91 N 2.46 3.67 -0.32 5.97 0.00 -1.26 -1.62 121.76 130.65 1sd3 s ALA 91 Ca 0.19 1.33 -0.26 0.00 0.00 0.00 0.00 51.96 53.21 1sd3 s ALA 91 Cb -0.15 -3.58 0.01 0.00 0.00 0.00 0.00 23.12 19.40 1sd3 s ALA 91 CO 0.15 -0.75 0.93 0.42 0.00 0.00 0.00 175.76 176.51 1sd3 s ILE 92 N 0.44 4.64 0.08 0.00 1.01 0.17 -4.87 121.20 122.66 1sd3 s ILE 92 Ca 0.63 1.41 0.03 0.00 0.00 0.00 0.00 60.65 62.72 1sd3 s ILE 92 Cb -0.42 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 37.72 1sd3 s ILE 92 CO 0.39 -0.40 -0.10 0.42 0.00 0.00 0.00 174.94 175.24 1sd3 s THR 93 N 3.34 0.86 0.18 2.92 -4.23 -1.26 -4.55 115.64 112.91 1sd3 s THR 93 Ca 0.39 -1.52 -0.14 0.00 -1.18 0.00 0.00 61.69 59.24 1sd3 s THR 93 Cb -0.13 -1.21 0.08 0.00 1.34 0.00 0.00 72.50 72.58 1sd3 s THR 93 CO 0.15 -0.51 1.73 0.22 -0.54 0.00 0.00 174.62 175.67 1sd3 h TYR 94 N 3.77 0.22 -0.24 3.99 3.20 -1.99 -0.39 116.97 125.53 1sd3 h TYR 94 Ca -0.37 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.47 1sd3 h TYR 94 Cb 1.19 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.42 1sd3 h TYR 94 CO 0.63 0.05 -0.09 -0.39 -1.64 0.00 0.00 178.16 176.72 1sd3 h VAL 95 N 0.28 1.19 -0.02 1.81 -1.51 -2.01 -2.68 116.25 113.31 1sd3 h VAL 95 Ca 0.22 -0.83 -0.21 0.00 -1.23 0.00 0.00 66.70 64.65 1sd3 h VAL 95 Cb 0.26 1.12 -0.00 0.00 -2.13 0.00 0.00 31.29 30.53 1sd3 h VAL 95 CO -0.26 0.27 -0.88 0.03 -1.23 0.00 0.00 177.57 175.50 1sd3 h ARG 96 N 0.36 0.40 0.00 5.19 3.08 -1.79 -3.07 114.38 118.56 1sd3 h ARG 96 Ca 0.07 -0.40 0.00 0.00 0.07 0.00 0.00 59.98 59.72 1sd3 h ARG 96 Cb 0.38 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1sd3 h ARG 96 CO 0.02 1.06 0.00 0.93 -1.07 0.00 0.00 179.97 180.91 1sd3 h GLU 97 N 0.24 0.00 0.00 0.04 5.08 -0.74 -0.13 114.58 119.07 1sd3 h GLU 97 Ca -0.06 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 1sd3 h GLU 97 Cb 1.50 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.73 1sd3 h GLU 97 CO 0.15 0.00 -0.60 0.87 -1.00 0.00 0.00 179.01 178.44 1sd3 h LYS 98 N 0.00 0.00 0.00 2.33 1.79 -1.46 -3.36 116.57 115.87 1sd3 h LYS 98 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1sd3 h LYS 98 Cb 0.05 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1sd3 h LYS 98 CO 0.00 0.60 -1.33 1.33 -1.08 0.00 0.00 179.45 178.96 1sd3 n VAL 99 N -3.76 0.07 -4.25 0.50 0.24 -0.36 -5.06 118.33 105.71 1sd3 n VAL 99 Ca -0.01 -0.17 -0.14 0.00 -2.04 0.00 0.00 64.34 61.98 1sd3 n VAL 99 Cb 0.61 0.15 -0.10 0.00 -1.47 0.00 0.00 33.84 33.03 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 -2.42 0.34 0.15 1.34 -4.36 -0.21 -4.20 121.20 111.84 1sd3 s ILE 100 Ca -0.03 -1.99 0.05 0.00 -0.26 0.00 0.00 60.65 58.43 1sd3 s ILE 100 Cb 0.04 -2.46 -0.04 0.00 1.25 0.00 0.00 42.46 41.25 1sd3 s ILE 100 CO 0.28 -0.11 0.07 -1.81 0.24 0.00 0.00 174.94 173.61 1sd3 s ASP 101 N -3.22 5.23 0.08 4.36 1.01 -0.61 -4.15 116.67 119.37 1sd3 s ASP 101 Ca 0.35 -0.20 0.07 0.00 0.71 0.00 0.00 52.55 53.47 1sd3 s ASP 101 Cb 0.07 -1.28 -0.03 0.00 1.01 0.00 0.00 42.92 42.69 1sd3 s ASP 101 CO 0.11 0.10 -0.18 -0.36 0.21 0.00 0.00 175.17 175.05 1sd3 s PHE 102 N -1.64 1.56 0.90 4.23 0.40 -1.26 -1.47 117.98 120.70 1sd3 s PHE 102 Ca 0.29 -0.41 -0.14 0.00 -0.60 0.00 0.00 56.93 56.07 1sd3 s PHE 102 Cb -0.10 -0.88 0.16 0.00 0.51 0.00 0.00 43.02 42.71 1sd3 s PHE 102 CO 0.21 0.12 1.25 -1.54 0.70 0.00 0.00 175.22 175.97 1sd3 s SER 103 N -1.63 3.59 0.83 1.36 1.04 -0.59 -4.96 113.70 113.34 1sd3 s SER 103 Ca 0.04 0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.70 1sd3 s SER 103 Cb -0.09 -0.54 0.09 0.00 0.10 0.00 0.00 66.02 65.58 1sd3 s SER 103 CO 0.03 -2.44 1.13 -0.54 0.98 0.00 0.00 173.24 172.40 1sd3 s LYS 104 N -5.74 1.69 0.51 4.02 -0.14 -1.26 -4.57 119.74 114.25 1sd3 s LYS 104 Ca 0.70 1.44 -0.22 0.00 -1.36 0.00 0.00 55.97 56.53 1sd3 s LYS 104 Cb -0.06 -1.81 -0.06 0.00 -1.68 0.00 0.00 37.83 34.22 1sd3 s LYS 104 CO 0.51 -2.11 1.29 -2.14 -0.76 0.00 0.00 175.35 172.14 1sd3 s PRO 105 N -4.60 3.40 0.00 -1.68 0.02 -1.26 -4.58 135.00 126.30 1sd3 s PRO 105 Ca 0.66 2.09 0.12 0.00 0.02 0.00 0.00 61.00 63.88 1sd3 s PRO 105 Cb -0.22 -2.35 0.04 0.00 0.02 0.00 0.00 34.50 32.00 1sd3 s PRO 105 CO 0.55 -0.93 0.78 1.97 -0.33 0.00 0.00 177.00 179.03 1sd3 n PHE 106 N -0.76 0.00 -3.61 6.54 1.16 0.22 -4.94 117.46 116.06 1sd3 n PHE 106 Ca 0.09 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.54 1sd3 n PHE 106 Cb 0.46 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.26 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 -1.25 0.72 0.13 3.97 0.00 -1.24 -4.99 119.30 116.64 1sd3 s MET 107 Ca 0.12 0.68 0.07 0.00 0.00 0.00 0.00 55.69 56.56 1sd3 s MET 107 Cb 0.10 0.35 -0.04 0.00 0.00 0.00 0.00 34.83 35.24 1sd3 s MET 107 CO 0.22 -0.12 -0.06 0.95 0.00 0.00 0.00 175.02 176.01 1sd3 s THR 108 N -0.02 3.55 0.00 10.11 -4.23 -1.26 -0.85 115.64 122.94 1sd3 s THR 108 Ca -0.00 -1.31 -0.00 0.00 -1.18 0.00 0.00 61.69 59.20 1sd3 s THR 108 Cb -0.04 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.09 1sd3 s THR 108 CO -0.00 0.03 0.01 0.00 -0.54 0.00 0.00 174.62 174.12 1sd3 n LEU 109 N 0.40 0.00 -3.50 4.79 -0.00 -0.26 -4.87 117.00 113.56 1sd3 n LEU 109 Ca -0.12 -0.02 -0.13 0.00 -0.00 0.00 0.00 56.01 55.74 1sd3 n LEU 109 Cb 0.53 0.04 -0.04 0.00 -0.00 0.00 0.00 43.42 43.96 1sd3 n LEU 109 CO 0.36 -0.01 0.55 -0.83 -0.00 0.00 0.00 177.39 177.46 1sd3 s GLY 110 N -1.57 -0.51 0.34 1.47 0.00 -1.26 -1.03 107.32 104.76 1sd3 s GLY 110 Ca 0.00 1.13 -0.27 0.00 0.00 0.00 0.00 44.72 45.58 1sd3 s GLY 110 CO 0.00 0.59 1.18 -0.42 0.00 0.00 0.00 173.10 174.45 1sd3 s ILE 111 N -2.39 3.17 0.00 0.90 1.01 -1.25 -0.02 121.20 122.61 1sd3 s ILE 111 Ca -0.02 1.09 0.00 0.00 0.00 0.00 0.00 60.65 61.72 1sd3 s ILE 111 Cb -0.01 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1sd3 s ILE 111 CO -0.03 0.19 0.00 -0.24 0.00 0.00 0.00 174.94 174.87 1sd3 n SER 112 N 0.62 0.00 -4.23 3.58 2.88 0.08 -0.03 113.62 116.53 1sd3 n SER 112 Ca 0.01 -0.77 -0.31 0.00 -1.33 0.00 0.00 58.87 56.47 1sd3 n SER 112 Cb 0.45 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.74 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 -2.25 2.01 -0.12 2.46 1.01 -1.25 -1.97 121.20 121.09 1sd3 s ILE 113 Ca 0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 59.60 1sd3 s ILE 113 Cb 0.00 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 1sd3 s ILE 113 CO 0.00 0.55 -0.00 -0.22 0.00 0.00 0.00 174.94 175.27 1sd3 s LEU 114 N 0.14 3.51 0.34 2.97 2.96 0.83 -0.02 118.68 129.41 1sd3 s LEU 114 Ca -0.12 0.05 -0.18 0.00 -0.22 0.00 0.00 54.13 53.65 1sd3 s LEU 114 Cb -0.16 -1.83 0.05 0.00 0.50 0.00 0.00 46.19 44.75 1sd3 s LEU 114 CO 0.07 0.28 0.79 -0.47 -1.32 0.00 0.00 176.35 175.70 1sd3 s TYR 115 N -0.28 0.02 0.43 5.38 5.04 -0.68 -0.86 117.35 126.41 1sd3 s TYR 115 Ca 0.06 -0.61 -0.22 0.00 -2.44 0.00 0.00 57.07 53.86 1sd3 s TYR 115 Cb -0.12 0.79 -0.10 0.00 0.35 0.00 0.00 41.96 42.88 1sd3 s TYR 115 CO 0.02 -1.42 1.00 1.03 -1.34 0.00 0.00 175.55 174.85 1sd3 s ARG 116 N -2.77 4.11 0.56 4.97 0.52 -1.26 -0.92 118.95 124.16 1sd3 s ARG 116 Ca 0.15 1.32 -0.06 0.00 -0.52 0.00 0.00 55.73 56.62 1sd3 s ARG 116 Cb -0.05 -2.31 -0.00 0.00 0.52 0.00 0.00 34.95 33.11 1sd3 s ARG 116 CO 0.10 -0.16 0.87 -1.59 0.02 0.00 0.00 175.30 174.54 1sd3 s LYS 117 N -2.90 3.07 0.00 3.54 -2.85 -0.84 -4.34 119.74 115.41 1sd3 s LYS 117 Ca 0.61 0.03 0.00 0.00 -1.00 0.00 0.00 55.97 55.61 1sd3 s LYS 117 Cb -0.16 -2.30 0.00 0.00 -2.06 0.00 0.00 37.83 33.31 1sd3 s LYS 117 CO 0.20 -0.58 0.00 0.41 0.10 0.00 0.00 175.35 175.48 1sd3 n GLY 118 N -2.50 0.57 3.63 0.59 0.00 -1.26 -5.02 105.19 101.21 1sd3 n GLY 118 Ca 0.04 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.00 2.14 -2.22 2.61 -4.23 -1.26 -5.04 115.64 105.64 1sd3 s THR 119 Ca 0.00 -1.98 0.22 0.00 -1.18 0.00 0.00 61.69 58.75 1sd3 s THR 119 Cb 0.00 -2.93 0.52 0.00 1.34 0.00 0.00 72.50 71.44 1sd3 s THR 119 CO 0.00 -0.05 1.67 -0.81 -0.54 0.00 0.00 174.62 174.90 1sd3 n PRO 120 N -0.99 1.48 -2.64 3.99 -0.04 -1.26 -4.82 135.00 130.72 1sd3 n PRO 120 Ca -0.04 -0.71 -0.43 0.00 -0.04 0.00 0.00 63.50 62.27 1sd3 n PRO 120 Cb 0.66 -1.39 -0.02 0.00 -0.04 0.00 0.00 33.50 32.71 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 -1.89 4.61 0.00 0.52 -1.09 -1.26 -4.87 121.20 117.22 1sd3 s ILE 121 Ca 0.33 1.93 0.00 0.00 -2.23 0.00 0.00 60.65 60.68 1sd3 s ILE 121 Cb 0.17 -4.32 0.00 0.00 -1.58 0.00 0.00 42.46 36.74 1sd3 s ILE 121 CO 0.27 -0.25 0.48 -0.67 -1.23 0.00 0.00 174.94 173.54 1sd3 n ASP 122 N 6.47 0.88 -3.70 3.58 2.03 -1.26 -4.92 116.55 119.63 1sd3 n ASP 122 Ca 0.12 -1.18 -0.04 0.00 0.52 0.00 0.00 54.79 54.21 1sd3 n ASP 122 Cb 0.46 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.85 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 -0.18 -0.15 0.36 1.67 1.04 -1.26 -3.35 113.70 111.82 1sd3 s SER 123 Ca 0.00 -0.46 0.06 0.00 0.48 0.00 0.00 55.95 56.04 1sd3 s SER 123 Cb 0.00 0.50 0.67 0.00 0.10 0.00 0.00 66.02 67.29 1sd3 s SER 123 CO 0.00 -0.94 1.89 0.00 0.98 0.00 0.00 173.24 175.17 1sd3 h ALA 124 N 2.00 1.42 -0.60 5.32 0.00 -1.98 -1.75 119.26 123.67 1sd3 h ALA 124 Ca -0.24 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 1sd3 h ALA 124 Cb 1.23 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1sd3 h ALA 124 CO 0.27 0.40 0.19 -0.44 0.00 0.00 0.00 179.25 179.67 1sd3 h ASP 125 N 0.40 0.84 0.19 0.00 3.32 -1.96 0.19 116.42 119.39 1sd3 h ASP 125 Ca 0.08 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1sd3 h ASP 125 Cb 0.35 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1sd3 h ASP 125 CO 0.02 0.79 -0.18 0.44 -1.72 0.00 0.00 179.24 178.58 1sd3 h ASP 126 N 0.88 0.00 0.16 6.45 3.32 -1.71 -1.23 116.42 124.29 1sd3 h ASP 126 Ca 0.20 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.01 1sd3 h ASP 126 Cb 0.25 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.82 1sd3 h ASP 126 CO -0.01 0.18 -1.09 -0.07 -1.72 0.00 0.00 179.24 176.53 1sd3 h LEU 127 N 0.00 0.52 -1.69 1.55 3.38 -1.07 -3.35 115.31 114.64 1sd3 h LEU 127 Ca -0.00 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.01 1sd3 h LEU 127 Cb 0.33 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1sd3 h LEU 127 CO 0.02 1.51 -0.16 0.00 0.09 0.00 0.00 178.44 179.90 1sd3 h ALA 128 N 0.06 1.23 -0.00 1.53 0.00 -0.41 -2.75 119.26 118.92 1sd3 h ALA 128 Ca -0.20 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1sd3 h ALA 128 Cb 1.77 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1sd3 h ALA 128 CO 0.15 0.20 -0.07 0.36 0.00 0.00 0.00 179.25 179.89 1sd3 n LYS 129 N -3.61 0.68 -4.25 0.00 2.85 -0.49 -4.86 118.16 108.48 1sd3 n LYS 129 Ca -0.01 -0.17 -0.16 0.00 -1.05 0.00 0.00 58.31 56.92 1sd3 n LYS 129 Cb 0.29 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 33.07 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 -2.44 1.05 0.00 -1.58 1.03 -1.04 -5.05 119.66 111.63 1sd3 s GLN 130 Ca 0.31 -1.37 0.00 0.00 0.04 0.00 0.00 55.36 54.34 1sd3 s GLN 130 Cb 0.20 -0.73 0.00 0.00 0.03 0.00 0.00 33.01 32.51 1sd3 s GLN 130 CO 0.46 0.11 0.65 0.25 -2.54 0.00 0.00 175.29 174.22 1sd3 n THR 131 N 0.08 0.30 0.07 3.63 -2.24 -1.26 -4.76 114.28 110.09 1sd3 n THR 131 Ca -0.12 -0.65 -0.08 0.00 -2.27 0.00 0.00 64.05 60.94 1sd3 n THR 131 Cb 0.59 0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 69.63 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 -0.25 -6.24 -0.78 3.64 -1.96 -3.43 116.57 107.55 1sd3 h LYS 132 Ca 0.00 0.02 -0.56 0.00 -1.27 0.00 0.00 60.65 58.84 1sd3 h LYS 132 Cb 0.16 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1sd3 h LYS 132 CO 0.00 0.03 0.74 0.42 -2.27 0.00 0.00 179.45 178.37 1sd3 s ILE 133 N -2.87 4.41 0.50 2.00 1.01 -1.26 -5.02 121.20 119.96 1sd3 s ILE 133 Ca -0.09 1.71 -0.07 0.00 0.00 0.00 0.00 60.65 62.20 1sd3 s ILE 133 Cb 0.00 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1sd3 s ILE 133 CO 0.30 -0.05 0.84 -1.61 0.00 0.00 0.00 174.94 174.42 1sd3 s GLU 134 N 2.60 3.59 0.04 2.79 2.02 -1.18 -4.91 118.70 123.64 1sd3 s GLU 134 Ca 0.53 0.36 -0.17 0.00 0.02 0.00 0.00 54.97 55.71 1sd3 s GLU 134 Cb -0.22 -2.31 0.03 0.00 0.10 0.00 0.00 34.13 31.73 1sd3 s GLU 134 CO 0.18 -0.26 0.38 1.52 0.02 0.00 0.00 175.26 177.09 1sd3 s TYR 135 N -2.79 -0.22 0.00 1.61 -0.85 -1.26 -1.02 117.35 112.82 1sd3 s TYR 135 Ca 0.50 0.17 0.00 0.00 -0.52 0.00 0.00 57.07 57.21 1sd3 s TYR 135 Cb -0.10 0.18 0.00 0.00 0.38 0.00 0.00 41.96 42.41 1sd3 s TYR 135 CO 0.45 -0.54 0.00 0.41 -1.52 0.00 0.00 175.55 174.35 1sd3 n GLY 136 N 0.59 2.68 3.33 5.49 0.00 -1.08 -4.73 105.19 111.47 1sd3 n GLY 136 Ca -0.19 -0.72 -0.09 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 n ALA 137 N -3.00 -1.40 -2.59 4.61 0.00 -1.25 -1.16 120.51 115.72 1sd3 n ALA 137 Ca 0.00 -1.19 -0.42 0.00 0.00 0.00 0.00 53.44 51.83 1sd3 n ALA 137 Cb 0.00 0.95 -0.03 0.00 0.00 0.00 0.00 19.45 20.37 1sd3 n ALA 137 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1sd3 s VAL 138 N -2.28 4.54 0.36 0.00 1.01 -1.26 -1.26 120.40 121.51 1sd3 s VAL 138 Ca 0.16 1.83 -0.28 0.00 0.00 0.00 0.00 61.98 63.68 1sd3 s VAL 138 Cb -0.04 -4.17 -0.11 0.00 0.00 0.00 0.00 36.38 32.06 1sd3 s VAL 138 CO 0.12 0.06 1.45 -0.70 0.00 0.00 0.00 175.10 176.03 1sd3 s GLU 139 N 1.64 4.17 -1.68 2.72 2.12 0.74 -2.90 118.70 125.52 1sd3 s GLU 139 Ca 0.53 2.49 -0.02 0.00 0.36 0.00 0.00 54.97 58.33 1sd3 s GLU 139 Cb -0.23 -2.99 0.00 0.00 0.26 0.00 0.00 34.13 31.17 1sd3 s GLU 139 CO 0.24 -0.45 0.21 -0.25 -0.54 0.00 0.00 175.26 174.46 1sd3 n ASP 140 N 0.57 -5.88 -4.84 -1.70 8.00 -1.26 -4.80 116.55 106.63 1sd3 n ASP 140 Ca 0.01 -0.10 -0.28 0.00 0.71 0.00 0.00 54.79 55.12 1sd3 n ASP 140 Cb 0.40 -4.85 -0.04 0.00 -0.02 0.00 0.00 41.12 36.61 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 -2.28 2.56 0.30 0.44 0.00 -1.14 -1.58 107.32 105.62 1sd3 s GLY 141 Ca 0.11 -1.12 0.03 0.00 0.00 0.00 0.00 44.72 43.74 1sd3 s GLY 141 CO 0.13 -2.01 1.77 0.00 0.00 0.00 0.00 173.10 173.00 1sd3 h ALA 142 N 1.03 1.19 -0.29 3.20 0.00 -1.88 -2.52 119.26 120.00 1sd3 h ALA 142 Ca -0.40 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.19 1sd3 h ALA 142 Cb 1.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1sd3 h ALA 142 CO 0.64 0.52 0.06 1.15 0.00 0.00 0.00 179.25 181.62 1sd3 h THR 143 N 0.46 1.22 -0.44 0.00 2.02 -1.95 -0.63 112.91 113.58 1sd3 h THR 143 Ca 0.08 -0.74 0.01 0.00 0.77 0.00 0.00 66.41 66.53 1sd3 h THR 143 Cb 0.55 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 1sd3 h THR 143 CO 0.04 0.24 0.28 -0.03 0.37 0.00 0.00 175.52 176.42 1sd3 h MET 144 N 0.29 0.55 -0.38 6.66 -1.53 -1.73 -2.30 114.93 116.51 1sd3 h MET 144 Ca 0.09 -0.03 -0.04 0.00 -3.44 0.00 0.00 59.70 56.28 1sd3 h MET 144 Cb 0.30 -0.13 -0.02 0.00 -0.55 0.00 0.00 31.60 31.21 1sd3 h MET 144 CO 0.00 0.37 0.08 1.15 0.14 0.00 0.00 176.91 178.65 1sd3 h THR 145 N 0.57 1.18 -0.36 -0.77 2.02 -1.27 -0.82 112.91 113.46 1sd3 h THR 145 Ca 0.17 -0.64 0.02 0.00 0.77 0.00 0.00 66.41 66.73 1sd3 h THR 145 Cb -0.04 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1sd3 h THR 145 CO -0.05 0.23 0.20 0.15 0.37 0.00 0.00 175.52 176.42 1sd3 h PHE 146 N 0.54 0.37 -0.25 3.16 3.57 -0.55 -0.92 116.94 122.86 1sd3 h PHE 146 Ca 0.13 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.47 1sd3 h PHE 146 Cb 0.22 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.84 1sd3 h PHE 146 CO 0.01 0.22 -0.53 0.74 -2.23 0.00 0.00 178.31 176.51 1sd3 h PHE 147 N 0.41 0.93 0.00 0.41 -1.00 -1.17 -1.12 116.94 115.40 1sd3 h PHE 147 Ca 0.14 -0.32 -0.02 0.00 2.81 0.00 0.00 57.97 60.58 1sd3 h PHE 147 Cb 0.02 -0.18 -0.00 0.00 3.61 0.00 0.00 35.95 39.40 1sd3 h PHE 147 CO -0.08 1.11 -0.10 -0.22 -1.61 0.00 0.00 178.31 177.41 1sd3 h LYS 148 N 0.57 0.00 -0.01 1.51 3.64 -0.82 -2.90 116.57 118.56 1sd3 h LYS 148 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1sd3 h LYS 148 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1sd3 h LYS 148 CO 0.11 0.10 -0.17 1.63 -2.27 0.00 0.00 179.45 178.85 1sd3 n LYS 149 N -4.23 1.50 -2.22 1.90 5.02 -0.38 -5.02 118.16 114.73 1sd3 n LYS 149 Ca -0.03 -1.08 -0.39 0.00 -2.02 0.00 0.00 58.31 54.79 1sd3 n LYS 149 Cb 0.18 -1.27 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 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 -1.58 6.66 0.00 4.39 0.15 -0.43 -4.93 113.70 117.96 1sd3 s SER 150 Ca 0.15 2.49 0.16 0.00 0.70 0.00 0.00 55.95 59.45 1sd3 s SER 150 Cb 0.13 -2.63 0.01 0.00 -1.71 0.00 0.00 66.02 61.81 1sd3 s SER 150 CO 0.29 -0.59 0.85 0.29 1.20 0.00 0.00 173.24 175.28 1sd3 n LYS 151 N 0.45 1.67 -2.28 5.44 5.02 -1.26 -4.48 118.16 122.73 1sd3 n LYS 151 Ca 0.02 -0.86 -0.42 0.00 -2.02 0.00 0.00 58.31 55.03 1sd3 n LYS 151 Cb 0.44 -1.26 -0.03 0.00 -0.02 0.00 0.00 35.03 34.17 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 -1.78 3.92 0.07 -0.18 1.01 -1.26 -4.87 121.20 118.11 1sd3 s ILE 152 Ca 0.13 1.22 -0.13 0.00 0.00 0.00 0.00 60.65 61.88 1sd3 s ILE 152 Cb 0.13 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 1sd3 s ILE 152 CO 0.37 -0.05 1.01 -1.54 0.00 0.00 0.00 174.94 174.73 1sd3 n SER 153 N 5.97 -0.44 -0.20 3.58 3.41 -1.26 -0.28 113.62 124.40 1sd3 n SER 153 Ca 0.14 1.11 0.01 0.00 -0.26 0.00 0.00 58.87 59.87 1sd3 n SER 153 Cb 0.44 -0.28 0.11 0.00 -0.26 0.00 0.00 64.21 64.22 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 0.58 -0.12 6.66 2.02 -2.00 -0.67 112.91 119.39 1sd3 h THR 154 Ca 0.07 -0.07 -0.12 0.00 0.77 0.00 0.00 66.41 67.05 1sd3 h THR 154 Cb 0.17 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.92 1sd3 h THR 154 CO -0.39 0.04 -0.45 1.88 0.37 0.00 0.00 175.52 176.97 1sd3 h TYR 155 N 0.21 0.34 -0.44 3.16 0.99 -1.56 -1.58 116.97 118.08 1sd3 h TYR 155 Ca 0.32 -0.10 -0.05 0.00 2.00 0.00 0.00 58.73 60.90 1sd3 h TYR 155 Cb 0.50 -0.07 -0.02 0.00 1.00 0.00 0.00 36.73 38.14 1sd3 h TYR 155 CO -0.29 0.69 0.09 0.22 -0.00 0.00 0.00 178.16 178.87 1sd3 h ASP 156 N 0.23 0.68 0.15 3.88 1.82 0.48 -0.47 116.42 123.19 1sd3 h ASP 156 Ca 0.02 -0.25 -0.11 0.00 -0.39 0.00 0.00 57.03 56.30 1sd3 h ASP 156 Cb 0.89 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.71 1sd3 h ASP 156 CO 0.07 0.75 -0.39 0.50 -1.61 0.00 0.00 179.24 178.56 1sd3 h LYS 157 N 0.58 0.32 -0.38 0.28 3.64 -1.01 -1.80 116.57 118.20 1sd3 h LYS 157 Ca 0.13 -0.15 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 1sd3 h LYS 157 Cb 0.35 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1sd3 h LYS 157 CO 0.01 0.67 -0.19 0.52 -2.27 0.00 0.00 179.45 178.18 1sd3 h MET 158 N 0.27 0.73 -0.38 1.90 2.86 -0.91 -1.95 114.93 117.46 1sd3 h MET 158 Ca 0.03 -0.28 -0.16 0.00 -2.06 0.00 0.00 59.70 57.23 1sd3 h MET 158 Cb 0.81 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 1sd3 h MET 158 CO 0.06 0.87 -0.39 2.35 1.06 0.00 0.00 176.91 180.87 1sd3 h TRP 159 N 0.65 1.13 -1.00 -0.22 2.91 -0.79 -1.26 115.95 117.36 1sd3 h TRP 159 Ca 0.10 -0.34 0.08 0.00 1.13 0.00 0.00 58.89 59.86 1sd3 h TRP 159 Cb 0.68 -0.24 -0.07 0.00 -0.51 0.00 0.00 29.16 29.02 1sd3 h TRP 159 CO 0.03 1.17 0.64 0.00 -1.03 0.00 0.00 178.44 179.26 1sd3 h ALA 160 N 0.77 1.44 0.54 2.65 0.00 -1.12 0.35 119.26 123.89 1sd3 h ALA 160 Ca 0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1sd3 h ALA 160 Cb 0.99 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1sd3 h ALA 160 CO 0.10 0.38 -0.26 0.35 0.00 0.00 0.00 179.25 179.81 1sd3 h PHE 161 N 1.12 -0.67 -0.37 0.00 3.57 -1.07 -2.20 116.94 117.33 1sd3 h PHE 161 Ca 0.45 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.99 1sd3 h PHE 161 Cb 0.27 0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 1sd3 h PHE 161 CO -0.00 -0.34 0.08 0.52 -2.23 0.00 0.00 178.31 176.34 1sd3 h MET 162 N -1.00 0.21 -0.50 1.11 2.86 -0.88 -2.58 114.93 114.15 1sd3 h MET 162 Ca -0.07 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1sd3 h MET 162 Cb 0.63 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.19 1sd3 h MET 162 CO 0.12 0.14 0.22 1.03 1.06 0.00 0.00 176.91 179.47 1sd3 h SER 163 N 0.21 0.27 0.56 1.22 0.87 -0.35 0.43 113.55 116.76 1sd3 h SER 163 Ca 0.18 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1sd3 h SER 163 Cb 0.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 1sd3 h SER 163 CO -0.22 0.19 0.00 0.77 -0.53 0.00 0.00 176.83 177.04 1sd3 h SER 164 N 0.42 0.00 0.00 6.23 4.64 -1.02 -2.58 113.55 121.24 1sd3 h SER 164 Ca 0.23 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.50 1sd3 h SER 164 Cb 0.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.17 1sd3 h SER 164 CO -0.20 0.00 -0.62 0.54 -0.87 0.00 0.00 176.83 175.68 1sd3 n ARG 165 N -2.71 0.96 -0.34 4.77 1.74 -0.54 -4.93 116.66 115.61 1sd3 n ARG 165 Ca -0.00 -2.69 -0.03 0.00 -0.77 0.00 0.00 57.85 54.36 1sd3 n ARG 165 Cb 0.19 -1.03 0.01 0.00 -1.02 0.00 0.00 32.46 30.60 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 -0.25 0.25 5.56 0.63 0.14 -0.57 116.66 121.85 1sd3 n ARG 166 Ca 0.13 1.34 0.13 0.00 -0.92 0.00 0.00 57.85 58.53 1sd3 n ARG 166 Cb 0.83 -1.98 0.60 0.00 0.45 0.00 0.00 32.46 32.36 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 -1.88 -1.18 115.11 116.12 1sd3 h GLN 167 Ca 0.26 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.73 1sd3 h GLN 167 Cb 0.48 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.22 1sd3 h GLN 167 CO -0.85 0.14 -1.59 0.43 -0.67 0.00 0.00 178.83 176.29 1sd3 n SER 168 N -3.37 0.86 -0.00 1.46 7.64 0.27 -4.58 113.62 115.89 1sd3 n SER 168 Ca -0.00 0.40 0.04 0.00 1.01 0.00 0.00 58.87 60.31 1sd3 n SER 168 Cb 0.35 0.05 -0.06 0.00 -1.01 0.00 0.00 64.21 63.53 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 -2.97 0.00 -3.13 0.44 0.24 -0.17 -4.97 118.33 107.77 1sd3 n VAL 169 Ca -0.14 -0.20 -0.39 0.00 -2.04 0.00 0.00 64.34 61.57 1sd3 n VAL 169 Cb 0.96 0.34 -0.05 0.00 -1.47 0.00 0.00 33.84 33.62 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 -3.53 4.39 0.40 1.34 1.43 -0.45 -3.78 118.68 118.49 1sd3 s LEU 170 Ca -0.03 1.21 0.08 0.00 -1.03 0.00 0.00 54.13 54.36 1sd3 s LEU 170 Cb 0.05 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 1sd3 s LEU 170 CO 0.35 0.03 0.21 0.68 0.23 0.00 0.00 176.35 177.85 1sd3 s VAL 171 N 0.11 2.52 -1.24 -1.59 -7.23 -0.39 -4.83 120.40 107.75 1sd3 s VAL 171 Ca 0.34 -1.62 0.26 0.00 -1.81 0.00 0.00 61.98 59.15 1sd3 s VAL 171 Cb -0.18 -2.99 0.16 0.00 0.56 0.00 0.00 36.38 33.92 1sd3 s VAL 171 CO 0.18 -0.04 1.59 0.29 -0.31 0.00 0.00 175.10 176.82 1sd3 n LYS 172 N -1.29 0.26 -3.59 4.82 4.76 -1.26 -0.18 118.16 121.68 1sd3 n LYS 172 Ca -0.00 -0.13 -0.07 0.00 -2.87 0.00 0.00 58.31 55.24 1sd3 n LYS 172 Cb 0.63 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 32.31 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 -2.83 -0.30 0.21 4.39 1.04 -1.26 -4.84 113.70 110.11 1sd3 s SER 173 Ca 0.17 -0.15 -0.09 0.00 0.48 0.00 0.00 55.95 56.36 1sd3 s SER 173 Cb 0.18 0.43 0.16 0.00 0.10 0.00 0.00 66.02 66.89 1sd3 s SER 173 CO 0.60 -0.74 1.82 0.78 0.98 0.00 0.00 173.24 176.68 1sd3 h ASN 174 N 2.00 0.99 -0.98 7.02 2.35 -1.96 -1.53 115.58 123.46 1sd3 h ASN 174 Ca -0.23 -0.11 0.08 0.00 -0.55 0.00 0.00 56.30 55.49 1sd3 h ASN 174 Cb 1.24 -0.25 -0.07 0.00 0.05 0.00 0.00 38.32 39.29 1sd3 h ASN 174 CO 0.29 0.81 0.62 -0.08 -1.65 0.00 0.00 177.43 177.42 1sd3 h GLU 175 N 1.08 1.04 -0.26 0.81 4.81 -1.98 0.15 114.58 120.23 1sd3 h GLU 175 Ca 0.27 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.31 1sd3 h GLU 175 Cb 0.06 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1sd3 h GLU 175 CO -0.04 0.69 -0.38 1.49 -0.73 0.00 0.00 179.01 180.04 1sd3 h GLU 176 N 1.08 0.59 -0.52 1.92 4.81 -1.77 -2.44 114.58 118.24 1sd3 h GLU 176 Ca 0.44 -0.29 -0.12 0.00 -0.13 0.00 0.00 59.36 59.27 1sd3 h GLU 176 Cb 0.28 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1sd3 h GLU 176 CO -0.21 0.87 -0.13 0.78 -0.73 0.00 0.00 179.01 179.60 1sd3 h GLY 177 N 1.03 1.09 0.94 1.92 0.00 -0.18 -2.21 103.07 105.67 1sd3 h GLY 177 Ca 0.05 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.46 1sd3 h GLY 177 CO 0.08 0.83 0.16 -2.22 0.00 0.00 0.00 176.54 175.38 1sd3 h ILE 178 N 0.88 1.15 -0.31 2.60 2.04 -0.64 -1.47 117.51 121.76 1sd3 h ILE 178 Ca 0.13 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 1sd3 h ILE 178 Cb 0.70 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1sd3 h ILE 178 CO 0.05 0.15 0.03 1.56 0.00 0.00 0.00 178.15 179.94 1sd3 h GLN 179 N 0.37 0.46 -0.58 2.37 1.08 -1.40 -0.78 115.11 116.62 1sd3 h GLN 179 Ca 0.11 -0.08 -0.05 0.00 -1.45 0.00 0.00 58.65 57.18 1sd3 h GLN 179 Cb 0.10 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.43 1sd3 h GLN 179 CO -0.01 0.47 0.19 -0.09 -0.95 0.00 0.00 178.83 178.43 1sd3 h ARG 180 N 0.45 0.91 -0.61 1.46 9.65 -0.88 -0.34 114.38 125.01 1sd3 h ARG 180 Ca 0.10 -0.19 -0.09 0.00 -1.10 0.00 0.00 59.98 58.69 1sd3 h ARG 180 Cb 0.25 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.68 1sd3 h ARG 180 CO 0.00 0.81 0.01 0.28 2.80 0.00 0.00 179.97 183.88 1sd3 h VAL 181 N 0.82 1.26 0.00 0.20 2.07 -0.46 -0.11 116.25 120.03 1sd3 h VAL 181 Ca 0.19 -1.14 -0.08 0.00 0.82 0.00 0.00 66.70 66.49 1sd3 h VAL 181 Cb 0.28 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1sd3 h VAL 181 CO -0.01 0.42 -0.40 -0.07 0.02 0.00 0.00 177.57 177.53 1sd3 h LEU 182 N 0.98 0.00 0.00 2.57 3.38 -0.88 -3.35 115.31 118.00 1sd3 h LEU 182 Ca 0.18 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.79 1sd3 h LEU 182 Cb 0.54 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.23 1sd3 h LEU 182 CO 0.03 0.40 -2.35 0.35 0.09 0.00 0.00 178.44 176.96 1sd3 n THR 183 N -3.53 1.35 -4.38 0.22 -2.24 -0.16 -5.05 114.28 100.48 1sd3 n THR 183 Ca -0.00 -0.81 -0.20 0.00 -2.27 0.00 0.00 64.05 60.77 1sd3 n THR 183 Cb 0.53 -0.55 -0.09 0.00 -2.10 0.00 0.00 70.33 68.12 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 -5.48 1.84 -1.14 3.42 1.04 -0.07 -5.05 113.70 108.25 1sd3 s SER 184 Ca -0.11 -1.56 -0.21 0.00 0.48 0.00 0.00 55.95 54.54 1sd3 s SER 184 Cb 0.06 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.55 1sd3 s SER 184 CO 0.78 -0.87 1.75 1.51 0.98 0.00 0.00 173.24 177.39 1sd3 s ASP 185 N -3.43 6.06 -0.05 7.02 1.47 -1.26 -4.53 116.67 121.95 1sd3 s ASP 185 Ca 0.34 -1.75 -0.04 0.00 1.18 0.00 0.00 52.55 52.28 1sd3 s ASP 185 Cb 0.05 -2.58 0.02 0.00 -0.34 0.00 0.00 42.92 40.07 1sd3 s ASP 185 CO 0.17 -1.95 0.13 -0.47 0.68 0.00 0.00 175.17 173.73 1sd3 s TYR 186 N 6.94 -0.15 -0.07 2.11 5.04 -1.26 -3.12 117.35 126.84 1sd3 s TYR 186 Ca 0.58 0.38 -0.01 0.00 -2.44 0.00 0.00 57.07 55.58 1sd3 s TYR 186 Cb 0.00 0.01 -0.03 0.00 0.35 0.00 0.00 41.96 42.29 1sd3 s TYR 186 CO 0.04 -0.09 -0.02 0.00 -1.34 0.00 0.00 175.55 174.13 1sd3 s ALA 187 N 0.38 3.21 -0.15 3.97 0.00 -0.19 -4.40 121.76 124.58 1sd3 s ALA 187 Ca -0.03 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.10 1sd3 s ALA 187 Cb -0.04 -1.40 0.00 0.00 0.00 0.00 0.00 23.12 21.68 1sd3 s ALA 187 CO -0.02 0.59 -0.18 0.12 0.00 0.00 0.00 175.76 176.27 1sd3 s PHE 188 N -0.89 2.73 -0.43 0.00 5.36 -0.04 -2.63 117.98 122.08 1sd3 s PHE 188 Ca 0.14 -1.17 -0.25 0.00 -0.96 0.00 0.00 56.93 54.69 1sd3 s PHE 188 Cb -0.11 -1.85 0.02 0.00 -0.34 0.00 0.00 43.02 40.74 1sd3 s PHE 188 CO 0.03 -0.53 0.88 -0.51 -1.46 0.00 0.00 175.22 173.63 1sd3 s LEU 189 N 0.80 4.06 0.21 6.12 2.01 -0.31 -0.12 118.68 131.46 1sd3 s LEU 189 Ca -0.06 0.21 -0.03 0.00 0.01 0.00 0.00 54.13 54.26 1sd3 s LEU 189 Cb -0.15 -3.14 -0.03 0.00 0.01 0.00 0.00 46.19 42.87 1sd3 s LEU 189 CO -0.01 -0.94 0.20 0.00 1.01 0.00 0.00 176.35 176.61 1sd3 s MET 190 N 3.52 1.27 0.17 1.70 0.23 -0.83 -4.56 119.30 120.80 1sd3 s MET 190 Ca 0.35 -1.56 -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 33.42 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 4.53 0.31 3.16 2.02 -1.26 -0.74 118.70 122.60 1sd3 s GLU 191 Ca 0.36 1.79 0.08 0.00 0.02 0.00 0.00 54.97 57.22 1sd3 s GLU 191 Cb 0.06 -3.27 0.85 0.00 0.10 0.00 0.00 34.13 31.87 1sd3 s GLU 191 CO 0.12 -0.03 1.71 0.66 0.02 0.00 0.00 175.26 177.73 1sd3 h SER 192 N 5.31 0.52 -0.58 -0.19 4.64 -0.76 -0.67 113.55 121.82 1sd3 h SER 192 Ca -0.44 0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.00 1sd3 h SER 192 Cb 1.21 0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 63.36 1sd3 h SER 192 CO 0.74 0.03 0.26 0.71 -0.87 0.00 0.00 176.83 177.70 1sd3 h THR 193 N 0.47 1.21 0.04 2.95 1.35 -1.89 -0.84 112.91 116.19 1sd3 h THR 193 Ca 0.62 -0.63 -0.22 0.00 -0.55 0.00 0.00 66.41 65.63 1sd3 h THR 193 Cb 1.22 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1sd3 h THR 193 CO -0.52 0.26 -1.00 0.74 -0.25 0.00 0.00 175.52 174.75 1sd3 h THR 194 N 0.87 1.50 -0.94 6.82 2.02 -1.55 -3.07 112.91 118.56 1sd3 h THR 194 Ca 0.21 -2.79 -0.01 0.00 0.77 0.00 0.00 66.41 64.59 1sd3 h THR 194 Cb 0.14 2.62 -0.05 0.00 -1.74 0.00 0.00 68.15 69.13 1sd3 h THR 194 CO -0.02 0.81 0.56 0.40 0.37 0.00 0.00 175.52 177.64 1sd3 h ILE 195 N 0.11 1.26 -0.60 3.11 2.04 -0.85 -0.88 117.51 121.70 1sd3 h ILE 195 Ca -0.07 -0.58 0.05 0.00 1.00 0.00 0.00 64.86 65.26 1sd3 h ILE 195 Cb 1.67 -0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 1sd3 h ILE 195 CO 0.16 0.28 0.32 -0.08 0.00 0.00 0.00 178.15 178.83 1sd3 h GLU 196 N 1.30 0.59 -0.30 2.37 4.81 -1.12 0.10 114.58 122.34 1sd3 h GLU 196 Ca 0.34 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.48 1sd3 h GLU 196 Cb -0.04 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1sd3 h GLU 196 CO -0.06 0.39 -0.03 0.35 -0.73 0.00 0.00 179.01 178.93 1sd3 h PHE 197 N 0.61 0.60 0.12 0.92 3.57 -1.30 -2.95 116.94 118.50 1sd3 h PHE 197 Ca 0.27 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 1sd3 h PHE 197 Cb 0.16 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.75 1sd3 h PHE 197 CO -0.09 0.71 -0.06 0.28 -2.23 0.00 0.00 178.31 176.92 1sd3 h VAL 198 N 0.32 1.00 0.00 1.41 2.07 -0.78 -3.07 116.25 117.19 1sd3 h VAL 198 Ca 0.08 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1sd3 h VAL 198 Cb 0.49 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1sd3 h VAL 198 CO 0.02 0.12 -0.07 0.71 0.02 0.00 0.00 177.57 178.37 1sd3 h THR 199 N -0.39 0.84 0.00 2.57 1.35 -1.08 0.14 112.91 116.33 1sd3 h THR 199 Ca -0.02 -0.27 -0.01 0.00 -0.55 0.00 0.00 66.41 65.57 1sd3 h THR 199 Cb 0.32 1.15 -0.00 0.00 -1.73 0.00 0.00 68.15 67.89 1sd3 h THR 199 CO 0.03 0.07 -0.03 -0.61 -0.25 0.00 0.00 175.52 174.73 1sd3 h GLN 200 N 0.00 0.00 -0.00 4.72 5.75 -1.43 -3.20 115.11 120.95 1sd3 h GLN 200 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1sd3 h GLN 200 Cb 0.15 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.70 1sd3 h GLN 200 CO 0.01 0.03 -0.25 0.54 -2.65 0.00 0.00 178.83 176.50 1sd3 n ARG 201 N -3.13 4.42 -3.73 1.69 1.74 -0.17 -4.79 116.66 112.69 1sd3 n ARG 201 Ca 0.01 -0.10 -0.28 0.00 -0.77 0.00 0.00 57.85 56.70 1sd3 n ARG 201 Cb 0.33 -0.83 -0.12 0.00 -1.02 0.00 0.00 32.46 30.83 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 -1.46 3.62 0.03 0.55 -0.87 0.31 -4.97 114.94 112.16 1sd3 s ASN 202 Ca 0.03 -3.19 0.02 0.00 -1.57 0.00 0.00 52.86 48.15 1sd3 s ASN 202 Cb 0.05 -1.16 0.09 0.00 -0.02 0.00 0.00 41.25 40.21 1sd3 s ASN 202 CO 0.23 -0.18 0.97 0.00 -2.57 0.00 0.00 177.10 175.55 1sd3 n ASN 204 N -1.49 0.88 -4.82 0.00 6.94 -1.26 -4.92 115.26 110.59 1sd3 n ASN 204 Ca -0.00 -0.68 -0.22 0.00 -0.02 0.00 0.00 54.58 53.66 1sd3 n ASN 204 Cb 0.09 0.29 -0.04 0.00 -2.36 0.00 0.00 39.78 37.76 1sd3 n ASN 204 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1sd3 s LEU 205 N -2.75 3.73 0.16 -4.53 1.43 0.42 -1.99 118.68 115.15 1sd3 s LEU 205 Ca 0.17 -0.33 -0.22 0.00 -1.03 0.00 0.00 54.13 52.72 1sd3 s LEU 205 Cb 0.18 -2.28 0.06 0.00 0.03 0.00 0.00 46.19 44.18 1sd3 s LEU 205 CO 0.63 -0.11 0.57 0.28 0.23 0.00 0.00 176.35 177.95 1sd3 s THR 206 N -2.19 0.01 0.32 5.49 -1.32 -0.10 -4.77 115.64 113.09 1sd3 s THR 206 Ca 0.35 -0.13 -0.24 0.00 -1.21 0.00 0.00 61.69 60.45 1sd3 s THR 206 Cb -0.07 -1.06 -0.10 0.00 -1.51 0.00 0.00 72.50 69.76 1sd3 s THR 206 CO 0.25 -0.05 0.91 -1.58 -2.21 0.00 0.00 174.62 171.93 1sd3 s GLN 207 N -3.77 4.48 -0.20 7.08 0.74 -1.26 -1.68 119.66 125.05 1sd3 s GLN 207 Ca 0.02 1.22 -0.02 0.00 0.05 0.00 0.00 55.36 56.63 1sd3 s GLN 207 Cb -0.01 -2.73 0.00 0.00 1.10 0.00 0.00 33.01 31.38 1sd3 s GLN 207 CO -0.12 0.26 -0.10 0.42 -0.55 0.00 0.00 175.29 175.19 1sd3 s ILE 208 N -1.68 2.89 0.00 -2.34 -1.09 0.97 -4.92 121.20 115.02 1sd3 s ILE 208 Ca 0.51 -0.66 0.00 0.00 -2.23 0.00 0.00 60.65 58.27 1sd3 s ILE 208 Cb -0.17 -2.28 0.00 0.00 -1.58 0.00 0.00 42.46 38.43 1sd3 s ILE 208 CO 0.22 0.47 0.00 0.61 -1.23 0.00 0.00 174.94 175.01 1sd3 n GLY 209 N 4.68 -1.39 0.00 6.18 0.00 -1.21 -3.79 105.19 109.65 1sd3 n GLY 209 Ca -0.19 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 2.71 3.72 -0.02 0.00 -1.26 -4.90 105.19 105.44 1sd3 n GLY 210 Ca 0.00 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 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 4.37 0.32 0.99 1.43 -1.26 -4.65 118.68 119.88 1sd3 s LEU 211 Ca 0.00 1.43 0.17 0.00 -1.03 0.00 0.00 54.13 54.70 1sd3 s LEU 211 Cb 0.00 -3.31 0.15 0.00 0.03 0.00 0.00 46.19 43.07 1sd3 s LEU 211 CO 0.00 -0.14 1.49 0.40 0.23 0.00 0.00 176.35 178.33 1sd3 h ILE 212 N 4.63 0.65 -3.05 -0.59 2.04 -0.77 -3.48 117.51 116.93 1sd3 h ILE 212 Ca -0.42 -1.90 -0.08 0.00 1.00 0.00 0.00 64.86 63.46 1sd3 h ILE 212 Cb 1.21 2.31 -0.01 0.00 -0.74 0.00 0.00 36.82 39.58 1sd3 h ILE 212 CO 0.74 0.37 0.12 -0.90 0.00 0.00 0.00 178.15 178.49 1sd3 n ASP 213 N -3.20 -1.66 -3.94 1.72 5.75 -1.26 -4.94 116.55 109.02 1sd3 n ASP 213 Ca 0.02 -2.37 -0.18 0.00 -0.01 0.00 0.00 54.79 52.25 1sd3 n ASP 213 Cb 0.68 2.83 -0.15 0.00 -1.03 0.00 0.00 41.12 43.44 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 -2.71 0.79 0.21 -1.12 0.15 -1.26 -3.90 113.70 105.85 1sd3 s SER 214 Ca 0.16 -0.12 -0.08 0.00 0.70 0.00 0.00 55.95 56.62 1sd3 s SER 214 Cb -0.03 -0.21 0.03 0.00 -1.71 0.00 0.00 66.02 64.10 1sd3 s SER 214 CO 0.12 0.03 0.41 2.29 1.20 0.00 0.00 173.24 177.29 1sd3 n LYS 215 N 3.33 0.59 -3.97 5.44 2.85 -0.20 -4.98 118.16 121.22 1sd3 n LYS 215 Ca -0.18 -1.17 -0.09 0.00 -1.05 0.00 0.00 58.31 55.82 1sd3 n LYS 215 Cb 0.55 1.46 -0.08 0.00 -0.65 0.00 0.00 35.03 36.31 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 -2.08 0.47 -0.10 2.58 0.00 -1.26 -1.10 107.32 105.82 1sd3 s GLY 216 Ca 0.08 -0.93 -0.06 0.00 0.00 0.00 0.00 44.72 43.81 1sd3 s GLY 216 CO 0.06 -0.93 0.14 -0.19 0.00 0.00 0.00 173.10 172.18 1sd3 s TYR 217 N -3.95 3.58 0.14 1.90 4.12 -0.03 -0.65 117.35 122.45 1sd3 s TYR 217 Ca 0.15 0.49 -0.04 0.00 0.02 0.00 0.00 57.07 57.70 1sd3 s TYR 217 Cb 0.04 -1.92 -0.03 0.00 -1.52 0.00 0.00 41.96 38.54 1sd3 s TYR 217 CO -0.03 0.72 0.13 0.20 0.02 0.00 0.00 175.55 176.59 1sd3 s GLY 218 N -1.17 0.85 0.04 0.71 0.00 -0.64 -0.61 107.32 106.49 1sd3 s GLY 218 Ca 0.17 -1.30 -0.27 0.00 0.00 0.00 0.00 44.72 43.32 1sd3 s GLY 218 CO 0.06 -1.20 0.85 0.14 0.00 0.00 0.00 173.10 172.96 1sd3 s VAL 219 N -4.03 4.74 0.06 1.40 1.01 -1.26 -4.40 120.40 117.92 1sd3 s VAL 219 Ca 0.23 1.80 -0.05 0.00 0.00 0.00 0.00 61.98 63.96 1sd3 s VAL 219 Cb 0.06 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1sd3 s VAL 219 CO 0.02 0.30 0.30 -0.83 0.00 0.00 0.00 175.10 174.88 1sd3 s GLY 220 N 0.28 2.24 0.06 4.51 0.00 -0.42 -1.54 107.32 112.45 1sd3 s GLY 220 Ca 0.43 -0.60 -0.03 0.00 0.00 0.00 0.00 44.72 44.52 1sd3 s GLY 220 CO 0.25 -0.47 0.03 -0.51 0.00 0.00 0.00 173.10 172.40 1sd3 s THR 221 N -1.43 0.20 0.59 0.90 -4.23 -0.54 -1.00 115.64 110.12 1sd3 s THR 221 Ca 0.33 -1.62 -0.19 0.00 -1.18 0.00 0.00 61.69 59.02 1sd3 s THR 221 Cb -0.13 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.22 1sd3 s THR 221 CO 0.20 -0.90 1.24 -2.84 -0.54 0.00 0.00 174.62 171.79 1sd3 s PRO 222 N -3.87 2.96 0.29 3.99 0.02 -1.26 -1.57 135.00 135.56 1sd3 s PRO 222 Ca 0.06 1.92 -0.30 0.00 0.02 0.00 0.00 61.00 62.70 1sd3 s PRO 222 Cb 0.07 -1.98 -0.13 0.00 0.02 0.00 0.00 34.50 32.48 1sd3 s PRO 222 CO -0.10 -1.24 1.40 -0.12 -0.33 0.00 0.00 177.00 176.62 1sd3 n MET 223 N -1.51 2.22 -0.55 5.54 1.56 -1.26 -1.47 117.12 121.64 1sd3 n MET 223 Ca 0.13 0.79 0.00 0.00 -0.27 0.00 0.00 57.70 58.35 1sd3 n MET 223 Cb 0.49 -2.44 0.00 0.00 2.15 0.00 0.00 33.22 33.41 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 1.58 1.37 3.73 -5.12 0.00 -1.26 -4.98 105.19 100.52 1sd3 n GLY 224 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 3.92 0.10 1.61 2.88 -0.54 -4.86 113.62 116.71 1sd3 n SER 225 Ca 0.00 1.10 0.11 0.00 -1.33 0.00 0.00 58.87 58.75 1sd3 n SER 225 Cb 0.00 -1.58 0.45 0.00 -0.75 0.00 0.00 64.21 62.33 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 3.08 0.15 0.16 -1.46 -0.04 -1.26 -2.82 135.00 132.82 1sd3 n PRO 226 Ca 0.12 0.37 0.04 0.00 -0.04 0.00 0.00 63.50 63.99 1sd3 n PRO 226 Cb 0.36 -1.78 0.19 0.00 -0.04 0.00 0.00 33.50 32.22 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 -0.06 0.54 0.05 -1.96 -3.36 116.97 112.17 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 0.36 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.06 1sd3 h TYR 227 CO 0.00 0.44 -0.18 -0.09 -1.05 0.00 0.00 178.16 177.28 1sd3 h ARG 228 N 0.00 -0.25 -0.17 4.88 1.12 -1.91 0.35 114.38 118.40 1sd3 h ARG 228 Ca -0.00 0.02 -0.08 0.00 -1.11 0.00 0.00 59.98 58.81 1sd3 h ARG 228 Cb 1.14 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 31.15 1sd3 h ARG 228 CO 0.06 -0.17 -0.24 -0.44 -3.11 0.00 0.00 179.97 176.07 1sd3 h ASP 229 N -0.26 0.29 -0.46 -3.80 3.32 -1.81 -2.03 116.42 111.68 1sd3 h ASP 229 Ca 0.08 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 1sd3 h ASP 229 Cb 0.37 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1sd3 h ASP 229 CO -0.21 0.54 -0.07 0.11 -1.72 0.00 0.00 179.24 177.89 1sd3 h LYS 230 N 0.27 0.85 -0.70 3.56 1.57 -1.58 -2.45 116.57 118.09 1sd3 h LYS 230 Ca 0.04 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.48 1sd3 h LYS 230 Cb 0.57 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 1sd3 h LYS 230 CO 0.04 0.93 0.27 0.82 -0.57 0.00 0.00 179.45 180.94 1sd3 h ILE 231 N 0.69 1.24 -0.74 1.86 1.08 -0.66 -2.20 117.51 118.78 1sd3 h ILE 231 Ca 0.12 -0.78 -0.03 0.00 -0.39 0.00 0.00 64.86 63.78 1sd3 h ILE 231 Cb 0.59 0.42 -0.03 0.00 -3.07 0.00 0.00 36.82 34.73 1sd3 h ILE 231 CO 0.04 0.31 0.33 0.74 -0.69 0.00 0.00 178.15 178.88 1sd3 h THR 232 N 1.02 1.25 -0.47 -0.27 2.02 -1.20 0.60 112.91 115.86 1sd3 h THR 232 Ca 0.23 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.69 1sd3 h THR 232 Cb 0.22 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1sd3 h THR 232 CO -0.02 0.30 0.29 0.40 0.37 0.00 0.00 175.52 176.86 1sd3 h ILE 233 N 1.05 1.14 -0.31 3.11 2.04 -1.02 -0.21 117.51 123.32 1sd3 h ILE 233 Ca 0.25 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1sd3 h ILE 233 Cb 0.16 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1sd3 h ILE 233 CO -0.03 0.14 0.15 0.00 0.00 0.00 0.00 178.15 178.41 1sd3 h ALA 234 N 1.14 0.40 -0.41 1.87 0.00 -0.91 -1.95 119.26 119.41 1sd3 h ALA 234 Ca 0.17 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1sd3 h ALA 234 Cb -0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1sd3 h ALA 234 CO -0.03 -0.03 0.20 0.82 0.00 0.00 0.00 179.25 180.21 1sd3 h ILE 235 N 0.37 1.17 -0.46 0.00 2.04 -0.63 -1.10 117.51 118.90 1sd3 h ILE 235 Ca 0.11 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1sd3 h ILE 235 Cb 0.13 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1sd3 h ILE 235 CO -0.01 0.18 0.16 -0.07 0.00 0.00 0.00 178.15 178.41 1sd3 h LEU 236 N 0.53 0.60 -0.26 1.44 3.38 -0.95 0.30 115.31 120.35 1sd3 h LEU 236 Ca 0.14 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1sd3 h LEU 236 Cb 0.11 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1sd3 h LEU 236 CO -0.02 0.56 -0.05 -0.61 0.09 0.00 0.00 178.44 178.41 1sd3 h GLN 237 N 0.65 0.50 -0.69 1.13 4.15 -0.94 -1.03 115.11 118.89 1sd3 h GLN 237 Ca 0.16 -0.18 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 1sd3 h GLN 237 Cb 0.17 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.80 1sd3 h GLN 237 CO -0.01 0.70 0.36 -0.07 -1.93 0.00 0.00 178.83 177.88 1sd3 h LEU 238 N 0.25 0.85 0.36 -2.39 3.38 -0.73 -1.90 115.31 115.15 1sd3 h LEU 238 Ca 0.07 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1sd3 h LEU 238 Cb 0.51 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1sd3 h LEU 238 CO 0.02 0.70 -0.17 -0.61 0.09 0.00 0.00 178.44 178.47 1sd3 h GLN 239 N 0.96 -0.47 -0.91 1.13 5.75 -0.78 -0.54 115.11 120.25 1sd3 h GLN 239 Ca 0.24 0.03 0.11 0.00 -0.15 0.00 0.00 58.65 58.89 1sd3 h GLN 239 Cb 0.04 0.11 -0.08 0.00 1.07 0.00 0.00 27.48 28.62 1sd3 h GLN 239 CO -0.04 -0.17 0.54 1.49 -2.65 0.00 0.00 178.83 178.00 1sd3 h GLU 240 N -0.79 0.83 0.00 1.69 4.81 -1.01 -0.70 114.58 119.41 1sd3 h GLU 240 Ca -0.05 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1sd3 h GLU 240 Cb 0.52 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1sd3 h GLU 240 CO 0.08 0.55 0.00 -0.85 -0.73 0.00 0.00 179.01 178.06 1sd3 n GLU 241 N -4.71 0.69 -0.86 1.92 0.28 -0.73 -4.89 120.64 112.35 1sd3 n GLU 241 Ca 0.17 0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.17 1sd3 n GLU 241 Cb 0.34 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.71 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 1.02 0.63 0.30 -1.84 0.00 -0.27 -4.94 105.19 100.08 1sd3 n GLY 242 Ca 0.18 0.00 -0.09 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 1.70 1.06 -0.42 1.61 1.63 -1.30 -1.61 116.57 119.26 1sd3 h LYS 243 Ca 0.00 -0.35 -0.06 0.00 -0.85 0.00 0.00 60.65 59.39 1sd3 h LYS 243 Cb 0.00 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 1sd3 h LYS 243 CO 0.00 1.05 0.02 -0.07 -3.45 0.00 0.00 179.45 177.00 1sd3 h LEU 244 N 0.96 0.62 -0.55 5.20 3.38 -1.79 0.12 115.31 123.25 1sd3 h LEU 244 Ca 0.17 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1sd3 h LEU 244 Cb 0.59 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1sd3 h LEU 244 CO 0.04 0.68 -0.26 -0.74 0.09 0.00 0.00 178.44 178.25 1sd3 h HIS 245 N 0.63 1.03 -0.58 1.13 2.76 -1.79 -1.77 115.15 116.56 1sd3 h HIS 245 Ca 0.13 -0.26 -0.05 0.00 -2.20 0.00 0.00 60.37 57.99 1sd3 h HIS 245 Cb 0.37 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 1sd3 h HIS 245 CO 0.02 1.05 0.15 1.98 -1.30 0.00 0.00 177.93 179.82 1sd3 h MET 246 N 0.77 0.91 -0.52 5.26 1.85 -0.64 -2.06 114.93 120.49 1sd3 h MET 246 Ca 0.09 -0.21 -0.08 0.00 -0.61 0.00 0.00 59.70 58.89 1sd3 h MET 246 Cb 0.81 -0.12 -0.02 0.00 0.43 0.00 0.00 31.60 32.70 1sd3 h MET 246 CO 0.07 0.84 0.02 0.52 -0.40 0.00 0.00 176.91 177.96 1sd3 h MET 247 N 0.82 0.86 -0.30 0.39 2.07 -0.83 -1.29 114.93 116.66 1sd3 h MET 247 Ca 0.18 -0.23 -0.02 0.00 -2.07 0.00 0.00 59.70 57.56 1sd3 h MET 247 Cb 0.33 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 29.95 1sd3 h MET 247 CO 0.00 0.85 0.10 -0.22 1.07 0.00 0.00 176.91 178.71 1sd3 h LYS 248 N 0.81 0.46 -0.75 1.72 1.63 -1.07 -2.08 116.57 117.29 1sd3 h LYS 248 Ca 0.16 -0.10 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 1sd3 h LYS 248 Cb 0.45 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.98 1sd3 h LYS 248 CO 0.02 0.51 0.35 0.93 -3.45 0.00 0.00 179.45 177.80 1sd3 h GLU 249 N 0.32 1.09 -0.34 1.90 4.39 -1.16 -0.46 114.58 120.31 1sd3 h GLU 249 Ca 0.10 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1sd3 h GLU 249 Cb 0.24 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 1sd3 h GLU 249 CO -0.00 0.86 0.19 -0.22 -1.16 0.00 0.00 179.01 178.67 1sd3 h LYS 250 N 1.06 0.47 0.00 2.33 3.64 -1.06 0.10 116.57 123.11 1sd3 h LYS 250 Ca 0.26 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1sd3 h LYS 250 Cb 0.14 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1sd3 h LYS 250 CO -0.03 0.39 -0.48 0.91 -2.27 0.00 0.00 179.45 177.97 1sd3 n TRP 251 N -4.78 0.49 -0.08 1.91 7.02 -0.80 -4.11 117.44 117.08 1sd3 n TRP 251 Ca -0.01 0.14 -0.08 0.00 -1.02 0.00 0.00 57.50 56.54 1sd3 n TRP 251 Cb 0.07 -0.63 -0.14 0.00 -2.42 0.00 0.00 31.31 28.20 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 -2.00 0.00 -0.41 -5.99 8.01 -0.19 -4.84 117.44 112.02 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 0.42 -0.84 0.00 0.00 -2.01 0.00 0.00 31.31 28.88 1sd3 n TRP 252 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22