#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m3d s PHE 6 N 0.00 3.38 0.13 1.61 0.40 -1.24 -4.97 117.98 117.30 1m3d s PHE 6 Ca 0.00 1.19 0.07 0.00 -0.60 0.00 0.00 56.93 57.59 1m3d s PHE 6 Cb 0.00 -2.52 -0.04 0.00 0.51 0.00 0.00 43.02 40.97 1m3d s PHE 6 CO 0.00 0.08 -0.17 -0.51 0.70 0.00 0.00 175.22 175.32 1m3d s LEU 7 N -3.07 2.39 -0.06 -0.37 1.43 -1.26 -0.71 118.68 117.04 1m3d s LEU 7 Ca 0.54 -0.80 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1m3d s LEU 7 Cb -0.10 -0.70 0.03 0.00 0.03 0.00 0.00 46.19 45.45 1m3d s LEU 7 CO 0.19 -0.07 0.15 0.54 0.23 0.00 0.00 176.35 177.39 1m3d s VAL 8 N -1.91 -0.03 -0.08 -1.59 0.11 0.09 -4.88 120.40 112.13 1m3d s VAL 8 Ca 0.10 0.09 -0.00 0.00 -2.93 0.00 0.00 61.98 59.24 1m3d s VAL 8 Cb -0.06 -0.23 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 1m3d s VAL 8 CO 0.04 0.04 -0.04 -0.89 -3.33 0.00 0.00 175.10 170.93 1m3d s THR 9 N 0.66 3.98 0.00 5.04 2.01 -1.13 -0.40 115.64 125.80 1m3d s THR 9 Ca -0.05 -0.37 0.06 0.00 0.31 0.00 0.00 61.69 61.64 1m3d s THR 9 Cb -0.06 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.78 1m3d s THR 9 CO -0.03 0.60 -0.19 -0.60 -0.69 0.00 0.00 174.62 173.71 1m3d s ARG 10 N -0.84 1.44 -0.13 4.92 3.52 -0.32 -4.73 118.95 122.81 1m3d s ARG 10 Ca 0.13 -0.74 0.02 0.00 -0.13 0.00 0.00 55.73 55.01 1m3d s ARG 10 Cb -0.11 -1.43 0.00 0.00 -1.56 0.00 0.00 34.95 31.84 1m3d s ARG 10 CO 0.02 0.38 -0.20 -1.01 -0.81 0.00 0.00 175.30 173.68 1m3d s HIS 11 N -0.55 2.68 -0.01 5.12 3.76 -1.26 -1.22 115.29 123.81 1m3d s HIS 11 Ca 0.07 -1.07 0.14 0.00 -0.15 0.00 0.00 55.06 54.05 1m3d s HIS 11 Cb -0.08 -1.80 0.17 0.00 1.11 0.00 0.00 32.58 31.98 1m3d s HIS 11 CO 0.00 -0.46 1.49 0.66 -0.85 0.00 0.00 174.74 175.58 1m3d h SER 12 N 7.01 0.00 -1.40 1.40 4.64 -1.59 -3.45 113.55 120.16 1m3d h SER 12 Ca -0.27 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.70 1m3d h SER 12 Cb 1.21 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.20 1m3d h SER 12 CO 0.53 0.58 -0.37 0.00 -0.87 0.00 0.00 176.83 176.70 1m3d n GLN 13 N -3.34 -1.28 -4.19 4.77 6.02 -1.26 -4.95 117.38 113.15 1m3d n GLN 13 Ca 0.01 1.03 -0.17 0.00 -0.01 0.00 0.00 57.00 57.86 1m3d n GLN 13 Cb 0.72 -5.35 -0.07 0.00 1.02 0.00 0.00 30.24 26.56 1m3d n GLN 13 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1m3d s THR 14 N -2.73 0.00 -1.51 5.09 -4.23 -1.26 -4.06 115.64 106.94 1m3d s THR 14 Ca 0.00 -1.82 0.30 0.00 -1.18 0.00 0.00 61.69 58.99 1m3d s THR 14 Cb 0.00 -2.55 0.55 0.00 1.34 0.00 0.00 72.50 71.83 1m3d s THR 14 CO 0.00 0.00 2.04 0.35 -0.54 0.00 0.00 174.62 176.47 1m3d n THR 15 N -0.57 0.00 -3.64 3.99 -2.24 -1.26 -2.02 114.28 108.53 1m3d n THR 15 Ca 0.04 -0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.46 1m3d n THR 15 Cb 0.62 -0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 68.37 1m3d n THR 15 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1m3d s ASP 16 N -2.51 6.59 0.34 3.42 1.01 -1.26 -4.83 116.67 119.44 1m3d s ASP 16 Ca 0.30 0.71 -0.29 0.00 0.71 0.00 0.00 52.55 53.99 1m3d s ASP 16 Cb 0.20 -2.15 -0.11 0.00 1.01 0.00 0.00 42.92 41.88 1m3d s ASP 16 CO 0.46 0.22 1.40 -1.81 0.21 0.00 0.00 175.17 175.64 1m3d s ASP 17 N -1.69 6.58 0.60 0.27 1.01 -1.26 -4.56 116.67 117.63 1m3d s ASP 17 Ca 0.30 2.84 -0.12 0.00 0.71 0.00 0.00 52.55 56.28 1m3d s ASP 17 Cb -0.14 -2.65 -0.05 0.00 1.01 0.00 0.00 42.92 41.09 1m3d s ASP 17 CO 0.17 -0.69 1.01 -2.16 0.21 0.00 0.00 175.17 173.71 1m3d s PRO 18 N -1.78 3.65 -0.02 8.23 0.04 -1.26 -4.98 135.00 138.88 1m3d s PRO 18 Ca 0.52 0.76 -0.13 0.00 0.04 0.00 0.00 61.00 62.19 1m3d s PRO 18 Cb -0.43 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 31.96 1m3d s PRO 18 CO 0.56 -0.51 0.35 -0.65 0.04 0.00 0.00 177.00 176.79 1m3d s GLN 19 N -4.99 3.80 0.29 4.56 -0.21 -1.26 -4.73 119.66 117.13 1m3d s GLN 19 Ca 0.55 0.28 -0.29 0.00 0.02 0.00 0.00 55.36 55.92 1m3d s GLN 19 Cb -0.11 -3.20 -0.10 0.00 1.00 0.00 0.00 33.01 30.60 1m3d s GLN 19 CO 0.50 0.70 1.42 0.00 -2.12 0.00 0.00 175.29 175.80 1m3d n PRO 21 N 1.65 0.54 -1.73 0.00 -0.02 -1.26 -4.86 135.00 129.32 1m3d n PRO 21 Ca 0.04 0.24 -0.42 0.00 -2.02 0.00 0.00 63.50 61.33 1m3d n PRO 21 Cb 0.40 -2.19 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 1m3d n PRO 21 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1m3d n PRO 22 N -1.69 2.49 -0.02 0.52 -0.02 -1.26 -2.05 135.00 132.98 1m3d n PRO 22 Ca 0.13 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 1m3d n PRO 22 Cb 0.49 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1m3d n PRO 22 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m3d n GLY 23 N 1.79 0.32 3.46 -1.23 0.00 -1.26 -4.96 105.19 103.32 1m3d n GLY 23 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1m3d n GLY 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3d s THR 24 N -2.11 2.12 0.03 2.61 -4.23 -0.87 -4.35 115.64 108.85 1m3d s THR 24 Ca 0.00 -2.26 0.08 0.00 -1.18 0.00 0.00 61.69 58.33 1m3d s THR 24 Cb 0.00 -2.39 -0.02 0.00 1.34 0.00 0.00 72.50 71.42 1m3d s THR 24 CO 0.00 -0.35 -0.22 -1.59 -0.54 0.00 0.00 174.62 171.92 1m3d s LYS 25 N -3.61 1.56 0.33 3.99 -2.85 -0.53 -4.78 119.74 113.85 1m3d s LYS 25 Ca 0.29 -0.94 -0.28 0.00 -1.00 0.00 0.00 55.97 54.05 1m3d s LYS 25 Cb -0.00 -1.65 -0.09 0.00 -2.06 0.00 0.00 37.83 34.03 1m3d s LYS 25 CO 0.14 0.43 1.18 -1.50 0.10 0.00 0.00 175.35 175.70 1m3d s ILE 26 N -0.74 3.15 -0.13 3.79 -1.16 -1.26 0.17 121.20 125.02 1m3d s ILE 26 Ca 0.09 1.09 -0.04 0.00 -0.51 0.00 0.00 60.65 61.28 1m3d s ILE 26 Cb -0.09 -3.67 -0.06 0.00 0.61 0.00 0.00 42.46 39.25 1m3d s ILE 26 CO 0.01 0.21 -0.15 0.18 -2.81 0.00 0.00 174.94 172.39 1m3d n LEU 27 N 0.71 1.55 -3.57 8.50 4.32 0.08 -4.85 117.00 123.74 1m3d n LEU 27 Ca 0.01 0.09 -0.06 0.00 -0.02 0.00 0.00 56.01 56.03 1m3d n LEU 27 Cb 0.44 -0.40 -0.02 0.00 -1.62 0.00 0.00 43.42 41.83 1m3d n LEU 27 CO 0.54 0.40 0.83 -0.72 -1.22 0.00 0.00 177.39 177.23 1m3d s TYR 28 N -2.24 -0.22 0.30 -1.77 -0.85 -1.20 -5.02 117.35 106.35 1m3d s TYR 28 Ca -0.18 0.10 0.09 0.00 -0.52 0.00 0.00 57.07 56.56 1m3d s TYR 28 Cb 0.06 0.54 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 1m3d s TYR 28 CO 0.24 -0.43 0.06 -1.01 -1.52 0.00 0.00 175.55 172.89 1m3d s HIS 29 N -2.83 2.69 0.00 -3.49 3.76 -1.26 -1.17 115.29 112.98 1m3d s HIS 29 Ca 0.08 -0.31 0.00 0.00 -0.15 0.00 0.00 55.06 54.68 1m3d s HIS 29 Cb -0.01 -1.41 0.00 0.00 1.11 0.00 0.00 32.58 32.27 1m3d s HIS 29 CO -0.06 0.49 0.00 0.41 -0.85 0.00 0.00 174.74 174.73 1m3d n GLY 30 N -1.01 2.07 3.62 -2.22 0.00 -0.40 -4.53 105.19 102.72 1m3d n GLY 30 Ca -0.05 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 1m3d n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m3d s TYR 31 N -2.50 2.94 -0.78 1.61 2.02 0.13 -0.98 117.35 119.78 1m3d s TYR 31 Ca 0.00 -0.01 -0.26 0.00 -0.37 0.00 0.00 57.07 56.43 1m3d s TYR 31 Cb 0.00 -1.62 0.02 0.00 -0.40 0.00 0.00 41.96 39.95 1m3d s TYR 31 CO 0.00 0.40 1.48 -1.12 -1.57 0.00 0.00 175.55 174.74 1m3d s SER 32 N -1.47 5.97 -0.14 2.29 0.01 -0.32 -1.64 113.70 118.40 1m3d s SER 32 Ca 0.18 -0.49 -0.22 0.00 1.31 0.00 0.00 55.95 56.72 1m3d s SER 32 Cb -0.11 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 1m3d s SER 32 CO 0.08 -1.95 0.68 -0.22 0.41 0.00 0.00 173.24 172.24 1m3d s LEU 33 N 6.59 4.22 -0.19 2.44 2.96 0.29 -1.16 118.68 133.82 1m3d s LEU 33 Ca 0.46 1.02 -0.15 0.00 -0.22 0.00 0.00 54.13 55.23 1m3d s LEU 33 Cb -0.07 -3.00 -0.10 0.00 0.50 0.00 0.00 46.19 43.51 1m3d s LEU 33 CO 0.10 -0.21 -0.10 -0.11 -1.32 0.00 0.00 176.35 174.71 1m3d n LEU 34 N 4.51 1.87 -3.72 -0.68 7.94 0.45 -4.54 117.00 122.82 1m3d n LEU 34 Ca -0.01 0.48 -0.02 0.00 -1.11 0.00 0.00 56.01 55.34 1m3d n LEU 34 Cb 0.50 -0.88 -0.01 0.00 0.53 0.00 0.00 43.42 43.56 1m3d n LEU 34 CO 0.46 -0.03 0.79 -0.72 -1.11 0.00 0.00 177.39 176.78 1m3d s TYR 35 N -2.42 -0.11 0.21 1.96 1.13 -1.08 -1.92 117.35 115.11 1m3d s TYR 35 Ca -0.25 -0.15 0.07 0.00 -1.41 0.00 0.00 57.07 55.33 1m3d s TYR 35 Cb 0.06 0.62 -0.05 0.00 -1.10 0.00 0.00 41.96 41.49 1m3d s TYR 35 CO 0.42 -0.71 -0.11 0.14 -2.51 0.00 0.00 175.55 172.78 1m3d s VAL 36 N -3.10 1.56 -0.13 -3.49 -7.23 -0.37 0.04 120.40 107.68 1m3d s VAL 36 Ca 0.13 -2.16 -0.03 0.00 -1.81 0.00 0.00 61.98 58.11 1m3d s VAL 36 Cb -0.00 -2.09 0.05 0.00 0.56 0.00 0.00 36.38 34.89 1m3d s VAL 36 CO 0.01 -0.56 0.05 -1.58 -0.31 0.00 0.00 175.10 172.71 1m3d s GLN 37 N -3.69 0.29 -0.04 4.82 0.74 -0.64 -0.60 119.66 120.54 1m3d s GLN 37 Ca 0.23 -0.03 0.05 0.00 0.05 0.00 0.00 55.36 55.66 1m3d s GLN 37 Cb 0.01 -1.44 -0.01 0.00 1.10 0.00 0.00 33.01 32.67 1m3d s GLN 37 CO 0.07 -0.52 -0.19 0.20 -0.55 0.00 0.00 175.29 174.30 1m3d s GLY 38 N 2.04 0.99 -1.35 2.59 0.00 -0.19 -0.97 107.32 110.44 1m3d s GLY 38 Ca 0.03 -0.79 -0.07 0.00 0.00 0.00 0.00 44.72 43.89 1m3d s GLY 38 CO -0.07 -0.49 0.47 -2.01 0.00 0.00 0.00 173.10 171.01 1m3d n ASN 39 N 2.98 -4.51 -0.25 1.64 4.05 -1.26 -1.04 115.26 116.87 1m3d n ASN 39 Ca -0.17 -0.29 -0.03 0.00 0.45 0.00 0.00 54.58 54.53 1m3d n ASN 39 Cb 0.53 -3.71 -0.01 0.00 1.23 0.00 0.00 39.78 37.82 1m3d n ASN 39 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1m3d n GLU 40 N -3.72 -0.93 -4.44 1.20 1.02 -1.26 -5.00 120.64 107.50 1m3d n GLU 40 Ca -0.06 0.44 -0.34 0.00 -0.02 0.00 0.00 57.16 57.19 1m3d n GLU 40 Cb 0.57 -4.26 -0.13 0.00 -0.02 0.00 0.00 31.44 27.61 1m3d n GLU 40 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1m3d s ARG 41 N -1.59 3.59 0.19 3.49 1.81 -0.20 -5.01 118.95 121.22 1m3d s ARG 41 Ca 0.00 -0.56 -0.10 0.00 -1.72 0.00 0.00 55.73 53.34 1m3d s ARG 41 Cb 0.00 -2.86 -0.07 0.00 -0.45 0.00 0.00 34.95 31.57 1m3d s ARG 41 CO 0.00 0.20 0.52 0.00 -0.68 0.00 0.00 175.30 175.34 1m3d s ALA 42 N 0.45 3.60 -0.17 2.13 0.00 -1.26 -1.02 121.76 125.49 1m3d s ALA 42 Ca -0.05 -0.27 -0.05 0.00 0.00 0.00 0.00 51.96 51.60 1m3d s ALA 42 Cb -0.15 -2.42 0.08 0.00 0.00 0.00 0.00 23.12 20.63 1m3d s ALA 42 CO 0.03 0.51 0.31 -1.58 0.00 0.00 0.00 175.76 175.03 1m3d s HIS 43 N -1.69 -0.55 0.49 0.00 2.46 0.23 -4.93 115.29 111.31 1m3d s HIS 43 Ca 0.43 1.01 0.08 0.00 0.47 0.00 0.00 55.06 57.06 1m3d s HIS 43 Cb -0.12 0.02 0.04 0.00 -0.13 0.00 0.00 32.58 32.38 1m3d s HIS 43 CO 0.21 -0.45 0.63 0.20 -2.47 0.00 0.00 174.74 172.85 1m3d s GLY 44 N 2.47 1.91 -0.13 1.59 0.00 -1.26 -1.23 107.32 110.66 1m3d s GLY 44 Ca 0.02 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.89 1m3d s GLY 44 CO -0.11 -1.62 -0.12 1.20 0.00 0.00 0.00 173.10 172.46 1m3d s GLN 45 N -4.45 2.02 0.01 2.90 -1.52 -0.81 -4.96 119.66 112.85 1m3d s GLN 45 Ca 0.56 -0.45 -0.33 0.00 -1.95 0.00 0.00 55.36 53.19 1m3d s GLN 45 Cb -0.07 -1.91 -0.12 0.00 -0.22 0.00 0.00 33.01 30.69 1m3d s GLN 45 CO 0.34 -0.24 1.81 -3.47 -0.25 0.00 0.00 175.29 173.48 1m3d n ASP 46 N 4.80 3.50 0.08 5.90 2.03 -1.26 -4.66 116.55 126.94 1m3d n ASP 46 Ca -0.16 1.00 0.05 0.00 0.52 0.00 0.00 54.79 56.20 1m3d n ASP 46 Cb 0.50 -1.42 0.26 0.00 -0.72 0.00 0.00 41.12 39.74 1m3d n ASP 46 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1m3d n LEU 47 N 5.79 0.25 -0.10 -2.67 4.77 -1.26 -0.69 117.00 123.09 1m3d n LEU 47 Ca 0.20 0.57 0.12 0.00 -0.03 0.00 0.00 56.01 56.87 1m3d n LEU 47 Cb 0.31 -0.58 0.23 0.00 -2.33 0.00 0.00 43.42 41.05 1m3d n LEU 47 CO 0.69 -0.65 0.44 0.61 -1.33 0.00 0.00 177.39 177.16 1m3d n GLY 48 N -1.36 -0.97 3.82 -0.72 0.00 -1.26 -4.47 105.19 100.23 1m3d n GLY 48 Ca -0.01 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 1m3d n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3d s THR 49 N -2.83 4.46 0.40 2.61 -4.23 0.13 -2.84 115.64 113.34 1m3d s THR 49 Ca 0.15 -1.31 0.38 0.00 -1.18 0.00 0.00 61.69 59.72 1m3d s THR 49 Cb 0.18 -3.37 0.38 0.00 1.34 0.00 0.00 72.50 71.02 1m3d s THR 49 CO 0.66 -0.28 2.15 0.00 -0.54 0.00 0.00 174.62 176.62 1m3d h ALA 50 N 1.76 1.00 0.00 3.99 0.00 -1.91 -1.86 119.26 122.23 1m3d h ALA 50 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1m3d h ALA 50 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1m3d h ALA 50 CO 0.61 0.00 0.00 0.78 0.00 0.00 0.00 179.25 180.64 1m3d h GLY 51 N 0.00 0.00 -1.42 0.00 0.00 -1.95 -1.76 103.07 97.95 1m3d h GLY 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1m3d h GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1m3d n SER 52 N -2.48 2.38 -3.95 0.19 3.41 -0.70 -4.71 113.62 107.76 1m3d n SER 52 Ca 0.01 -1.83 -0.31 0.00 -0.26 0.00 0.00 58.87 56.48 1m3d n SER 52 Cb 0.20 -0.16 -0.15 0.00 -0.26 0.00 0.00 64.21 63.84 1m3d n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m3d s LEU 54 N 1.12 3.99 0.41 0.00 1.43 -0.65 -4.81 118.68 120.16 1m3d s LEU 54 Ca 0.07 0.20 0.10 0.00 -1.03 0.00 0.00 54.13 53.47 1m3d s LEU 54 Cb -0.19 -1.99 0.87 0.00 0.03 0.00 0.00 46.19 44.90 1m3d s LEU 54 CO -0.11 0.25 1.98 0.03 0.23 0.00 0.00 176.35 178.73 1m3d h ARG 55 N 6.15 0.29 -5.79 1.70 3.08 -1.88 0.36 114.38 118.28 1m3d h ARG 55 Ca -0.43 -0.05 -0.69 0.00 0.07 0.00 0.00 59.98 58.89 1m3d h ARG 55 Cb 1.18 -0.05 -0.31 0.00 0.08 0.00 0.00 29.97 30.87 1m3d h ARG 55 CO 0.67 0.32 -0.87 0.15 -1.07 0.00 0.00 179.97 179.17 1m3d s LYS 56 N -4.97 2.74 0.31 0.04 1.02 -1.26 -4.66 119.74 112.96 1m3d s LYS 56 Ca -0.06 -0.88 -0.01 0.00 0.02 0.00 0.00 55.97 55.04 1m3d s LYS 56 Cb 0.16 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 35.20 1m3d s LYS 56 CO 0.72 0.32 0.52 0.12 -0.92 0.00 0.00 175.35 176.12 1m3d s PHE 57 N -0.01 3.49 -0.27 3.18 2.19 -1.26 -4.92 117.98 120.37 1m3d s PHE 57 Ca -0.08 0.41 -0.27 0.00 0.33 0.00 0.00 56.93 57.33 1m3d s PHE 57 Cb -0.15 -1.94 0.17 0.00 -1.31 0.00 0.00 43.02 39.80 1m3d s PHE 57 CO 0.05 0.17 1.30 0.45 1.83 0.00 0.00 175.22 179.02 1m3d s SER 58 N -3.70 -0.15 0.39 6.13 0.15 -1.26 -5.00 113.70 110.27 1m3d s SER 58 Ca 0.41 0.25 0.28 0.00 0.70 0.00 0.00 55.95 57.59 1m3d s SER 58 Cb -0.10 0.23 1.24 0.00 -1.71 0.00 0.00 66.02 65.68 1m3d s SER 58 CO 0.34 -0.08 1.85 0.71 1.20 0.00 0.00 173.24 177.25 1m3d h THR 59 N 2.81 0.00 -2.52 6.45 1.35 -1.94 -3.32 112.91 115.75 1m3d h THR 59 Ca -0.21 -0.29 -0.59 0.00 -0.55 0.00 0.00 66.41 64.77 1m3d h THR 59 Cb 1.19 1.11 -0.39 0.00 -1.73 0.00 0.00 68.15 68.33 1m3d h THR 59 CO 0.20 0.00 -0.90 -0.32 -0.25 0.00 0.00 175.52 174.25 1m3d s MET 60 N -3.52 0.89 0.00 4.72 -2.45 -1.26 -4.16 119.30 113.52 1m3d s MET 60 Ca 0.02 -1.91 0.24 0.00 -1.25 0.00 0.00 55.69 52.80 1m3d s MET 60 Cb 0.09 -1.55 1.46 0.00 1.25 0.00 0.00 34.83 36.08 1m3d s MET 60 CO 0.43 -1.31 1.92 -0.35 1.05 0.00 0.00 175.02 176.76 1m3d n PRO 61 N 3.25 0.98 -4.22 4.11 -0.04 -1.25 -4.89 135.00 132.94 1m3d n PRO 61 Ca 0.22 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.55 1m3d n PRO 61 Cb 0.43 -1.39 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 1m3d n PRO 61 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1m3d s PHE 62 N -2.00 1.27 0.18 0.54 -0.71 -1.26 -5.10 117.98 110.89 1m3d s PHE 62 Ca 0.37 -1.43 -0.04 0.00 -1.04 0.00 0.00 56.93 54.79 1m3d s PHE 62 Cb 0.17 -0.59 -0.03 0.00 -1.21 0.00 0.00 43.02 41.35 1m3d s PHE 62 CO 0.28 -0.68 0.17 -0.48 -1.34 0.00 0.00 175.22 173.18 1m3d s LEU 63 N -3.20 1.23 0.07 -1.99 0.05 -1.26 -4.47 118.68 109.10 1m3d s LEU 63 Ca 0.39 -1.19 0.04 0.00 0.05 0.00 0.00 54.13 53.42 1m3d s LEU 63 Cb 0.06 0.65 -0.03 0.00 -2.05 0.00 0.00 46.19 44.82 1m3d s LEU 63 CO 0.15 -0.85 -0.11 0.72 -0.55 0.00 0.00 176.35 175.71 1m3d s PHE 64 N -4.07 1.02 0.09 3.48 -0.12 -0.80 -4.98 117.98 112.60 1m3d s PHE 64 Ca 0.28 -0.52 0.07 0.00 -0.05 0.00 0.00 56.93 56.72 1m3d s PHE 64 Cb 0.06 -0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 41.84 1m3d s PHE 64 CO 0.06 0.00 -0.19 0.00 -0.05 0.00 0.00 175.22 175.04 1m3d s ASN 66 N -1.83 4.69 0.00 0.00 2.20 -0.21 -4.99 114.94 114.80 1m3d s ASN 66 Ca 0.04 -1.18 0.21 0.00 -0.94 0.00 0.00 52.86 50.99 1m3d s ASN 66 Cb -0.10 0.33 1.20 0.00 -2.00 0.00 0.00 41.25 40.69 1m3d s ASN 66 CO 0.04 -1.09 1.66 2.30 -2.94 0.00 0.00 177.10 177.07 1m3d n ILE 67 N -1.78 0.12 0.32 0.54 -5.35 -1.26 -2.41 119.36 109.54 1m3d n ILE 67 Ca 0.00 0.03 0.08 0.00 -0.27 0.00 0.00 62.75 62.60 1m3d n ILE 67 Cb 0.64 -0.69 0.23 0.00 -1.74 0.00 0.00 39.64 38.08 1m3d n ILE 67 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1m3d n ASN 68 N -1.09 2.84 -2.48 7.28 3.02 -1.26 -4.92 115.26 118.64 1m3d n ASN 68 Ca 0.14 -2.01 -0.17 0.00 -0.03 0.00 0.00 54.58 52.52 1m3d n ASN 68 Cb 0.10 -0.36 0.04 0.00 -0.61 0.00 0.00 39.78 38.96 1m3d n ASN 68 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1m3d n ASN 69 N 1.04 -5.01 -4.17 6.41 3.02 -1.01 -5.02 115.26 110.52 1m3d n ASN 69 Ca 0.18 -0.30 -0.28 0.00 -0.03 0.00 0.00 54.58 54.15 1m3d n ASN 69 Cb 0.45 -3.74 -0.16 0.00 -0.61 0.00 0.00 39.78 35.72 1m3d n ASN 69 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1m3d s VAL 70 N -3.12 1.61 0.05 2.41 1.01 -1.26 -4.99 120.40 116.12 1m3d s VAL 70 Ca 0.32 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.58 1m3d s VAL 70 Cb -0.14 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1m3d s VAL 70 CO 0.40 0.46 -0.25 0.00 0.00 0.00 0.00 175.10 175.71 1m3d s ASN 72 N -1.31 2.50 -0.15 0.00 0.01 0.95 -4.98 114.94 111.96 1m3d s ASN 72 Ca 0.11 -0.44 0.00 0.00 -0.71 0.00 0.00 52.86 51.82 1m3d s ASN 72 Cb -0.10 -1.14 -0.00 0.00 0.41 0.00 0.00 41.25 40.42 1m3d s ASN 72 CO 0.02 0.10 -0.15 0.12 -1.51 0.00 0.00 177.10 175.69 1m3d s PHE 73 N 0.47 2.79 -1.41 2.20 5.36 -1.26 -1.90 117.98 124.23 1m3d s PHE 73 Ca -0.17 -0.94 -0.12 0.00 -0.96 0.00 0.00 56.93 54.74 1m3d s PHE 73 Cb -0.17 -1.88 0.09 0.00 -0.34 0.00 0.00 43.02 40.72 1m3d s PHE 73 CO 0.07 -0.41 0.63 0.00 -1.46 0.00 0.00 175.22 174.05 1m3d n ALA 74 N 3.95 -1.13 -1.43 11.12 0.00 -1.26 -4.86 120.51 126.90 1m3d n ALA 74 Ca -0.19 0.10 0.06 0.00 0.00 0.00 0.00 53.44 53.41 1m3d n ALA 74 Cb 0.52 -3.26 0.19 0.00 0.00 0.00 0.00 19.45 16.90 1m3d n ALA 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1m3d n SER 75 N -2.45 2.02 0.00 0.00 7.64 -1.26 -4.84 113.62 114.72 1m3d n SER 75 Ca 0.01 -3.65 0.00 0.00 1.01 0.00 0.00 58.87 56.24 1m3d n SER 75 Cb 0.53 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1m3d n SER 75 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1m3d n ARG 76 N -1.19 0.00 -2.84 1.43 0.63 -1.26 -5.09 116.66 108.34 1m3d n ARG 76 Ca 0.20 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 57.01 1m3d n ARG 76 Cb 0.72 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.66 1m3d n ARG 76 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1m3d n ASN 77 N 0.00 0.18 -4.98 6.15 5.03 -1.26 -4.93 115.26 115.45 1m3d n ASN 77 Ca 0.00 -2.90 -0.20 0.00 0.87 0.00 0.00 54.58 52.35 1m3d n ASN 77 Cb 0.00 0.03 0.00 0.00 -1.02 0.00 0.00 39.78 38.79 1m3d n ASN 77 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1m3d s ASP 78 N -2.33 5.91 0.29 6.41 -0.00 -1.26 -4.89 116.67 120.80 1m3d s ASP 78 Ca 0.30 -0.03 0.07 0.00 -0.00 0.00 0.00 52.55 52.89 1m3d s ASP 78 Cb 0.39 -1.32 -0.06 0.00 -0.00 0.00 0.00 42.92 41.93 1m3d s ASP 78 CO -0.03 -0.54 -0.06 -0.31 -0.00 0.00 0.00 175.17 174.23 1m3d s TYR 79 N -2.31 2.05 -0.05 4.23 1.51 -0.14 -1.66 117.35 120.97 1m3d s TYR 79 Ca 0.46 -0.66 -0.05 0.00 -1.01 0.00 0.00 57.07 55.81 1m3d s TYR 79 Cb -0.10 -1.18 0.01 0.00 -0.11 0.00 0.00 41.96 40.59 1m3d s TYR 79 CO 0.33 0.34 0.14 -1.54 -1.11 0.00 0.00 175.55 173.71 1m3d s SER 80 N -3.48 -0.13 -0.03 2.29 1.04 -0.81 -1.62 113.70 110.96 1m3d s SER 80 Ca 0.30 0.23 0.05 0.00 0.48 0.00 0.00 55.95 57.01 1m3d s SER 80 Cb 0.04 0.28 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 1m3d s SER 80 CO 0.13 -0.08 -0.17 -0.31 0.98 0.00 0.00 173.24 173.79 1m3d s TYR 81 N -0.07 1.67 0.04 5.02 2.02 0.11 -0.80 117.35 125.34 1m3d s TYR 81 Ca -0.01 -0.43 0.04 0.00 -0.37 0.00 0.00 57.07 56.30 1m3d s TYR 81 Cb -0.02 -1.11 -0.02 0.00 -0.40 0.00 0.00 41.96 40.41 1m3d s TYR 81 CO 0.00 -0.12 -0.12 -1.58 -1.57 0.00 0.00 175.55 172.16 1m3d s TRP 82 N -0.11 1.02 0.49 2.71 0.52 -0.92 -0.41 118.94 122.23 1m3d s TRP 82 Ca -0.00 -0.40 -0.24 0.00 0.02 0.00 0.00 56.10 55.48 1m3d s TRP 82 Cb -0.10 -0.60 -0.07 0.00 -1.15 0.00 0.00 33.47 31.56 1m3d s TRP 82 CO 0.01 0.01 1.36 -0.51 0.02 0.00 0.00 176.95 177.84 1m3d s LEU 83 N -1.32 4.01 0.46 2.99 1.43 -0.31 -0.77 118.68 125.17 1m3d s LEU 83 Ca -0.02 2.76 0.06 0.00 -1.03 0.00 0.00 54.13 55.90 1m3d s LEU 83 Cb -0.08 -4.10 -0.03 0.00 0.03 0.00 0.00 46.19 42.01 1m3d s LEU 83 CO 0.01 -1.28 0.19 -0.94 0.23 0.00 0.00 176.35 174.56 1m3d s SER 84 N -0.80 4.39 0.48 2.29 1.04 0.64 -1.30 113.70 120.43 1m3d s SER 84 Ca 0.65 -1.23 0.08 0.00 0.48 0.00 0.00 55.95 55.93 1m3d s SER 84 Cb -0.40 -0.10 0.08 0.00 0.10 0.00 0.00 66.02 65.69 1m3d s SER 84 CO 0.50 -0.72 0.65 0.35 0.98 0.00 0.00 173.24 175.00 1m3d n THR 85 N -1.34 0.00 1.87 2.02 -2.24 -0.52 -4.56 114.28 109.51 1m3d n THR 85 Ca -0.05 -1.61 0.08 0.00 -2.27 0.00 0.00 64.05 60.20 1m3d n THR 85 Cb 0.65 -0.58 0.41 0.00 -2.10 0.00 0.00 70.33 68.71 1m3d n THR 85 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1m3d n PRO 86 N -2.03 1.11 -1.67 -0.78 -0.04 -1.26 -4.87 135.00 125.46 1m3d n PRO 86 Ca 0.13 -0.17 -0.47 0.00 -0.04 0.00 0.00 63.50 62.95 1m3d n PRO 86 Cb 0.50 -1.25 -0.04 0.00 -0.04 0.00 0.00 33.50 32.67 1m3d n PRO 86 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1m3d n GLU 87 N -0.56 2.10 -2.46 0.54 4.07 -1.26 -4.94 120.64 118.12 1m3d n GLU 87 Ca 0.11 0.76 -0.32 0.00 -0.06 0.00 0.00 57.16 57.65 1m3d n GLU 87 Cb 0.09 -2.54 -0.04 0.00 -0.06 0.00 0.00 31.44 28.89 1m3d n GLU 87 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1m3d s PRO 88 N 1.69 3.98 0.63 5.31 0.04 -1.26 -4.99 135.00 140.39 1m3d s PRO 88 Ca 0.83 1.00 -0.18 0.00 0.04 0.00 0.00 61.00 62.68 1m3d s PRO 88 Cb -0.70 -2.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 1m3d s PRO 88 CO 0.42 -0.25 1.23 -1.64 0.04 0.00 0.00 177.00 176.80 1m3d s MET 89 N -3.91 2.73 0.70 4.56 -1.94 -1.26 -4.95 119.30 115.23 1m3d s MET 89 Ca 0.60 1.86 -0.16 0.00 -1.71 0.00 0.00 55.69 56.28 1m3d s MET 89 Cb -0.10 -1.89 0.02 0.00 2.01 0.00 0.00 34.83 34.87 1m3d s MET 89 CO 0.28 -1.40 1.19 -2.14 -0.01 0.00 0.00 175.02 172.94 1m3d s PRO 90 N -3.46 2.38 0.55 2.03 0.02 -1.26 -4.86 135.00 130.41 1m3d s PRO 90 Ca 0.78 1.71 0.25 0.00 0.02 0.00 0.00 61.00 63.76 1m3d s PRO 90 Cb -0.32 -1.87 1.48 0.00 0.02 0.00 0.00 34.50 33.81 1m3d s PRO 90 CO 0.37 -1.64 2.05 0.52 -0.33 0.00 0.00 177.00 177.97 1m3d h MET 91 N -0.06 0.00 0.00 5.54 2.86 -1.98 0.61 114.93 121.91 1m3d h MET 91 Ca -0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1m3d h MET 91 Cb 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 1m3d h MET 91 CO 0.51 0.00 0.00 0.66 1.06 0.00 0.00 176.91 179.14 1m3d h SER 92 N 0.00 0.00 -0.43 1.22 4.64 -2.03 -3.46 113.55 113.49 1m3d h SER 92 Ca 0.15 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.28 1m3d h SER 92 Cb 0.67 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.69 1m3d h SER 92 CO -0.00 0.00 -0.17 0.23 -0.87 0.00 0.00 176.83 176.02 1m3d n MET 93 N -2.85 -1.48 -2.79 4.77 0.00 0.21 -4.97 117.12 110.00 1m3d n MET 93 Ca 0.02 0.78 -0.28 0.00 0.00 0.00 0.00 57.70 58.22 1m3d n MET 93 Cb 0.35 -5.05 -0.01 0.00 0.00 0.00 0.00 33.22 28.51 1m3d n MET 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1m3d s ALA 94 N -1.91 3.43 0.43 3.04 0.00 -1.26 -5.00 121.76 120.49 1m3d s ALA 94 Ca 0.00 -0.48 -0.24 0.00 0.00 0.00 0.00 51.96 51.24 1m3d s ALA 94 Cb 0.00 -2.55 -0.10 0.00 0.00 0.00 0.00 23.12 20.47 1m3d s ALA 94 CO 0.00 -0.21 1.08 -2.30 0.00 0.00 0.00 175.76 174.33 1m3d n PRO 95 N -1.92 1.48 -3.56 0.00 -0.02 -1.26 -4.80 135.00 124.92 1m3d n PRO 95 Ca 0.00 0.53 -0.35 0.00 -2.02 0.00 0.00 63.50 61.66 1m3d n PRO 95 Cb 0.55 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.83 1m3d n PRO 95 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1m3d s ILE 96 N -1.26 5.08 0.07 4.25 1.01 0.73 -4.88 121.20 126.21 1m3d s ILE 96 Ca 0.63 0.52 -0.03 0.00 0.00 0.00 0.00 60.65 61.78 1m3d s ILE 96 Cb -0.54 -3.66 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 1m3d s ILE 96 CO 0.56 0.34 0.05 0.42 0.00 0.00 0.00 174.94 176.31 1m3d s THR 97 N -1.34 0.18 0.00 2.92 -4.23 -1.26 -1.37 115.64 110.53 1m3d s THR 97 Ca 0.31 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1m3d s THR 97 Cb -0.14 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 72.15 1m3d s THR 97 CO 0.17 -0.82 0.00 0.61 -0.54 0.00 0.00 174.62 174.04 1m3d n GLY 98 N 0.03 1.84 0.33 3.99 0.00 -1.26 -2.55 105.19 107.57 1m3d n GLY 98 Ca -0.13 -0.49 0.18 0.00 0.00 0.00 0.00 46.02 45.58 1m3d n GLY 98 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1m3d h GLU 99 N 0.00 0.00 0.00 1.61 4.39 -1.99 -1.14 114.58 117.45 1m3d h GLU 99 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1m3d h GLU 99 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1m3d h GLU 99 CO 0.00 0.00 0.00 -0.91 -1.16 0.00 0.00 179.01 176.94 1m3d h ASN 100 N 0.00 0.00 0.31 1.42 2.35 -1.91 -1.68 115.58 116.07 1m3d h ASN 100 Ca 0.04 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.60 1m3d h ASN 100 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1m3d h ASN 100 CO -0.00 0.00 -0.74 0.40 -1.65 0.00 0.00 177.43 175.44 1m3d h ILE 101 N 0.00 1.39 -0.92 2.81 2.04 -1.33 -3.35 117.51 118.15 1m3d h ILE 101 Ca 0.00 -2.18 0.22 0.00 1.00 0.00 0.00 64.86 63.90 1m3d h ILE 101 Cb 0.02 2.15 -0.17 0.00 -0.74 0.00 0.00 36.82 38.07 1m3d h ILE 101 CO 0.00 0.65 -0.06 -0.09 0.00 0.00 0.00 178.15 178.65 1m3d h ARG 102 N 0.24 0.03 0.00 2.37 9.65 -1.47 0.25 114.38 125.45 1m3d h ARG 102 Ca -0.03 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1m3d h ARG 102 Cb 1.31 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.88 1m3d h ARG 102 CO 0.12 0.02 0.00 -1.35 2.80 0.00 0.00 179.97 181.56 1m3d h PRO 103 N 0.03 0.00 0.00 0.20 0.11 -1.77 -3.06 132.00 127.51 1m3d h PRO 103 Ca 0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.62 1m3d h PRO 103 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1m3d h PRO 103 CO -0.88 0.00 -1.03 1.19 -0.21 0.00 0.00 178.00 177.07 1m3d n PHE 104 N -2.62 0.47 -3.33 0.65 3.01 0.08 -4.60 117.46 111.11 1m3d n PHE 104 Ca -0.01 0.14 -0.38 0.00 1.01 0.00 0.00 57.45 58.21 1m3d n PHE 104 Cb 0.12 -0.61 -0.06 0.00 -0.01 0.00 0.00 39.48 38.91 1m3d n PHE 104 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1m3d s ILE 105 N -3.26 5.17 0.54 4.37 1.09 -1.16 -1.44 121.20 126.51 1m3d s ILE 105 Ca 0.02 0.94 -0.19 0.00 -1.10 0.00 0.00 60.65 60.32 1m3d s ILE 105 Cb 0.13 -3.80 -0.06 0.00 -1.06 0.00 0.00 42.46 37.66 1m3d s ILE 105 CO 0.79 0.35 1.10 -0.55 -0.10 0.00 0.00 174.94 176.53 1m3d s SER 106 N 0.47 5.86 0.30 3.58 0.15 -0.42 -4.42 113.70 119.21 1m3d s SER 106 Ca 0.25 2.07 0.07 0.00 0.70 0.00 0.00 55.95 59.04 1m3d s SER 106 Cb -0.15 -2.57 -0.02 0.00 -1.71 0.00 0.00 66.02 61.56 1m3d s SER 106 CO 0.10 -1.12 0.34 -0.13 1.20 0.00 0.00 173.24 173.63 1m3d s ARG 107 N -3.39 3.03 0.15 5.44 1.81 -0.86 -1.17 118.95 123.97 1m3d s ARG 107 Ca 0.70 -1.05 -0.07 0.00 -1.72 0.00 0.00 55.73 53.59 1m3d s ARG 107 Cb -0.21 -2.68 -0.01 0.00 -0.45 0.00 0.00 34.95 31.59 1m3d s ARG 107 CO 0.27 0.22 0.23 0.00 -0.68 0.00 0.00 175.30 175.34 1m3d s ALA 109 N -3.98 0.28 -0.25 0.00 0.00 -0.35 -1.27 121.76 116.18 1m3d s ALA 109 Ca 0.18 0.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.12 1m3d s ALA 109 Cb 0.04 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1m3d s ALA 109 CO -0.00 -0.02 0.11 0.08 0.00 0.00 0.00 175.76 175.93 1m3d s VAL 110 N 0.63 4.76 0.12 0.00 1.01 -0.32 -1.18 120.40 125.43 1m3d s VAL 110 Ca -0.06 -0.02 0.11 0.00 0.00 0.00 0.00 61.98 62.01 1m3d s VAL 110 Cb -0.09 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1m3d s VAL 110 CO -0.01 0.32 -0.27 0.00 0.00 0.00 0.00 175.10 175.14 1m3d s GLU 112 N -1.97 4.11 0.11 0.00 2.12 0.13 -0.73 118.70 122.46 1m3d s GLU 112 Ca 0.14 0.14 0.10 0.00 0.36 0.00 0.00 54.97 55.70 1m3d s GLU 112 Cb -0.10 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 1m3d s GLU 112 CO 0.06 0.38 -0.22 0.00 -0.54 0.00 0.00 175.26 174.93 1m3d s ALA 113 N 0.03 2.52 0.48 6.30 0.00 0.11 -1.45 121.76 129.75 1m3d s ALA 113 Ca 0.18 -1.37 0.24 0.00 0.00 0.00 0.00 51.96 51.01 1m3d s ALA 113 Cb -0.14 -0.54 1.44 0.00 0.00 0.00 0.00 23.12 23.89 1m3d s ALA 113 CO 0.06 0.56 2.11 -1.35 0.00 0.00 0.00 175.76 177.14 1m3d h PRO 114 N 3.97 0.00 0.00 0.00 0.11 -1.86 -3.28 132.00 130.94 1m3d h PRO 114 Ca -0.50 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1m3d h PRO 114 Cb 1.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1m3d h PRO 114 CO 0.43 0.09 -0.01 0.00 -0.21 0.00 0.00 178.00 178.31 1m3d n ALA 115 N -2.36 -0.36 -1.70 -0.75 0.00 -1.26 -4.89 120.51 109.19 1m3d n ALA 115 Ca -0.02 -0.70 -0.40 0.00 0.00 0.00 0.00 53.44 52.31 1m3d n ALA 115 Cb 0.19 0.56 0.02 0.00 0.00 0.00 0.00 19.45 20.22 1m3d n ALA 115 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1m3d n MET 116 N -0.26 1.81 -4.98 0.00 2.81 -1.26 -4.79 117.12 110.45 1m3d n MET 116 Ca -0.01 0.65 -0.27 0.00 -1.81 0.00 0.00 57.70 56.25 1m3d n MET 116 Cb 0.27 -2.39 -0.16 0.00 -0.71 0.00 0.00 33.22 30.24 1m3d n MET 116 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1m3d s VAL 117 N -1.24 1.62 0.28 2.03 1.01 -1.26 -2.72 120.40 120.13 1m3d s VAL 117 Ca 0.64 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 1m3d s VAL 117 Cb -0.49 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 1m3d s VAL 117 CO 0.56 0.46 0.40 0.00 0.00 0.00 0.00 175.10 176.52 1m3d s MET 118 N -0.24 1.65 0.11 2.72 0.23 0.04 -4.80 119.30 119.00 1m3d s MET 118 Ca 0.02 -1.58 0.09 0.00 -1.03 0.00 0.00 55.69 53.19 1m3d s MET 118 Cb -0.10 0.41 -0.04 0.00 -1.53 0.00 0.00 34.83 33.58 1m3d s MET 118 CO 0.01 -0.66 -0.23 0.00 -2.03 0.00 0.00 175.02 172.11 1m3d s ALA 119 N -3.60 2.03 0.02 3.16 0.00 -0.54 0.19 121.76 123.03 1m3d s ALA 119 Ca 0.30 -1.31 0.05 0.00 0.00 0.00 0.00 51.96 50.99 1m3d s ALA 119 Cb 0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 1m3d s ALA 119 CO 0.15 0.44 -0.15 0.14 0.00 0.00 0.00 175.76 176.34 1m3d s VAL 120 N -1.08 1.15 0.01 0.00 -7.23 -0.58 -4.53 120.40 108.14 1m3d s VAL 120 Ca 0.09 -0.85 0.07 0.00 -1.81 0.00 0.00 61.98 59.48 1m3d s VAL 120 Cb -0.10 -1.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.81 1m3d s VAL 120 CO 0.05 0.14 -0.22 -1.00 -0.31 0.00 0.00 175.10 173.76 1m3d s HIS 121 N -0.64 2.46 -0.12 2.82 3.76 -1.26 -1.70 115.29 120.61 1m3d s HIS 121 Ca 0.04 -0.33 0.17 0.00 -0.15 0.00 0.00 55.06 54.78 1m3d s HIS 121 Cb -0.07 -1.48 -0.16 0.00 1.11 0.00 0.00 32.58 31.97 1m3d s HIS 121 CO 0.01 0.13 0.72 -1.13 -0.85 0.00 0.00 174.74 173.61 1m3d n SER 122 N 1.98 0.71 -2.00 1.40 3.41 -0.66 -4.94 113.62 113.53 1m3d n SER 122 Ca -0.16 0.32 -0.20 0.00 -0.26 0.00 0.00 58.87 58.57 1m3d n SER 122 Cb 0.52 0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 64.80 1m3d n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m3d n GLN 123 N -2.84 -1.50 -4.14 4.33 6.02 -1.26 -4.93 117.38 113.07 1m3d n GLN 123 Ca -0.12 1.03 -0.14 0.00 -0.01 0.00 0.00 57.00 57.75 1m3d n GLN 123 Cb 0.86 -5.53 -0.06 0.00 1.02 0.00 0.00 30.24 26.53 1m3d n GLN 123 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1m3d s THR 124 N -2.90 0.00 -1.93 5.09 -4.23 -1.26 -0.49 115.64 109.92 1m3d s THR 124 Ca 0.00 -1.73 0.31 0.00 -1.18 0.00 0.00 61.69 59.09 1m3d s THR 124 Cb 0.00 -2.52 0.77 0.00 1.34 0.00 0.00 72.50 72.09 1m3d s THR 124 CO 0.00 0.00 2.12 2.30 -0.54 0.00 0.00 174.62 178.50 1m3d n ILE 125 N -0.49 0.00 -3.55 2.99 -5.35 -1.26 -2.45 119.36 109.25 1m3d n ILE 125 Ca 0.02 -0.03 -0.33 0.00 -0.27 0.00 0.00 62.75 62.14 1m3d n ILE 125 Cb 0.63 -0.36 -0.05 0.00 -1.74 0.00 0.00 39.64 38.11 1m3d n ILE 125 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1m3d s GLN 126 N -2.13 3.74 -0.02 6.28 -1.52 -1.26 -4.85 119.66 119.90 1m3d s GLN 126 Ca 0.42 0.14 -0.30 0.00 -1.95 0.00 0.00 55.36 53.67 1m3d s GLN 126 Cb 0.21 -2.85 -0.04 0.00 -0.22 0.00 0.00 33.01 30.11 1m3d s GLN 126 CO 0.39 0.46 1.25 0.42 -0.25 0.00 0.00 175.29 177.56 1m3d s ILE 127 N -1.60 4.07 0.33 1.08 1.01 -1.26 -4.47 121.20 120.37 1m3d s ILE 127 Ca 0.40 1.44 -0.28 0.00 0.00 0.00 0.00 60.65 62.21 1m3d s ILE 127 Cb -0.13 -3.92 -0.09 0.00 0.01 0.00 0.00 42.46 38.33 1m3d s ILE 127 CO 0.21 0.02 1.14 -2.16 0.00 0.00 0.00 174.94 174.15 1m3d s PRO 128 N 2.02 4.40 0.46 2.79 0.04 -1.26 -5.01 135.00 138.44 1m3d s PRO 128 Ca 0.58 1.83 -0.21 0.00 0.04 0.00 0.00 61.00 63.25 1m3d s PRO 128 Cb -0.27 -2.97 -0.10 0.00 0.04 0.00 0.00 34.50 31.20 1m3d s PRO 128 CO 0.24 -0.02 0.99 -0.65 0.04 0.00 0.00 177.00 177.61 1m3d s GLN 129 N -1.83 4.01 0.51 4.56 -0.21 -1.26 -4.56 119.66 120.88 1m3d s GLN 129 Ca 0.50 1.24 -0.21 0.00 0.02 0.00 0.00 55.36 56.90 1m3d s GLN 129 Cb -0.31 -2.14 -0.06 0.00 1.00 0.00 0.00 33.01 31.49 1m3d s GLN 129 CO 0.40 -0.23 1.16 0.00 -2.12 0.00 0.00 175.29 174.51 1m3d n PRO 131 N -0.94 0.40 -1.69 0.00 -0.02 -1.26 -4.81 135.00 126.68 1m3d n PRO 131 Ca 0.10 0.20 -0.43 0.00 -2.02 0.00 0.00 63.50 61.34 1m3d n PRO 131 Cb 0.49 -2.22 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1m3d n PRO 131 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1m3d n THR 132 N -2.69 0.25 -0.12 3.45 -1.04 -1.26 -1.28 114.28 111.59 1m3d n THR 132 Ca 0.13 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1m3d n THR 132 Cb 0.50 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 67.02 1m3d n THR 132 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m3d n GLY 133 N 4.07 0.56 3.54 3.41 0.00 -1.26 -5.07 105.19 110.44 1m3d n GLY 133 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1m3d n GLY 133 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1m3d s TRP 134 N -2.25 2.75 0.13 1.61 0.52 -0.40 -4.61 118.94 116.68 1m3d s TRP 134 Ca 0.00 -0.13 0.04 0.00 0.02 0.00 0.00 56.10 56.02 1m3d s TRP 134 Cb 0.00 -1.54 -0.04 0.00 -1.15 0.00 0.00 33.47 30.75 1m3d s TRP 134 CO 0.00 0.33 0.15 -1.54 0.02 0.00 0.00 176.95 175.91 1m3d s SER 135 N -1.52 5.73 0.19 2.95 1.04 0.21 -4.73 113.70 117.57 1m3d s SER 135 Ca 0.17 -0.01 -0.28 0.00 0.48 0.00 0.00 55.95 56.30 1m3d s SER 135 Cb -0.11 -1.57 -0.08 0.00 0.10 0.00 0.00 66.02 64.36 1m3d s SER 135 CO 0.08 0.11 0.88 -0.55 0.98 0.00 0.00 173.24 174.73 1m3d s SER 136 N -2.86 7.53 -0.12 7.02 0.15 -1.26 -0.33 113.70 123.82 1m3d s SER 136 Ca 0.31 1.81 0.03 0.00 0.70 0.00 0.00 55.95 58.80 1m3d s SER 136 Cb -0.11 -2.56 -0.09 0.00 -1.71 0.00 0.00 66.02 61.54 1m3d s SER 136 CO 0.24 0.15 -0.08 0.18 1.20 0.00 0.00 173.24 174.93 1m3d n LEU 137 N 1.72 2.26 -3.61 3.45 4.77 0.21 -4.87 117.00 120.94 1m3d n LEU 137 Ca -0.03 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1m3d n LEU 137 Cb 0.48 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 1m3d n LEU 137 CO 0.49 0.61 1.07 -1.66 -1.33 0.00 0.00 177.39 176.57 1m3d s TRP 138 N -2.26 -0.06 0.25 -1.77 -2.14 -1.20 -4.78 118.94 106.99 1m3d s TRP 138 Ca -0.14 -0.02 0.08 0.00 2.66 0.00 0.00 56.10 58.68 1m3d s TRP 138 Cb 0.04 0.53 -0.05 0.00 -3.10 0.00 0.00 33.47 30.89 1m3d s TRP 138 CO 0.33 -0.21 -0.11 0.96 -2.66 0.00 0.00 176.95 175.26 1m3d s ILE 139 N -2.35 1.78 0.00 0.66 -0.00 -1.26 -0.49 121.20 119.53 1m3d s ILE 139 Ca 0.13 -2.19 0.00 0.00 -0.00 0.00 0.00 60.65 58.59 1m3d s ILE 139 Cb 0.03 -2.26 0.00 0.00 -0.00 0.00 0.00 42.46 40.23 1m3d s ILE 139 CO -0.04 -0.44 0.00 0.61 -0.00 0.00 0.00 174.94 175.07 1m3d n GLY 140 N -0.50 1.74 3.40 6.27 0.00 -0.55 -4.32 105.19 111.23 1m3d n GLY 140 Ca -0.06 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1m3d n GLY 140 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m3d s TYR 141 N -1.05 2.46 -0.70 1.61 1.51 0.16 -1.63 117.35 119.70 1m3d s TYR 141 Ca 0.00 -0.33 -0.26 0.00 -1.01 0.00 0.00 57.07 55.47 1m3d s TYR 141 Cb 0.00 -1.46 -0.03 0.00 -0.11 0.00 0.00 41.96 40.36 1m3d s TYR 141 CO 0.00 0.16 1.91 -1.12 -1.11 0.00 0.00 175.55 175.40 1m3d s SER 142 N -1.19 5.18 -0.26 2.29 0.01 -0.61 -1.69 113.70 117.42 1m3d s SER 142 Ca 0.13 0.03 -0.13 0.00 1.31 0.00 0.00 55.95 57.28 1m3d s SER 142 Cb -0.10 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1m3d s SER 142 CO 0.03 -2.53 0.30 0.12 0.41 0.00 0.00 173.24 171.57 1m3d s PHE 143 N 9.58 3.25 -0.13 2.43 5.36 0.20 -1.92 117.98 136.76 1m3d s PHE 143 Ca 0.69 0.33 -0.02 0.00 -0.96 0.00 0.00 56.93 56.97 1m3d s PHE 143 Cb -0.11 -2.49 -0.07 0.00 -0.34 0.00 0.00 43.02 40.01 1m3d s PHE 143 CO 0.14 -0.17 -0.14 1.55 -1.46 0.00 0.00 175.22 175.14 1m3d n VAL 144 N 4.97 0.73 -3.85 3.12 3.14 -0.28 -4.29 118.33 121.87 1m3d n VAL 144 Ca -0.11 -0.24 -0.10 0.00 -2.96 0.00 0.00 64.34 60.94 1m3d n VAL 144 Cb 0.51 -1.23 0.01 0.00 -1.06 0.00 0.00 33.84 32.07 1m3d n VAL 144 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1m3d s MET 145 N -2.25 2.19 0.11 1.45 0.23 -1.14 -0.18 119.30 119.71 1m3d s MET 145 Ca -0.18 -1.49 -0.22 0.00 -1.03 0.00 0.00 55.69 52.77 1m3d s MET 145 Cb 0.05 0.60 0.06 0.00 -1.53 0.00 0.00 34.83 34.01 1m3d s MET 145 CO 0.27 -1.01 0.54 -3.38 -2.03 0.00 0.00 175.02 169.41 1m3d s HIS 146 N -2.43 -0.44 0.03 3.16 -3.43 -0.71 -0.27 115.29 111.20 1m3d s HIS 146 Ca 0.18 0.32 -0.09 0.00 -0.80 0.00 0.00 55.06 54.67 1m3d s HIS 146 Cb -0.04 0.43 0.00 0.00 -1.43 0.00 0.00 32.58 31.54 1m3d s HIS 146 CO 0.13 -0.75 0.18 0.95 -2.00 0.00 0.00 174.74 173.25 1m3d s THR 147 N -3.26 0.11 0.00 -5.38 -4.23 -0.90 -2.86 115.64 99.12 1m3d s THR 147 Ca -0.01 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1m3d s THR 147 Cb -0.00 -0.82 0.00 0.00 1.34 0.00 0.00 72.50 73.02 1m3d s THR 147 CO -0.08 -0.48 0.00 -0.24 -0.54 0.00 0.00 174.62 173.28 1m3d n SER 148 N 0.84 0.00 -4.63 3.99 2.88 -0.40 -0.61 113.62 115.70 1m3d n SER 148 Ca -0.20 0.00 -0.49 0.00 -1.33 0.00 0.00 58.87 56.85 1m3d n SER 148 Cb 0.58 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.99 1m3d n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1m3d n ALA 149 N -3.00 0.07 -1.22 -1.46 0.00 -1.26 -0.63 120.51 113.01 1m3d n ALA 149 Ca 0.00 0.48 -0.08 0.00 0.00 0.00 0.00 53.44 53.85 1m3d n ALA 149 Cb 0.00 -2.20 -0.03 0.00 0.00 0.00 0.00 19.45 17.22 1m3d n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m3d n GLY 150 N 2.87 0.80 2.47 0.00 0.00 -1.26 -1.94 105.19 108.13 1m3d n GLY 150 Ca 0.17 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1m3d n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m3d n ALA 151 N 1.14 -0.35 -2.21 4.61 0.00 0.19 -4.99 120.51 118.91 1m3d n ALA 151 Ca -0.08 0.25 -0.26 0.00 0.00 0.00 0.00 53.44 53.35 1m3d n ALA 151 Cb 0.50 -1.88 0.01 0.00 0.00 0.00 0.00 19.45 18.08 1m3d n ALA 151 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1m3d s GLU 152 N -3.92 3.21 0.00 0.00 0.41 -0.82 -4.72 118.70 112.87 1m3d s GLU 152 Ca 0.00 -0.00 0.00 0.00 -0.41 0.00 0.00 54.97 54.56 1m3d s GLU 152 Cb 0.00 -2.37 0.00 0.00 -1.78 0.00 0.00 34.13 29.98 1m3d s GLU 152 CO 0.00 -0.41 0.00 0.41 -0.49 0.00 0.00 175.26 174.77 1m3d n GLY 153 N -2.35 -0.57 1.22 -1.39 0.00 -1.26 -1.27 105.19 99.56 1m3d n GLY 153 Ca 0.02 -0.79 -0.03 0.00 0.00 0.00 0.00 46.02 45.22 1m3d n GLY 153 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1m3d n SER 154 N 0.05 -0.73 -1.45 1.61 3.41 -1.14 -4.66 113.62 110.72 1m3d n SER 154 Ca 0.00 -1.53 -0.03 0.00 -0.26 0.00 0.00 58.87 57.05 1m3d n SER 154 Cb 0.00 1.22 -0.00 0.00 -0.26 0.00 0.00 64.21 65.17 1m3d n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1m3d n GLY 155 N -0.18 2.30 3.50 5.00 0.00 -1.26 -1.74 105.19 112.82 1m3d n GLY 155 Ca -0.03 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.45 1m3d n GLY 155 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1m3d s GLN 156 N -2.10 1.83 0.02 1.61 -1.52 0.75 -4.73 119.66 115.51 1m3d s GLN 156 Ca 0.05 -1.16 -0.30 0.00 -1.95 0.00 0.00 55.36 52.00 1m3d s GLN 156 Cb -0.01 -2.14 -0.04 0.00 -0.22 0.00 0.00 33.01 30.60 1m3d s GLN 156 CO 0.04 0.48 1.06 0.00 -0.25 0.00 0.00 175.29 176.62 1m3d s ALA 157 N -1.17 3.25 -0.48 6.09 0.00 -1.26 -4.88 121.76 123.32 1m3d s ALA 157 Ca 0.19 0.64 0.16 0.00 0.00 0.00 0.00 51.96 52.95 1m3d s ALA 157 Cb -0.11 -3.38 0.84 0.00 0.00 0.00 0.00 23.12 20.47 1m3d s ALA 157 CO 0.11 -0.33 1.50 1.28 0.00 0.00 0.00 175.76 178.32 1m3d n LEU 158 N 3.98 0.41 -0.75 0.00 4.77 -1.26 -0.75 117.00 123.40 1m3d n LEU 158 Ca 0.07 0.67 0.10 0.00 -0.03 0.00 0.00 56.01 56.82 1m3d n LEU 158 Cb 0.49 -0.70 0.07 0.00 -2.33 0.00 0.00 43.42 40.96 1m3d n LEU 158 CO 0.53 -0.75 0.53 0.00 -1.33 0.00 0.00 177.39 176.37 1m3d n ALA 159 N -1.70 2.60 -2.26 -1.18 0.00 -1.26 -4.66 120.51 112.04 1m3d n ALA 159 Ca -0.00 -0.65 -0.35 0.00 0.00 0.00 0.00 53.44 52.44 1m3d n ALA 159 Cb 0.06 -0.68 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 1m3d n ALA 159 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1m3d s SER 160 N -1.76 6.85 0.64 0.00 0.15 0.07 -1.46 113.70 118.18 1m3d s SER 160 Ca 0.22 1.18 0.38 0.00 0.70 0.00 0.00 55.95 58.43 1m3d s SER 160 Cb 0.17 -2.33 2.13 0.00 -1.71 0.00 0.00 66.02 64.27 1m3d s SER 160 CO 0.29 0.01 2.29 -0.65 1.20 0.00 0.00 173.24 176.37 1m3d h PRO 161 N 3.15 0.00 0.00 5.44 0.11 -1.85 -0.96 132.00 137.90 1m3d h PRO 161 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1m3d h PRO 161 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1m3d h PRO 161 CO 0.66 0.00 -0.03 0.78 -0.21 0.00 0.00 178.00 179.20 1m3d h GLY 162 N 0.00 0.00 -0.19 -0.55 0.00 -1.86 -1.13 103.07 99.35 1m3d h GLY 162 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1m3d h GLY 162 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1m3d n SER 163 N -3.26 0.88 -3.85 0.19 3.41 -0.36 -4.55 113.62 106.07 1m3d n SER 163 Ca -0.02 -1.60 -0.30 0.00 -0.26 0.00 0.00 58.87 56.69 1m3d n SER 163 Cb 0.18 -0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 63.93 1m3d n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m3d s LEU 165 N 0.36 4.32 0.35 0.00 1.43 -0.68 -4.77 118.68 119.69 1m3d s LEU 165 Ca 0.15 1.20 0.08 0.00 -1.03 0.00 0.00 54.13 54.53 1m3d s LEU 165 Cb -0.23 -3.09 0.67 0.00 0.03 0.00 0.00 46.19 43.56 1m3d s LEU 165 CO -0.04 -0.12 1.85 -0.33 0.23 0.00 0.00 176.35 177.94 1m3d h GLU 166 N 6.76 0.29 -5.27 1.70 5.08 -1.88 0.46 114.58 121.73 1m3d h GLU 166 Ca -0.41 -0.08 -0.67 0.00 -1.00 0.00 0.00 59.36 57.19 1m3d h GLU 166 Cb 1.20 -0.03 -0.33 0.00 0.50 0.00 0.00 28.75 30.09 1m3d h GLU 166 CO 0.75 0.47 -0.86 -1.21 -1.00 0.00 0.00 179.01 177.17 1m3d s GLU 167 N -4.62 3.08 0.17 2.33 2.02 -1.26 -4.63 118.70 115.79 1m3d s GLU 167 Ca -0.06 -0.84 -0.30 0.00 0.02 0.00 0.00 54.97 53.79 1m3d s GLU 167 Cb 0.15 -2.41 -0.08 0.00 0.10 0.00 0.00 34.13 31.89 1m3d s GLU 167 CO 0.75 0.09 1.12 0.12 0.02 0.00 0.00 175.26 177.36 1m3d s PHE 168 N 0.58 3.55 -0.06 1.61 2.19 -1.26 -4.94 117.98 119.65 1m3d s PHE 168 Ca -0.12 1.56 -0.02 0.00 0.33 0.00 0.00 56.93 58.67 1m3d s PHE 168 Cb -0.17 -3.31 0.04 0.00 -1.31 0.00 0.00 43.02 38.27 1m3d s PHE 168 CO 0.04 -0.74 0.12 1.03 1.83 0.00 0.00 175.22 177.49 1m3d s ARG 169 N -0.28 0.05 0.47 10.12 1.81 -1.26 -5.00 118.95 124.85 1m3d s ARG 169 Ca 0.50 0.37 0.21 0.00 -1.72 0.00 0.00 55.73 55.10 1m3d s ARG 169 Cb -0.30 -0.23 1.18 0.00 -0.45 0.00 0.00 34.95 35.15 1m3d s ARG 169 CO 0.35 -0.20 2.00 0.66 -0.68 0.00 0.00 175.30 177.42 1m3d h SER 170 N 7.54 0.00 -2.84 0.23 4.64 -2.00 -3.26 113.55 117.86 1m3d h SER 170 Ca -0.36 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.35 1m3d h SER 170 Cb 1.13 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.82 1m3d h SER 170 CO 0.37 0.19 -0.73 0.00 -0.87 0.00 0.00 176.83 175.78 1m3d s ALA 171 N -4.28 2.87 -0.84 5.18 0.00 -1.26 -4.47 121.76 118.95 1m3d s ALA 171 Ca -0.03 -3.29 0.24 0.00 0.00 0.00 0.00 51.96 48.88 1m3d s ALA 171 Cb 0.14 -1.94 0.94 0.00 0.00 0.00 0.00 23.12 22.25 1m3d s ALA 171 CO 0.64 -2.05 1.74 -0.35 0.00 0.00 0.00 175.76 175.74 1m3d n PRO 172 N 2.34 0.10 -4.11 0.00 -0.04 -1.23 -4.84 135.00 127.22 1m3d n PRO 172 Ca 0.23 0.19 -0.10 0.00 -0.04 0.00 0.00 63.50 63.78 1m3d n PRO 172 Cb 0.40 -1.64 -0.10 0.00 -0.04 0.00 0.00 33.50 32.11 1m3d n PRO 172 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1m3d s PHE 173 N -3.08 0.70 0.14 0.54 -0.71 -1.26 -0.26 117.98 114.05 1m3d s PHE 173 Ca 0.10 -0.81 0.09 0.00 -1.04 0.00 0.00 56.93 55.27 1m3d s PHE 173 Cb 0.13 -0.43 -0.04 0.00 -1.21 0.00 0.00 43.02 41.47 1m3d s PHE 173 CO 0.45 -0.19 -0.18 -1.50 -1.34 0.00 0.00 175.22 172.47 1m3d s ILE 174 N -2.93 2.79 -0.20 -4.49 2.07 0.05 -4.81 121.20 113.69 1m3d s ILE 174 Ca 0.03 -1.63 -0.08 0.00 -1.41 0.00 0.00 60.65 57.56 1m3d s ILE 174 Cb 0.01 -2.30 -0.04 0.00 0.13 0.00 0.00 42.46 40.25 1m3d s ILE 174 CO -0.04 0.03 0.08 -0.70 -1.91 0.00 0.00 174.94 172.39 1m3d s GLU 175 N -2.34 3.96 0.25 3.50 2.12 -0.80 -2.16 118.70 123.23 1m3d s GLU 175 Ca 0.19 -0.35 0.12 0.00 0.36 0.00 0.00 54.97 55.29 1m3d s GLU 175 Cb -0.10 -3.27 -0.05 0.00 0.26 0.00 0.00 34.13 30.97 1m3d s GLU 175 CO 0.11 0.19 -0.21 0.00 -0.54 0.00 0.00 175.26 174.81 1m3d s HIS 177 N -2.31 1.60 0.55 0.00 0.09 0.19 -1.92 115.29 113.50 1m3d s HIS 177 Ca 0.27 -0.55 0.26 0.00 -0.00 0.00 0.00 55.06 55.04 1m3d s HIS 177 Cb -0.06 -0.80 1.46 0.00 -0.00 0.00 0.00 32.58 33.19 1m3d s HIS 177 CO 0.13 0.25 2.02 0.78 -0.00 0.00 0.00 174.74 177.93 1m3d h GLY 178 N 3.11 0.00 2.00 -2.22 0.00 -1.48 0.92 103.07 105.41 1m3d h GLY 178 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1m3d h GLY 178 CO 0.55 0.00 0.00 -0.96 0.00 0.00 0.00 176.54 176.13 1m3d n ARG 179 N -4.17 0.07 0.00 4.80 1.85 -1.26 -4.82 116.66 113.13 1m3d n ARG 179 Ca 0.07 0.36 0.00 0.00 -1.00 0.00 0.00 57.85 57.28 1m3d n ARG 179 Cb 0.51 -1.65 0.00 0.00 -1.05 0.00 0.00 32.46 30.26 1m3d n ARG 179 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1m3d n GLY 180 N -0.27 0.62 3.92 2.89 0.00 0.32 -5.10 105.19 107.56 1m3d n GLY 180 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1m3d n GLY 180 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3d s THR 181 N -2.00 5.12 0.01 2.61 -4.23 -1.24 -4.32 115.64 111.59 1m3d s THR 181 Ca 0.00 -0.21 -0.05 0.00 -1.18 0.00 0.00 61.69 60.25 1m3d s THR 181 Cb 0.00 -3.75 -0.01 0.00 1.34 0.00 0.00 72.50 70.09 1m3d s THR 181 CO 0.00 -0.27 0.08 0.00 -0.54 0.00 0.00 174.62 173.89 1m3d s ASN 183 N -1.56 -0.03 -0.01 0.00 2.47 0.10 -0.19 114.94 115.72 1m3d s ASN 183 Ca -0.13 -0.06 -0.04 0.00 0.42 0.00 0.00 52.86 53.04 1m3d s ASN 183 Cb -0.07 0.08 -0.04 0.00 -1.45 0.00 0.00 41.25 39.77 1m3d s ASN 183 CO -0.00 -0.15 0.21 -0.31 -3.72 0.00 0.00 177.10 173.13 1m3d s TYR 184 N -2.21 3.56 0.08 0.43 1.51 -1.26 -1.91 117.35 117.55 1m3d s TYR 184 Ca 0.14 0.45 0.07 0.00 -1.01 0.00 0.00 57.07 56.72 1m3d s TYR 184 Cb 0.06 -1.90 -0.03 0.00 -0.11 0.00 0.00 41.96 39.98 1m3d s TYR 184 CO -0.05 0.64 -0.18 0.71 -1.11 0.00 0.00 175.55 175.55 1m3d s TYR 185 N -1.30 1.55 0.63 2.71 1.51 -1.26 -5.03 117.35 116.16 1m3d s TYR 185 Ca 0.27 -0.43 0.35 0.00 -1.01 0.00 0.00 57.07 56.25 1m3d s TYR 185 Cb -0.13 -0.86 1.97 0.00 -0.11 0.00 0.00 41.96 42.83 1m3d s TYR 185 CO 0.17 0.14 2.19 0.00 -1.11 0.00 0.00 175.55 176.93 1m3d h ALA 186 N 4.23 1.38 -0.59 3.71 0.00 -2.03 -1.81 119.26 124.15 1m3d h ALA 186 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1m3d h ALA 186 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1m3d h ALA 186 CO 0.40 -0.15 0.00 0.27 0.00 0.00 0.00 179.25 179.77 1m3d n ASN 187 N -3.36 3.58 -4.57 0.00 6.94 -1.26 -4.81 115.26 111.78 1m3d n ASN 187 Ca -0.01 -2.14 -0.42 0.00 -0.02 0.00 0.00 54.58 51.98 1m3d n ASN 187 Cb 0.21 -0.46 -0.03 0.00 -2.36 0.00 0.00 39.78 37.15 1m3d n ASN 187 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1m3d s ALA 188 N -1.42 2.98 -0.05 -2.53 0.00 -0.68 -4.21 121.76 115.86 1m3d s ALA 188 Ca 0.42 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 51.41 1m3d s ALA 188 Cb 0.24 -4.03 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 1m3d s ALA 188 CO 0.25 -2.71 0.06 0.71 0.00 0.00 0.00 175.76 174.07 1m3d s TYR 189 N 4.94 3.28 -0.11 0.00 4.12 0.22 -4.95 117.35 124.85 1m3d s TYR 189 Ca 0.40 0.25 0.02 0.00 0.02 0.00 0.00 57.07 57.76 1m3d s TYR 189 Cb -0.08 -1.78 -0.01 0.00 -1.52 0.00 0.00 41.96 38.57 1m3d s TYR 189 CO 0.23 0.55 -0.19 -1.54 0.02 0.00 0.00 175.55 174.62 1m3d s SER 190 N -1.34 3.54 -0.13 2.29 1.04 -1.26 -2.11 113.70 115.73 1m3d s SER 190 Ca 0.18 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 56.14 1m3d s SER 190 Cb -0.12 -1.49 -0.03 0.00 0.10 0.00 0.00 66.02 64.48 1m3d s SER 190 CO 0.08 0.17 -0.02 -0.36 0.98 0.00 0.00 173.24 174.09 1m3d s PHE 191 N 0.32 3.07 0.14 5.02 0.40 0.63 -5.00 117.98 122.56 1m3d s PHE 191 Ca -0.15 -0.11 0.06 0.00 -0.60 0.00 0.00 56.93 56.14 1m3d s PHE 191 Cb -0.17 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 1m3d s PHE 191 CO 0.07 0.15 -0.14 -1.58 0.70 0.00 0.00 175.22 174.42 1m3d s TRP 192 N -0.07 1.45 0.26 0.36 0.52 -1.26 -1.12 118.94 119.07 1m3d s TRP 192 Ca 0.03 -0.57 -0.30 0.00 0.02 0.00 0.00 56.10 55.28 1m3d s TRP 192 Cb -0.13 -0.74 -0.09 0.00 -1.15 0.00 0.00 33.47 31.36 1m3d s TRP 192 CO 0.02 0.17 1.18 -0.51 0.02 0.00 0.00 176.95 177.83 1m3d s LEU 193 N -2.63 4.49 0.61 2.99 1.43 -0.81 -4.91 118.68 119.85 1m3d s LEU 193 Ca 0.12 2.34 -0.02 0.00 -1.03 0.00 0.00 54.13 55.54 1m3d s LEU 193 Cb -0.04 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.60 1m3d s LEU 193 CO 0.03 -0.30 0.87 0.00 0.23 0.00 0.00 176.35 177.18 1m3d s ALA 194 N -0.76 3.60 0.01 4.21 0.00 -1.26 -1.13 121.76 126.43 1m3d s ALA 194 Ca 0.48 -1.16 -0.19 0.00 0.00 0.00 0.00 51.96 51.10 1m3d s ALA 194 Cb -0.34 -2.29 -0.06 0.00 0.00 0.00 0.00 23.12 20.44 1m3d s ALA 194 CO 0.42 -0.95 0.55 0.95 0.00 0.00 0.00 175.76 176.72 1m3d s THR 195 N -2.95 4.89 -0.03 0.00 -4.23 -1.26 -4.46 115.64 107.61 1m3d s THR 195 Ca 0.58 1.14 0.01 0.00 -1.18 0.00 0.00 61.69 62.25 1m3d s THR 195 Cb -0.10 -3.87 0.01 0.00 1.34 0.00 0.00 72.50 69.87 1m3d s THR 195 CO 0.41 0.48 -0.05 -0.63 -0.54 0.00 0.00 174.62 174.29 1m3d s ILE 196 N -0.57 0.51 0.09 2.99 1.01 0.36 -4.96 121.20 120.62 1m3d s ILE 196 Ca 0.29 -0.17 -0.25 0.00 0.00 0.00 0.00 60.65 60.52 1m3d s ILE 196 Cb -0.18 -0.50 -0.06 0.00 0.01 0.00 0.00 42.46 41.73 1m3d s ILE 196 CO 0.17 0.19 0.76 -1.61 0.00 0.00 0.00 174.94 174.44 1m3d s GLU 197 N 0.52 4.50 0.43 2.79 0.41 -1.26 -4.80 118.70 121.30 1m3d s GLU 197 Ca -0.07 1.07 0.09 0.00 -0.41 0.00 0.00 54.97 55.66 1m3d s GLU 197 Cb -0.10 -3.32 0.95 0.00 -1.78 0.00 0.00 34.13 29.88 1m3d s GLU 197 CO -0.00 0.40 2.08 0.00 -0.49 0.00 0.00 175.26 177.25 1m3d h ARG 198 N 5.14 0.42 0.00 1.61 3.08 -2.00 -0.81 114.38 121.82 1m3d h ARG 198 Ca -0.45 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1m3d h ARG 198 Cb 1.21 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1m3d h ARG 198 CO 0.69 0.28 0.00 0.66 -1.07 0.00 0.00 179.97 180.52 1m3d h SER 199 N 0.43 0.00 -0.21 7.04 4.64 -2.05 -3.11 113.55 120.29 1m3d h SER 199 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1m3d h SER 199 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1m3d h SER 199 CO -0.02 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.32 1m3d n GLU 200 N -2.57 2.68 -0.31 4.77 1.02 -0.33 -4.70 120.64 121.21 1m3d n GLU 200 Ca 0.02 -2.33 0.02 0.00 -0.02 0.00 0.00 57.16 54.85 1m3d n GLU 200 Cb 0.27 -1.47 0.15 0.00 -0.02 0.00 0.00 31.44 30.38 1m3d n GLU 200 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1m3d h MET 201 N 1.34 0.89 -0.91 3.49 2.86 -1.42 -2.60 114.93 118.58 1m3d h MET 201 Ca 0.00 -0.05 -0.62 0.00 -2.06 0.00 0.00 59.70 56.96 1m3d h MET 201 Cb 0.99 -0.20 -0.32 0.00 0.06 0.00 0.00 31.60 32.12 1m3d h MET 201 CO 0.08 0.59 0.38 1.19 1.06 0.00 0.00 176.91 180.21 1m3d n PHE 202 N -4.66 3.04 -4.45 -0.22 3.01 -1.26 -4.94 117.46 107.97 1m3d n PHE 202 Ca 0.13 -2.73 -0.29 0.00 1.01 0.00 0.00 57.45 55.57 1m3d n PHE 202 Cb 0.21 -1.11 -0.13 0.00 -0.01 0.00 0.00 39.48 38.44 1m3d n PHE 202 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1m3d s LYS 203 N -3.73 1.42 0.12 -1.08 -0.14 -0.98 -5.08 119.74 110.26 1m3d s LYS 203 Ca 0.60 -1.29 -0.34 0.00 -1.36 0.00 0.00 55.97 53.59 1m3d s LYS 203 Cb 0.48 -1.85 -0.13 0.00 -1.68 0.00 0.00 37.83 34.65 1m3d s LYS 203 CO 0.01 0.44 1.65 1.17 -0.76 0.00 0.00 175.35 177.86 1m3d n LYS 204 N 1.07 2.22 -1.68 1.68 4.81 -1.26 -4.89 118.16 120.10 1m3d n LYS 204 Ca -0.18 0.80 -0.39 0.00 -0.87 0.00 0.00 58.31 57.67 1m3d n LYS 204 Cb 0.53 -2.60 0.04 0.00 0.02 0.00 0.00 35.03 33.02 1m3d n LYS 204 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1m3d n PRO 205 N 4.13 1.44 -3.32 1.64 -0.02 -1.26 -4.95 135.00 132.65 1m3d n PRO 205 Ca 0.18 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.77 1m3d n PRO 205 Cb 0.30 -2.34 -0.09 0.00 -0.02 0.00 0.00 33.50 31.35 1m3d n PRO 205 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1m3d s THR 206 N -1.34 5.09 0.57 3.45 2.01 -1.26 -5.04 115.64 119.11 1m3d s THR 206 Ca 0.70 -0.11 -0.20 0.00 0.31 0.00 0.00 61.69 62.39 1m3d s THR 206 Cb -0.45 -3.98 -0.06 0.00 0.01 0.00 0.00 72.50 68.02 1m3d s THR 206 CO 0.51 -0.31 0.98 -2.65 -0.69 0.00 0.00 174.62 172.46 1m3d n PRO 207 N 5.60 1.02 -3.69 4.92 -0.02 -1.26 -5.02 135.00 136.55 1m3d n PRO 207 Ca -0.07 0.39 -0.10 0.00 -2.02 0.00 0.00 63.50 61.70 1m3d n PRO 207 Cb 0.48 -2.16 -0.10 0.00 -0.02 0.00 0.00 33.50 31.70 1m3d n PRO 207 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1m3d s SER 208 N -1.13 -0.58 -0.24 2.55 0.15 -1.26 -5.13 113.70 108.06 1m3d s SER 208 Ca 0.73 0.98 -0.05 0.00 0.70 0.00 0.00 55.95 58.31 1m3d s SER 208 Cb -0.44 0.86 -0.00 0.00 -1.71 0.00 0.00 66.02 64.72 1m3d s SER 208 CO 0.49 -0.20 -0.00 -0.89 1.20 0.00 0.00 173.24 173.84 1m3d s THR 209 N 1.43 3.58 -0.12 6.45 2.01 -1.26 -5.10 115.64 122.63 1m3d s THR 209 Ca -0.10 -0.55 -0.03 0.00 0.31 0.00 0.00 61.69 61.33 1m3d s THR 209 Cb -0.08 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.69 1m3d s THR 209 CO -0.14 0.31 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.34 1m3d s LEU 210 N 1.49 3.48 0.40 4.42 1.43 -1.26 -5.12 118.68 123.52 1m3d s LEU 210 Ca 0.05 0.04 0.08 0.00 -1.03 0.00 0.00 54.13 53.26 1m3d s LEU 210 Cb -0.15 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 1m3d s LEU 210 CO -0.01 0.28 0.33 -0.54 0.23 0.00 0.00 176.35 176.64 1m3d s LYS 211 N -0.29 2.51 0.02 1.70 1.02 -1.26 -4.91 119.74 118.52 1m3d s LYS 211 Ca 0.06 -1.55 -0.37 0.00 0.02 0.00 0.00 55.97 54.13 1m3d s LYS 211 Cb -0.12 -2.33 -0.16 0.00 -0.52 0.00 0.00 37.83 34.70 1m3d s LYS 211 CO 0.02 -0.13 1.45 0.00 -0.92 0.00 0.00 175.35 175.77 1m3d n ALA 212 N -1.46 -0.58 0.00 5.17 0.00 -1.26 -1.63 120.51 120.74 1m3d n ALA 212 Ca 0.02 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1m3d n ALA 212 Cb 0.62 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1m3d n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m3d n GLY 213 N 2.95 2.19 0.60 0.00 0.00 -1.26 -4.86 105.19 104.82 1m3d n GLY 213 Ca 0.20 -0.49 0.06 0.00 0.00 0.00 0.00 46.02 45.79 1m3d n GLY 213 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1m3d n GLU 214 N 0.00 1.94 -0.03 1.61 0.28 -0.65 -4.75 120.64 119.05 1m3d n GLU 214 Ca 0.00 -2.87 -0.01 0.00 -0.16 0.00 0.00 57.16 54.12 1m3d n GLU 214 Cb 0.00 -1.68 -0.00 0.00 1.43 0.00 0.00 31.44 31.18 1m3d n GLU 214 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1m3d h LEU 215 N 0.89 0.00 -1.82 -1.84 3.38 -1.89 -3.37 115.31 110.66 1m3d h LEU 215 Ca 0.04 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1m3d h LEU 215 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1m3d h LEU 215 CO 0.14 0.26 0.44 -0.09 0.09 0.00 0.00 178.44 179.29 1m3d h ARG 216 N -0.44 0.00 -0.36 1.13 2.43 -1.94 -0.20 114.38 115.00 1m3d h ARG 216 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1m3d h ARG 216 Cb 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1m3d h ARG 216 CO 0.00 0.00 0.00 0.25 -1.51 0.00 0.00 179.97 178.71 1m3d n THR 217 N -3.12 0.47 -1.90 0.20 -2.24 -1.26 -3.85 114.28 102.59 1m3d n THR 217 Ca 0.02 -0.49 0.03 0.00 -2.27 0.00 0.00 64.05 61.35 1m3d n THR 217 Cb 0.53 0.26 0.05 0.00 -2.10 0.00 0.00 70.33 69.07 1m3d n THR 217 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1m3d n HIS 218 N 0.57 0.00 -4.88 4.78 8.25 -0.09 -4.95 115.22 118.90 1m3d n HIS 218 Ca 0.13 -0.44 -0.32 0.00 -0.26 0.00 0.00 57.72 56.83 1m3d n HIS 218 Cb 0.32 -0.11 -0.13 0.00 1.12 0.00 0.00 29.99 31.18 1m3d n HIS 218 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1m3d s VAL 219 N -0.83 2.84 0.55 1.59 1.01 -1.24 -4.20 120.40 120.11 1m3d s VAL 219 Ca 0.17 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 61.02 1m3d s VAL 219 Cb 0.17 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1m3d s VAL 219 CO -0.04 0.51 1.29 -0.24 0.00 0.00 0.00 175.10 176.62 1m3d n SER 220 N 2.08 2.34 -4.86 3.32 2.88 -0.28 -4.57 113.62 114.52 1m3d n SER 220 Ca -0.17 0.95 -0.21 0.00 -1.33 0.00 0.00 58.87 58.12 1m3d n SER 220 Cb 0.52 -1.54 -0.03 0.00 -0.75 0.00 0.00 64.21 62.41 1m3d n SER 220 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1m3d s ARG 221 N -2.84 2.65 0.25 -1.46 1.81 -1.03 -1.57 118.95 116.76 1m3d s ARG 221 Ca 0.72 -1.39 -0.14 0.00 -1.72 0.00 0.00 55.73 53.20 1m3d s ARG 221 Cb -0.42 -2.44 -0.00 0.00 -0.45 0.00 0.00 34.95 31.64 1m3d s ARG 221 CO 0.49 -0.02 0.50 0.00 -0.68 0.00 0.00 175.30 175.59 1m3d s GLN 223 N -4.00 0.20 -0.20 0.00 0.74 -0.69 -1.48 119.66 114.23 1m3d s GLN 223 Ca 0.21 0.30 -0.12 0.00 0.05 0.00 0.00 55.36 55.79 1m3d s GLN 223 Cb -0.01 0.05 -0.05 0.00 1.10 0.00 0.00 33.01 34.10 1m3d s GLN 223 CO 0.08 -0.06 0.24 0.08 -0.55 0.00 0.00 175.29 175.08 1m3d s VAL 224 N 0.34 5.33 0.14 1.34 1.01 0.35 -1.52 120.40 127.39 1m3d s VAL 224 Ca -0.02 0.39 0.07 0.00 0.00 0.00 0.00 61.98 62.42 1m3d s VAL 224 Cb -0.03 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 1m3d s VAL 224 CO -0.01 0.36 -0.16 0.00 0.00 0.00 0.00 175.10 175.29 1m3d s MET 226 N -2.71 1.64 0.00 0.00 -2.45 0.55 -0.78 119.30 115.56 1m3d s MET 226 Ca 0.12 -0.45 0.25 0.00 -1.25 0.00 0.00 55.69 54.36 1m3d s MET 226 Cb -0.05 -1.38 1.50 0.00 1.25 0.00 0.00 34.83 36.14 1m3d s MET 226 CO 0.04 0.08 1.85 -2.13 1.05 0.00 0.00 175.02 175.92