#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m3d s GLY 5 N 0.00 0.77 -0.15 -1.41 0.00 -1.26 -4.57 107.32 100.70 1m3d s GLY 5 Ca 0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 44.72 44.11 1m3d s GLY 5 CO 0.00 1.05 -0.06 -1.36 0.00 0.00 0.00 173.10 172.73 1m3d s PHE 6 N 1.77 2.97 0.30 1.90 0.40 0.16 -4.87 117.98 120.62 1m3d s PHE 6 Ca 0.02 -0.40 -0.28 0.00 -0.60 0.00 0.00 56.93 55.67 1m3d s PHE 6 Cb -0.14 -1.94 -0.09 0.00 0.51 0.00 0.00 43.02 41.36 1m3d s PHE 6 CO -0.07 -0.10 0.99 -0.51 0.70 0.00 0.00 175.22 176.23 1m3d s LEU 7 N 0.40 4.45 -0.03 -0.37 1.02 -1.26 0.15 118.68 123.04 1m3d s LEU 7 Ca -0.06 1.99 0.01 0.00 0.02 0.00 0.00 54.13 56.10 1m3d s LEU 7 Cb -0.15 -3.83 0.02 0.00 0.02 0.00 0.00 46.19 42.25 1m3d s LEU 7 CO 0.03 -0.07 -0.02 0.54 0.02 0.00 0.00 176.35 176.85 1m3d s VAL 8 N -1.39 0.32 -0.06 -1.59 0.11 0.79 -4.88 120.40 113.70 1m3d s VAL 8 Ca 0.47 -0.03 0.01 0.00 -2.93 0.00 0.00 61.98 59.50 1m3d s VAL 8 Cb -0.24 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.22 1m3d s VAL 8 CO 0.30 0.16 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.27 1m3d s THR 9 N 0.75 3.66 0.03 5.04 2.01 -1.23 -0.17 115.64 125.72 1m3d s THR 9 Ca -0.08 -0.51 0.06 0.00 0.31 0.00 0.00 61.69 61.46 1m3d s THR 9 Cb -0.12 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 69.88 1m3d s THR 9 CO -0.01 0.59 -0.16 -0.60 -0.69 0.00 0.00 174.62 173.74 1m3d s ARG 10 N -0.84 1.16 -0.12 4.92 3.52 -0.17 -4.80 118.95 122.62 1m3d s ARG 10 Ca 0.13 -0.76 0.03 0.00 -0.13 0.00 0.00 55.73 55.00 1m3d s ARG 10 Cb -0.11 -1.19 0.00 0.00 -1.56 0.00 0.00 34.95 32.10 1m3d s ARG 10 CO 0.02 0.31 -0.23 -1.01 -0.81 0.00 0.00 175.30 173.57 1m3d s HIS 11 N -0.71 2.61 0.14 5.12 3.76 -1.26 -0.99 115.29 123.97 1m3d s HIS 11 Ca 0.05 -1.16 0.08 0.00 -0.15 0.00 0.00 55.06 53.87 1m3d s HIS 11 Cb -0.08 -1.76 -0.10 0.00 1.11 0.00 0.00 32.58 31.76 1m3d s HIS 11 CO 0.01 -0.49 1.35 0.66 -0.85 0.00 0.00 174.74 175.41 1m3d h SER 12 N 6.97 0.00 -1.71 1.40 4.64 -1.42 -3.45 113.55 119.98 1m3d h SER 12 Ca -0.25 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.73 1m3d h SER 12 Cb 1.22 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.24 1m3d h SER 12 CO 0.51 0.92 -0.38 0.00 -0.87 0.00 0.00 176.83 177.00 1m3d n GLN 13 N -3.43 -1.27 -4.11 4.77 6.02 -1.26 -4.94 117.38 113.16 1m3d n GLN 13 Ca -0.00 0.93 -0.15 0.00 -0.01 0.00 0.00 57.00 57.77 1m3d n GLN 13 Cb 0.87 -5.27 -0.05 0.00 1.02 0.00 0.00 30.24 26.82 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 -2.75 0.00 -1.32 5.09 -4.23 -1.26 -4.02 115.64 107.16 1m3d s THR 14 Ca 0.00 -1.65 0.28 0.00 -1.18 0.00 0.00 61.69 59.14 1m3d s THR 14 Cb 0.00 -2.60 0.42 0.00 1.34 0.00 0.00 72.50 71.65 1m3d s THR 14 CO 0.00 0.00 1.93 0.35 -0.54 0.00 0.00 174.62 176.36 1m3d n THR 15 N -0.55 0.11 -3.57 3.99 -2.24 -1.26 -1.77 114.28 108.98 1m3d n THR 15 Ca 0.02 0.03 -0.34 0.00 -2.27 0.00 0.00 64.05 61.48 1m3d n THR 15 Cb 0.62 -0.57 -0.05 0.00 -2.10 0.00 0.00 70.33 68.23 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 -2.68 6.63 0.29 3.42 1.01 -1.26 -4.83 116.67 119.25 1m3d s ASP 16 Ca 0.23 0.79 -0.29 0.00 0.71 0.00 0.00 52.55 53.98 1m3d s ASP 16 Cb 0.18 -2.17 -0.10 0.00 1.01 0.00 0.00 42.92 41.84 1m3d s ASP 16 CO 0.44 0.14 1.29 -1.81 0.21 0.00 0.00 175.17 175.43 1m3d s ASP 17 N -1.89 6.86 0.59 0.27 1.01 -1.26 -4.50 116.67 117.74 1m3d s ASP 17 Ca 0.35 2.57 -0.16 0.00 0.71 0.00 0.00 52.55 56.03 1m3d s ASP 17 Cb -0.14 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.12 1m3d s ASP 17 CO 0.19 -0.49 1.05 -2.84 0.21 0.00 0.00 175.17 173.30 1m3d s PRO 18 N -1.31 3.37 -0.09 8.23 0.02 -1.26 -4.99 135.00 138.96 1m3d s PRO 18 Ca 0.51 1.19 -0.14 0.00 0.02 0.00 0.00 61.00 62.58 1m3d s PRO 18 Cb -0.38 -2.04 -0.05 0.00 0.02 0.00 0.00 34.50 32.05 1m3d s PRO 18 CO 0.48 -0.77 0.36 -0.65 -0.33 0.00 0.00 177.00 176.08 1m3d s GLN 19 N -4.06 4.06 0.28 5.54 -1.52 -1.26 -4.73 119.66 117.98 1m3d s GLN 19 Ca 0.63 0.26 -0.29 0.00 -1.95 0.00 0.00 55.36 54.01 1m3d s GLN 19 Cb -0.16 -3.32 -0.10 0.00 -0.22 0.00 0.00 33.01 29.21 1m3d s GLN 19 CO 0.36 0.45 1.42 0.00 -0.25 0.00 0.00 175.29 177.28 1m3d s PRO 21 N -0.90 1.81 0.32 0.00 0.04 -1.26 -4.87 135.00 130.14 1m3d s PRO 21 Ca 0.56 1.75 -0.29 0.00 0.04 0.00 0.00 61.00 63.07 1m3d s PRO 21 Cb -0.42 -1.80 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 1m3d s PRO 21 CO 0.48 -2.08 1.42 -0.35 0.04 0.00 0.00 177.00 176.51 1m3d n PRO 22 N -3.11 2.35 0.00 0.56 -0.04 -1.26 -2.07 135.00 131.43 1m3d n PRO 22 Ca 0.13 0.83 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 1m3d n PRO 22 Cb 0.50 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 1m3d n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1m3d n GLY 23 N 1.27 1.44 3.50 0.55 0.00 -1.26 -5.06 105.19 105.64 1m3d n GLY 23 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.38 2.80 -0.02 2.61 -4.23 -0.88 -4.39 115.64 109.15 1m3d s THR 24 Ca 0.00 -1.88 0.04 0.00 -1.18 0.00 0.00 61.69 58.67 1m3d s THR 24 Cb 0.00 -2.38 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 1m3d s THR 24 CO 0.00 -0.15 -0.14 -1.59 -0.54 0.00 0.00 174.62 172.20 1m3d s LYS 25 N -2.85 2.41 0.42 3.99 -2.85 -0.40 -4.78 119.74 115.68 1m3d s LYS 25 Ca 0.24 -0.76 -0.25 0.00 -1.00 0.00 0.00 55.97 54.19 1m3d s LYS 25 Cb -0.08 -2.35 -0.08 0.00 -2.06 0.00 0.00 37.83 33.26 1m3d s LYS 25 CO 0.13 0.60 1.21 -1.50 0.10 0.00 0.00 175.35 175.89 1m3d s ILE 26 N -0.81 2.96 -0.03 3.79 1.10 -1.26 0.01 121.20 126.97 1m3d s ILE 26 Ca 0.13 0.80 -0.02 0.00 -0.51 0.00 0.00 60.65 61.05 1m3d s ILE 26 Cb -0.11 -3.45 -0.02 0.00 0.15 0.00 0.00 42.46 39.04 1m3d s ILE 26 CO 0.02 0.07 -0.05 0.18 -2.11 0.00 0.00 174.94 173.05 1m3d n LEU 27 N -0.04 0.43 -3.51 8.50 4.77 -0.16 -4.83 117.00 122.17 1m3d n LEU 27 Ca 0.05 0.07 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 1m3d n LEU 27 Cb 0.46 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 1m3d n LEU 27 CO 0.52 -0.03 0.67 -0.72 -1.33 0.00 0.00 177.39 176.49 1m3d s TYR 28 N -2.08 -0.39 0.27 -1.77 -0.85 -1.19 -5.03 117.35 106.30 1m3d s TYR 28 Ca -0.05 0.38 0.09 0.00 -0.52 0.00 0.00 57.07 56.96 1m3d s TYR 28 Cb 0.02 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.83 1m3d s TYR 28 CO 0.07 -0.53 0.06 -1.01 -1.52 0.00 0.00 175.55 172.63 1m3d s HIS 29 N -2.59 2.81 0.00 -3.49 3.76 -1.26 -1.52 115.29 113.00 1m3d s HIS 29 Ca 0.02 -0.20 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 1m3d s HIS 29 Cb -0.01 -1.28 0.00 0.00 1.11 0.00 0.00 32.58 32.40 1m3d s HIS 29 CO -0.06 0.57 0.00 0.41 -0.85 0.00 0.00 174.74 174.82 1m3d n GLY 30 N -0.99 1.89 3.74 -2.22 0.00 -0.60 -4.63 105.19 102.38 1m3d n GLY 30 Ca -0.07 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.83 3.20 -0.67 1.61 1.51 0.62 -0.75 117.35 120.03 1m3d s TYR 31 Ca 0.00 0.16 -0.27 0.00 -1.01 0.00 0.00 57.07 55.94 1m3d s TYR 31 Cb 0.00 -1.71 0.03 0.00 -0.11 0.00 0.00 41.96 40.16 1m3d s TYR 31 CO 0.00 0.51 1.26 -1.12 -1.11 0.00 0.00 175.55 175.09 1m3d s SER 32 N -1.62 6.26 -0.22 2.29 0.01 -0.58 -1.46 113.70 118.38 1m3d s SER 32 Ca 0.21 -0.21 -0.20 0.00 1.31 0.00 0.00 55.95 57.05 1m3d s SER 32 Cb -0.12 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.53 1m3d s SER 32 CO 0.12 -1.71 0.62 -0.22 0.41 0.00 0.00 173.24 172.46 1m3d s LEU 33 N 5.48 4.11 -0.13 2.44 2.96 0.57 -1.39 118.68 132.72 1m3d s LEU 33 Ca 0.39 0.77 -0.08 0.00 -0.22 0.00 0.00 54.13 54.99 1m3d s LEU 33 Cb -0.08 -2.86 -0.05 0.00 0.50 0.00 0.00 46.19 43.70 1m3d s LEU 33 CO 0.19 -0.31 -0.02 0.25 -1.32 0.00 0.00 176.35 175.14 1m3d h LEU 34 N 8.47 0.00 -7.74 -0.68 5.85 -1.07 -3.42 115.31 116.73 1m3d h LEU 34 Ca -0.30 -0.11 0.16 0.00 0.84 0.00 0.00 57.88 58.48 1m3d h LEU 34 Cb 1.14 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 1m3d h LEU 34 CO 0.77 0.75 0.45 -0.72 -0.34 0.00 0.00 178.44 179.35 1m3d s TYR 35 N -2.01 -0.12 0.27 1.25 1.13 -1.05 -2.60 117.35 114.23 1m3d s TYR 35 Ca -0.11 -0.22 0.07 0.00 -1.41 0.00 0.00 57.07 55.40 1m3d s TYR 35 Cb 0.01 0.66 -0.06 0.00 -1.10 0.00 0.00 41.96 41.48 1m3d s TYR 35 CO 0.20 -0.91 -0.07 0.14 -2.51 0.00 0.00 175.55 172.40 1m3d s VAL 36 N -3.29 1.69 -0.15 -3.49 -7.23 -0.58 -0.01 120.40 107.34 1m3d s VAL 36 Ca 0.13 -2.14 -0.04 0.00 -1.81 0.00 0.00 61.98 58.11 1m3d s VAL 36 Cb -0.02 -2.41 0.06 0.00 0.56 0.00 0.00 36.38 34.56 1m3d s VAL 36 CO 0.03 -0.33 0.08 -1.58 -0.31 0.00 0.00 175.10 172.99 1m3d s GLN 37 N -3.71 0.15 -0.07 4.82 0.74 -0.35 -0.94 119.66 120.29 1m3d s GLN 37 Ca 0.29 -0.07 0.03 0.00 0.05 0.00 0.00 55.36 55.67 1m3d s GLN 37 Cb 0.03 -1.68 0.00 0.00 1.10 0.00 0.00 33.01 32.47 1m3d s GLN 37 CO 0.12 -0.61 -0.18 0.20 -0.55 0.00 0.00 175.29 174.27 1m3d s GLY 38 N 2.10 1.03 -1.50 2.59 0.00 -0.44 -1.17 107.32 109.93 1m3d s GLY 38 Ca 0.02 -0.69 -0.12 0.00 0.00 0.00 0.00 44.72 43.93 1m3d s GLY 38 CO -0.08 -0.15 0.96 -2.01 0.00 0.00 0.00 173.10 171.82 1m3d n ASN 39 N 3.56 -4.46 -0.21 1.64 4.05 -1.26 -1.49 115.26 117.10 1m3d n ASN 39 Ca -0.20 -0.77 -0.03 0.00 0.45 0.00 0.00 54.58 54.02 1m3d n ASN 39 Cb 0.52 -3.96 -0.01 0.00 1.23 0.00 0.00 39.78 37.56 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 -4.66 -0.97 -4.74 1.20 1.02 -1.26 -5.01 120.64 106.23 1m3d n GLU 40 Ca -0.00 0.42 -0.33 0.00 -0.02 0.00 0.00 57.16 57.23 1m3d n GLU 40 Cb 0.55 -4.24 -0.15 0.00 -0.02 0.00 0.00 31.44 27.58 1m3d n GLU 40 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1m3d s ARG 41 N -1.51 3.31 0.25 3.49 3.52 -0.56 -5.01 118.95 122.44 1m3d s ARG 41 Ca 0.00 -0.72 -0.18 0.00 -0.13 0.00 0.00 55.73 54.70 1m3d s ARG 41 Cb 0.00 -2.61 -0.08 0.00 -1.56 0.00 0.00 34.95 30.70 1m3d s ARG 41 CO 0.00 0.15 0.72 0.00 -0.81 0.00 0.00 175.30 175.36 1m3d s ALA 42 N 0.49 3.39 -0.16 6.12 0.00 -1.26 -1.32 121.76 129.02 1m3d s ALA 42 Ca -0.10 0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.94 1m3d s ALA 42 Cb -0.16 -2.80 0.08 0.00 0.00 0.00 0.00 23.12 20.24 1m3d s ALA 42 CO 0.04 0.33 0.26 -1.58 0.00 0.00 0.00 175.76 174.82 1m3d s HIS 43 N -1.64 -0.42 0.40 0.00 2.46 -0.12 -4.93 115.29 111.04 1m3d s HIS 43 Ca 0.46 0.72 0.07 0.00 0.47 0.00 0.00 55.06 56.78 1m3d s HIS 43 Cb -0.15 -0.14 0.01 0.00 -0.13 0.00 0.00 32.58 32.17 1m3d s HIS 43 CO 0.20 -0.47 0.55 0.20 -2.47 0.00 0.00 174.74 172.75 1m3d s GLY 44 N 2.40 1.87 -0.21 1.59 0.00 -1.26 -1.52 107.32 110.19 1m3d s GLY 44 Ca 0.04 -1.61 0.01 0.00 0.00 0.00 0.00 44.72 43.17 1m3d s GLY 44 CO -0.10 -1.45 -0.13 1.20 0.00 0.00 0.00 173.10 172.61 1m3d s GLN 45 N -4.32 2.36 0.01 2.90 -1.52 -1.07 -4.98 119.66 113.03 1m3d s GLN 45 Ca 0.53 -0.95 -0.36 0.00 -1.95 0.00 0.00 55.36 52.63 1m3d s GLN 45 Cb -0.10 -2.56 -0.14 0.00 -0.22 0.00 0.00 33.01 29.99 1m3d s GLN 45 CO 0.33 -0.39 1.63 -3.47 -0.25 0.00 0.00 175.29 173.13 1m3d n ASP 46 N 4.61 2.73 0.15 5.90 -0.08 -1.26 -4.60 116.55 124.00 1m3d n ASP 46 Ca -0.16 1.06 0.09 0.00 -1.51 0.00 0.00 54.79 54.27 1m3d n ASP 46 Cb 0.47 -1.31 0.49 0.00 2.34 0.00 0.00 41.12 43.11 1m3d n ASP 46 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1m3d n LEU 47 N 4.37 0.47 -0.22 -2.67 4.77 -1.26 -0.82 117.00 121.64 1m3d n LEU 47 Ca 0.20 0.70 0.13 0.00 -0.03 0.00 0.00 56.01 57.01 1m3d n LEU 47 Cb 0.24 -0.75 0.37 0.00 -2.33 0.00 0.00 43.42 40.95 1m3d n LEU 47 CO 0.69 -0.86 0.64 0.61 -1.33 0.00 0.00 177.39 177.13 1m3d n GLY 48 N -1.31 -0.67 3.78 -0.72 0.00 -1.26 -4.47 105.19 100.54 1m3d n GLY 48 Ca -0.01 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.54 4.21 -0.15 2.61 -4.23 0.00 -3.57 115.64 111.97 1m3d s THR 49 Ca 0.23 -1.49 0.27 0.00 -1.18 0.00 0.00 61.69 59.51 1m3d s THR 49 Cb 0.19 -3.26 0.28 0.00 1.34 0.00 0.00 72.50 71.05 1m3d s THR 49 CO 0.53 -0.33 1.80 0.00 -0.54 0.00 0.00 174.62 176.09 1m3d h ALA 50 N 1.67 1.00 0.00 3.99 0.00 -1.91 -2.31 119.26 121.70 1m3d h ALA 50 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1m3d h ALA 50 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 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 1.01 0.00 -0.80 0.00 0.00 -1.95 -1.68 103.07 99.65 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 -2.98 1.59 -3.91 0.19 3.41 -0.87 -4.63 113.62 106.42 1m3d n SER 52 Ca -0.00 -1.74 -0.31 0.00 -0.26 0.00 0.00 58.87 56.56 1m3d n SER 52 Cb 0.22 -0.12 -0.15 0.00 -0.26 0.00 0.00 64.21 63.90 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 1.20 4.33 0.38 0.00 1.02 -0.53 -4.83 118.68 120.25 1m3d s LEU 54 Ca 0.09 0.40 0.08 0.00 0.02 0.00 0.00 54.13 54.72 1m3d s LEU 54 Cb -0.18 -2.09 0.76 0.00 0.02 0.00 0.00 46.19 44.70 1m3d s LEU 54 CO -0.14 0.33 1.93 0.03 0.02 0.00 0.00 176.35 178.52 1m3d h ARG 55 N 5.55 0.37 -6.01 1.70 3.08 -1.88 0.18 114.38 117.36 1m3d h ARG 55 Ca -0.50 -0.07 -0.68 0.00 0.07 0.00 0.00 59.98 58.80 1m3d h ARG 55 Cb 1.20 -0.06 -0.31 0.00 0.08 0.00 0.00 29.97 30.88 1m3d h ARG 55 CO 0.64 0.41 -0.88 0.15 -1.07 0.00 0.00 179.97 179.22 1m3d s LYS 56 N -4.93 2.45 0.15 0.04 1.02 -1.26 -4.71 119.74 112.50 1m3d s LYS 56 Ca -0.07 -0.88 -0.08 0.00 0.02 0.00 0.00 55.97 54.96 1m3d s LYS 56 Cb 0.16 -2.10 -0.06 0.00 -0.52 0.00 0.00 37.83 35.30 1m3d s LYS 56 CO 0.74 0.39 0.44 0.12 -0.92 0.00 0.00 175.35 176.11 1m3d s PHE 57 N -0.19 3.49 -0.19 3.18 5.36 -1.26 -4.92 117.98 123.46 1m3d s PHE 57 Ca -0.03 0.72 -0.28 0.00 -0.96 0.00 0.00 56.93 56.38 1m3d s PHE 57 Cb -0.13 -2.13 0.11 0.00 -0.34 0.00 0.00 43.02 40.53 1m3d s PHE 57 CO 0.03 0.40 0.91 0.45 -1.46 0.00 0.00 175.22 175.55 1m3d s SER 58 N -2.23 -0.50 0.42 6.13 0.15 -1.26 -5.01 113.70 111.40 1m3d s SER 58 Ca 0.41 0.75 0.29 0.00 0.70 0.00 0.00 55.95 58.09 1m3d s SER 58 Cb -0.12 0.68 1.06 0.00 -1.71 0.00 0.00 66.02 65.93 1m3d s SER 58 CO 0.22 -0.33 1.84 0.71 1.20 0.00 0.00 173.24 176.88 1m3d h THR 59 N 3.16 0.00 -2.18 6.45 1.35 -1.94 -3.34 112.91 116.41 1m3d h THR 59 Ca -0.24 -0.50 -0.54 0.00 -0.55 0.00 0.00 66.41 64.57 1m3d h THR 59 Cb 1.16 1.43 -0.36 0.00 -1.73 0.00 0.00 68.15 68.66 1m3d h THR 59 CO 0.23 0.00 -0.94 0.80 -0.25 0.00 0.00 175.52 175.36 1m3d n MET 60 N -2.78 0.26 0.00 4.72 0.00 -1.26 -3.96 117.12 114.10 1m3d n MET 60 Ca 0.02 -3.05 0.03 0.00 -0.00 0.00 0.00 57.70 54.70 1m3d n MET 60 Cb 0.33 -1.62 0.16 0.00 0.00 0.00 0.00 33.22 32.10 1m3d n MET 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1m3d n PRO 61 N 2.74 0.75 -4.07 2.12 -0.04 -1.26 -4.85 135.00 130.40 1m3d n PRO 61 Ca 0.28 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.64 1m3d n PRO 61 Cb 0.49 -1.11 -0.07 0.00 -0.04 0.00 0.00 33.50 32.77 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 0.67 0.26 0.54 -0.71 -1.26 -5.10 117.98 110.38 1m3d s PHE 62 Ca 0.08 -0.98 0.02 0.00 -1.04 0.00 0.00 56.93 55.01 1m3d s PHE 62 Cb 0.04 -0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.68 1m3d s PHE 62 CO 0.06 -0.82 0.18 -0.48 -1.34 0.00 0.00 175.22 172.82 1m3d s LEU 63 N -3.06 1.45 0.07 -1.99 0.05 -1.26 -4.54 118.68 109.38 1m3d s LEU 63 Ca 0.28 -1.53 0.04 0.00 0.05 0.00 0.00 54.13 52.97 1m3d s LEU 63 Cb 0.03 0.37 -0.03 0.00 -2.05 0.00 0.00 46.19 44.51 1m3d s LEU 63 CO 0.09 -0.91 -0.11 0.72 -0.55 0.00 0.00 176.35 175.59 1m3d s PHE 64 N -3.83 1.00 0.05 3.48 -0.12 -1.01 -4.99 117.98 112.56 1m3d s PHE 64 Ca 0.39 -0.52 0.07 0.00 -0.05 0.00 0.00 56.93 56.82 1m3d s PHE 64 Cb 0.05 -0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 41.85 1m3d s PHE 64 CO 0.18 -0.00 -0.20 0.00 -0.05 0.00 0.00 175.22 175.14 1m3d n ASN 66 N 1.75 2.65 0.13 0.00 0.23 -0.02 -4.97 115.26 115.03 1m3d n ASN 66 Ca -0.18 -2.84 0.11 0.00 -0.53 0.00 0.00 54.58 51.14 1m3d n ASN 66 Cb 0.54 -0.12 0.51 0.00 -2.08 0.00 0.00 39.78 38.62 1m3d n ASN 66 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 1m3d n ILE 67 N -1.90 0.94 0.09 1.53 -6.64 -1.26 -1.60 119.36 110.52 1m3d n ILE 67 Ca 0.02 0.41 0.07 0.00 -1.77 0.00 0.00 62.75 61.48 1m3d n ILE 67 Cb 0.63 -1.36 0.25 0.00 -1.44 0.00 0.00 39.64 37.71 1m3d n ILE 67 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 1m3d n ASN 68 N -2.20 3.37 -3.40 7.28 3.02 -1.26 -4.91 115.26 117.15 1m3d n ASN 68 Ca 0.01 -2.26 -0.22 0.00 -0.03 0.00 0.00 54.58 52.08 1m3d n ASN 68 Cb 0.15 -0.46 0.08 0.00 -0.61 0.00 0.00 39.78 38.94 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 0.77 -5.59 -4.12 6.41 3.02 -0.63 -5.01 115.26 110.11 1m3d n ASN 69 Ca 0.18 -0.52 -0.27 0.00 -0.03 0.00 0.00 54.58 53.94 1m3d n ASN 69 Cb 0.63 -4.79 -0.16 0.00 -0.61 0.00 0.00 39.78 34.85 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 -3.31 1.51 0.08 2.41 1.01 -1.26 -4.95 120.40 115.89 1m3d s VAL 70 Ca 0.48 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.80 1m3d s VAL 70 Cb -0.21 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 1m3d s VAL 70 CO 0.69 0.44 -0.11 0.00 0.00 0.00 0.00 175.10 176.11 1m3d s ASN 72 N -1.93 2.45 -0.15 0.00 0.01 0.66 -4.97 114.94 111.00 1m3d s ASN 72 Ca 0.19 -0.43 -0.01 0.00 -0.71 0.00 0.00 52.86 51.90 1m3d s ASN 72 Cb -0.11 -1.11 -0.01 0.00 0.41 0.00 0.00 41.25 40.43 1m3d s ASN 72 CO 0.11 0.05 -0.12 0.12 -1.51 0.00 0.00 177.10 175.75 1m3d s PHE 73 N 0.78 2.84 -1.67 2.20 5.36 -1.26 -2.41 117.98 123.82 1m3d s PHE 73 Ca -0.11 -0.79 -0.14 0.00 -0.96 0.00 0.00 56.93 54.93 1m3d s PHE 73 Cb -0.16 -1.91 0.13 0.00 -0.34 0.00 0.00 43.02 40.74 1m3d s PHE 73 CO 0.02 -0.33 0.58 0.00 -1.46 0.00 0.00 175.22 174.02 1m3d n ALA 74 N 3.90 -1.47 0.27 11.12 0.00 -1.26 -4.83 120.51 128.23 1m3d n ALA 74 Ca -0.18 -0.15 0.03 0.00 0.00 0.00 0.00 53.44 53.13 1m3d n ALA 74 Cb 0.52 -2.59 -0.03 0.00 0.00 0.00 0.00 19.45 17.35 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 -2.70 0.34 0.00 0.00 7.64 -1.26 -4.79 113.62 112.85 1m3d n SER 75 Ca -0.03 -0.67 0.00 0.00 1.01 0.00 0.00 58.87 59.17 1m3d n SER 75 Cb 0.54 0.94 0.00 0.00 -1.01 0.00 0.00 64.21 64.68 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 -1.04 0.00 -3.17 1.43 0.63 -1.26 -5.07 116.66 108.17 1m3d n ARG 76 Ca 0.01 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.76 1m3d n ARG 76 Cb 0.09 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.97 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 0.93 -5.00 6.15 3.02 -1.26 -4.88 115.26 114.22 1m3d n ASN 77 Ca 0.00 -3.02 -0.18 0.00 -0.03 0.00 0.00 54.58 51.35 1m3d n ASN 77 Cb 0.00 -0.62 0.01 0.00 -0.61 0.00 0.00 39.78 38.56 1m3d n ASN 77 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1m3d s ASP 78 N -2.47 5.76 0.18 6.41 -0.00 -1.26 -4.89 116.67 120.40 1m3d s ASP 78 Ca 0.40 -0.30 0.03 0.00 -0.00 0.00 0.00 52.55 52.68 1m3d s ASP 78 Cb 0.35 -0.89 -0.05 0.00 -0.00 0.00 0.00 42.92 42.33 1m3d s ASP 78 CO -0.08 -0.66 -0.04 -0.31 -0.00 0.00 0.00 175.17 174.08 1m3d s TYR 79 N -2.31 1.35 0.01 4.23 1.51 -0.32 -2.67 117.35 119.15 1m3d s TYR 79 Ca 0.51 -0.90 0.00 0.00 -1.01 0.00 0.00 57.07 55.68 1m3d s TYR 79 Cb -0.10 -0.75 -0.01 0.00 -0.11 0.00 0.00 41.96 40.99 1m3d s TYR 79 CO 0.33 -0.05 -0.02 -1.54 -1.11 0.00 0.00 175.55 173.16 1m3d s SER 80 N -3.22 0.16 -0.04 2.29 1.04 -0.75 -1.22 113.70 111.96 1m3d s SER 80 Ca 0.23 -0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.55 1m3d s SER 80 Cb 0.05 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1m3d s SER 80 CO 0.04 -0.07 -0.15 -0.31 0.98 0.00 0.00 173.24 173.74 1m3d s TYR 81 N -0.39 1.52 0.05 5.02 2.02 0.98 -0.76 117.35 125.78 1m3d s TYR 81 Ca -0.04 -0.45 0.05 0.00 -0.37 0.00 0.00 57.07 56.27 1m3d s TYR 81 Cb -0.03 -1.04 -0.02 0.00 -0.40 0.00 0.00 41.96 40.46 1m3d s TYR 81 CO -0.00 -0.17 -0.15 -1.58 -1.57 0.00 0.00 175.55 172.08 1m3d s TRP 82 N 0.17 1.28 0.47 2.71 0.52 -0.93 -0.47 118.94 122.70 1m3d s TRP 82 Ca -0.05 -0.38 -0.24 0.00 0.02 0.00 0.00 56.10 55.45 1m3d s TRP 82 Cb -0.12 -0.75 -0.07 0.00 -1.15 0.00 0.00 33.47 31.38 1m3d s TRP 82 CO 0.02 0.05 1.37 -0.51 0.02 0.00 0.00 176.95 177.90 1m3d s LEU 83 N -1.29 4.04 0.45 2.99 1.43 -0.49 -0.76 118.68 125.06 1m3d s LEU 83 Ca 0.01 2.78 0.06 0.00 -1.03 0.00 0.00 54.13 55.96 1m3d s LEU 83 Cb -0.08 -4.05 -0.03 0.00 0.03 0.00 0.00 46.19 42.06 1m3d s LEU 83 CO 0.02 -1.22 0.24 -0.94 0.23 0.00 0.00 176.35 174.67 1m3d s SER 84 N -0.74 4.51 0.59 2.29 1.04 0.10 -1.12 113.70 120.36 1m3d s SER 84 Ca 0.64 -1.13 0.10 0.00 0.48 0.00 0.00 55.95 56.04 1m3d s SER 84 Cb -0.41 -0.22 0.09 0.00 0.10 0.00 0.00 66.02 65.59 1m3d s SER 84 CO 0.51 -0.70 0.81 0.42 0.98 0.00 0.00 173.24 175.26 1m3d s THR 85 N -2.65 2.08 -1.93 2.02 -4.23 -0.68 -4.47 115.64 105.78 1m3d s THR 85 Ca 0.37 -1.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.14 1m3d s THR 85 Cb 0.02 -2.08 0.68 0.00 1.34 0.00 0.00 72.50 72.45 1m3d s THR 85 CO 0.21 0.00 1.85 -2.65 -0.54 0.00 0.00 174.62 173.49 1m3d n PRO 86 N -2.28 0.73 -1.70 3.99 -0.02 -1.26 -4.86 135.00 129.60 1m3d n PRO 86 Ca 0.16 0.01 -0.56 0.00 -2.02 0.00 0.00 63.50 61.08 1m3d n PRO 86 Cb 0.62 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.53 1m3d n PRO 86 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1m3d n GLU 87 N -1.03 1.26 -1.86 -0.52 4.07 -1.26 -4.88 120.64 116.41 1m3d n GLU 87 Ca 0.18 0.46 -0.40 0.00 -0.06 0.00 0.00 57.16 57.34 1m3d n GLU 87 Cb 0.10 -2.17 0.00 0.00 -0.06 0.00 0.00 31.44 29.31 1m3d n GLU 87 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 1m3d s PRO 88 N 3.70 3.97 0.44 5.31 0.02 -1.26 -4.96 135.00 142.22 1m3d s PRO 88 Ca 0.98 2.44 -0.25 0.00 0.02 0.00 0.00 61.00 64.19 1m3d s PRO 88 Cb -1.03 -2.85 -0.08 0.00 0.02 0.00 0.00 34.50 30.56 1m3d s PRO 88 CO 0.64 -0.59 1.36 1.41 -0.33 0.00 0.00 177.00 179.49 1m3d s MET 89 N -2.20 3.76 0.67 5.54 -2.45 -1.26 -4.93 119.30 118.43 1m3d s MET 89 Ca 0.56 2.28 -0.17 0.00 -1.25 0.00 0.00 55.69 57.10 1m3d s MET 89 Cb -0.44 -2.66 -0.04 0.00 1.25 0.00 0.00 34.83 32.95 1m3d s MET 89 CO 0.58 -0.70 0.76 -2.30 1.05 0.00 0.00 175.02 174.41 1m3d n PRO 90 N -0.13 0.54 -0.28 4.11 -0.02 -1.26 -4.89 135.00 133.07 1m3d n PRO 90 Ca 0.05 0.23 -0.04 0.00 -2.02 0.00 0.00 63.50 61.72 1m3d n PRO 90 Cb 0.43 -2.00 0.07 0.00 -0.02 0.00 0.00 33.50 31.98 1m3d n PRO 90 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1m3d h MET 91 N -0.03 0.99 0.00 -0.52 4.05 -1.96 -1.81 114.93 115.65 1m3d h MET 91 Ca -0.47 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 58.88 1m3d h MET 91 Cb 1.36 -0.22 -0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1m3d h MET 91 CO 0.46 0.66 -0.04 0.66 0.23 0.00 0.00 176.91 178.88 1m3d h SER 92 N 1.02 0.00 -0.18 1.39 4.64 -2.03 -3.45 113.55 114.94 1m3d h SER 92 Ca 0.29 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.53 1m3d h SER 92 Cb -0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 61.97 1m3d h SER 92 CO -0.07 0.04 -0.07 0.23 -0.87 0.00 0.00 176.83 176.08 1m3d n MET 93 N -3.39 -1.15 -2.88 4.77 0.00 -0.68 -4.98 117.12 108.81 1m3d n MET 93 Ca -0.02 0.50 -0.29 0.00 0.00 0.00 0.00 57.70 57.89 1m3d n MET 93 Cb 0.16 -4.48 -0.02 0.00 0.00 0.00 0.00 33.22 28.88 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 -1.70 3.40 0.53 3.04 0.00 -1.26 -4.98 121.76 120.79 1m3d s ALA 94 Ca 0.00 -0.33 -0.21 0.00 0.00 0.00 0.00 51.96 51.42 1m3d s ALA 94 Cb 0.00 -2.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.44 1m3d s ALA 94 CO 0.00 -0.05 1.11 -2.30 0.00 0.00 0.00 175.76 174.52 1m3d n PRO 95 N -1.47 1.31 -3.78 0.00 -0.02 -1.26 -4.81 135.00 124.97 1m3d n PRO 95 Ca 0.01 0.49 -0.35 0.00 -2.02 0.00 0.00 63.50 61.62 1m3d n PRO 95 Cb 0.54 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 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 -1.37 5.34 0.13 4.25 1.09 0.43 -4.87 121.20 126.19 1m3d s ILE 96 Ca 0.70 0.22 0.03 0.00 -1.10 0.00 0.00 60.65 60.50 1m3d s ILE 96 Cb -0.46 -3.53 -0.04 0.00 -1.06 0.00 0.00 42.46 37.37 1m3d s ILE 96 CO 0.51 0.45 -0.09 0.42 -0.10 0.00 0.00 174.94 176.14 1m3d s THR 97 N -1.20 0.97 0.00 2.92 -4.23 -1.26 -1.37 115.64 111.46 1m3d s THR 97 Ca 0.24 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 1m3d s THR 97 Cb -0.13 -1.77 0.00 0.00 1.34 0.00 0.00 72.50 71.94 1m3d s THR 97 CO 0.13 -0.80 0.00 0.61 -0.54 0.00 0.00 174.62 174.02 1m3d n GLY 98 N -0.12 2.42 0.32 3.99 0.00 -1.25 -2.29 105.19 108.26 1m3d n GLY 98 Ca -0.11 -0.29 0.16 0.00 0.00 0.00 0.00 46.02 45.77 1m3d n GLY 98 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1m3d h GLU 99 N 0.00 0.00 0.00 1.61 4.22 -1.99 -1.31 114.58 117.11 1m3d h GLU 99 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1m3d h GLU 99 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1m3d h GLU 99 CO 0.00 0.00 0.00 0.09 -2.18 0.00 0.00 179.01 176.92 1m3d n ASN 100 N -4.01 0.62 0.09 1.04 3.02 -0.97 -2.09 115.26 112.97 1m3d n ASN 100 Ca 0.01 0.74 -0.06 0.00 -0.03 0.00 0.00 54.58 55.24 1m3d n ASN 100 Cb 0.27 -0.84 0.08 0.00 -0.61 0.00 0.00 39.78 38.68 1m3d n ASN 100 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1m3d h ILE 101 N 0.00 1.43 -0.93 2.41 1.08 -1.34 -3.36 117.51 116.80 1m3d h ILE 101 Ca 0.00 -2.24 0.13 0.00 -0.39 0.00 0.00 64.86 62.37 1m3d h ILE 101 Cb 0.13 2.19 -0.14 0.00 -3.07 0.00 0.00 36.82 35.92 1m3d h ILE 101 CO 0.00 0.65 -0.40 -1.14 -0.69 0.00 0.00 178.15 176.57 1m3d n ARG 102 N -3.78 -0.26 0.31 2.37 3.00 -0.89 -0.91 116.66 116.50 1m3d n ARG 102 Ca -0.03 1.42 0.16 0.00 -0.00 0.00 0.00 57.85 59.41 1m3d n ARG 102 Cb 0.69 -2.11 0.87 0.00 0.00 0.00 0.00 32.46 31.91 1m3d n ARG 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1m3d h PRO 103 N 0.00 0.00 0.00 -0.14 0.11 -1.81 -2.49 132.00 127.67 1m3d h PRO 103 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1m3d h PRO 103 Cb 0.52 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1m3d h PRO 103 CO -0.91 0.00 -0.81 1.19 -0.21 0.00 0.00 178.00 177.26 1m3d n PHE 104 N -2.82 0.12 -3.44 0.65 3.01 -0.09 -4.58 117.46 110.32 1m3d n PHE 104 Ca -0.02 0.04 -0.38 0.00 1.01 0.00 0.00 57.45 58.10 1m3d n PHE 104 Cb 0.27 -0.29 -0.08 0.00 -0.01 0.00 0.00 39.48 39.37 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 -3.08 5.23 0.60 4.37 1.01 -0.94 -1.69 121.20 126.70 1m3d s ILE 105 Ca 0.07 0.62 -0.18 0.00 0.00 0.00 0.00 60.65 61.16 1m3d s ILE 105 Cb 0.16 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.91 1m3d s ILE 105 CO 0.77 0.28 1.20 -0.55 0.00 0.00 0.00 174.94 176.64 1m3d s SER 106 N 1.00 5.14 0.24 3.58 0.15 -0.28 -4.47 113.70 119.05 1m3d s SER 106 Ca 0.17 2.36 0.07 0.00 0.70 0.00 0.00 55.95 59.26 1m3d s SER 106 Cb -0.14 -2.60 -0.04 0.00 -1.71 0.00 0.00 66.02 61.53 1m3d s SER 106 CO 0.07 -1.63 0.17 -0.13 1.20 0.00 0.00 173.24 172.92 1m3d s ARG 107 N -3.40 2.87 0.15 5.44 1.81 -0.73 -1.53 118.95 123.56 1m3d s ARG 107 Ca 0.77 -1.05 -0.03 0.00 -1.72 0.00 0.00 55.73 53.70 1m3d s ARG 107 Cb -0.30 -2.55 -0.03 0.00 -0.45 0.00 0.00 34.95 31.62 1m3d s ARG 107 CO 0.34 0.41 0.12 0.00 -0.68 0.00 0.00 175.30 175.50 1m3d s ALA 109 N -4.04 0.52 -0.26 0.00 0.00 -0.16 -1.55 121.76 116.27 1m3d s ALA 109 Ca 0.24 -0.18 -0.05 0.00 0.00 0.00 0.00 51.96 51.96 1m3d s ALA 109 Cb 0.06 -0.20 -0.00 0.00 0.00 0.00 0.00 23.12 22.98 1m3d s ALA 109 CO 0.02 0.08 0.03 0.08 0.00 0.00 0.00 175.76 175.97 1m3d s VAL 110 N 0.16 3.74 0.15 0.00 1.01 -0.58 -1.00 120.40 123.88 1m3d s VAL 110 Ca -0.02 -0.56 0.09 0.00 0.00 0.00 0.00 61.98 61.49 1m3d s VAL 110 Cb -0.06 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1m3d s VAL 110 CO -0.00 0.25 -0.16 0.00 0.00 0.00 0.00 175.10 175.18 1m3d s GLU 112 N -2.43 4.09 0.17 0.00 2.12 0.10 -0.14 118.70 122.60 1m3d s GLU 112 Ca 0.20 -0.26 0.07 0.00 0.36 0.00 0.00 54.97 55.35 1m3d s GLU 112 Cb -0.10 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1m3d s GLU 112 CO 0.12 0.09 -0.03 0.00 -0.54 0.00 0.00 175.26 174.90 1m3d s ALA 113 N 0.98 3.14 -0.45 6.30 0.00 0.39 -1.28 121.76 130.84 1m3d s ALA 113 Ca 0.08 -1.37 0.26 0.00 0.00 0.00 0.00 51.96 50.93 1m3d s ALA 113 Cb -0.13 -0.94 0.88 0.00 0.00 0.00 0.00 23.12 22.92 1m3d s ALA 113 CO 0.04 0.50 1.77 -1.00 0.00 0.00 0.00 175.76 177.06 1m3d h PRO 114 N 2.82 0.00 -3.84 0.00 0.13 -1.81 0.50 132.00 129.80 1m3d h PRO 114 Ca -0.47 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.56 1m3d h PRO 114 Cb 1.20 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.23 1m3d h PRO 114 CO 0.57 0.00 -0.21 0.00 -0.23 0.00 0.00 178.00 178.13 1m3d s ALA 115 N -3.29 0.06 0.75 -0.56 0.00 -1.26 -4.86 121.76 112.61 1m3d s ALA 115 Ca 0.06 -1.06 -0.15 0.00 0.00 0.00 0.00 51.96 50.81 1m3d s ALA 115 Cb 0.09 1.13 0.04 0.00 0.00 0.00 0.00 23.12 24.39 1m3d s ALA 115 CO 0.54 -0.81 1.16 -1.33 0.00 0.00 0.00 175.76 175.32 1m3d n MET 116 N -0.37 0.47 -4.74 0.00 2.81 -1.26 -4.77 117.12 109.25 1m3d n MET 116 Ca -0.01 0.23 -0.24 0.00 -1.81 0.00 0.00 57.70 55.87 1m3d n MET 116 Cb 0.63 -2.40 -0.16 0.00 -0.71 0.00 0.00 33.22 30.58 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 -1.88 1.26 0.24 2.03 1.01 -1.26 -2.84 120.40 118.96 1m3d s VAL 117 Ca 0.75 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1m3d s VAL 117 Cb -0.32 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1m3d s VAL 117 CO 0.48 0.36 0.12 0.00 0.00 0.00 0.00 175.10 176.07 1m3d s MET 118 N -0.16 1.35 0.05 2.72 0.23 0.03 -4.78 119.30 118.74 1m3d s MET 118 Ca 0.02 -1.73 0.07 0.00 -1.03 0.00 0.00 55.69 53.02 1m3d s MET 118 Cb -0.08 0.01 -0.03 0.00 -1.53 0.00 0.00 34.83 33.20 1m3d s MET 118 CO 0.00 -0.37 -0.20 0.00 -2.03 0.00 0.00 175.02 172.42 1m3d s ALA 119 N -3.90 1.73 0.07 3.16 0.00 -0.70 -0.37 121.76 121.75 1m3d s ALA 119 Ca 0.38 -1.06 0.06 0.00 0.00 0.00 0.00 51.96 51.34 1m3d s ALA 119 Cb 0.07 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1m3d s ALA 119 CO 0.14 0.38 -0.17 0.14 0.00 0.00 0.00 175.76 176.25 1m3d s VAL 120 N -0.83 1.37 -0.00 0.00 -7.23 -0.59 -4.62 120.40 108.50 1m3d s VAL 120 Ca 0.07 -1.28 0.06 0.00 -1.81 0.00 0.00 61.98 59.02 1m3d s VAL 120 Cb -0.09 -1.25 -0.02 0.00 0.56 0.00 0.00 36.38 35.58 1m3d s VAL 120 CO 0.02 -0.05 -0.18 -1.00 -0.31 0.00 0.00 175.10 173.58 1m3d s HIS 121 N -1.06 1.59 -0.10 2.82 3.76 -1.26 -1.63 115.29 119.41 1m3d s HIS 121 Ca 0.03 -0.31 0.15 0.00 -0.15 0.00 0.00 55.06 54.77 1m3d s HIS 121 Cb -0.09 -1.01 -0.24 0.00 1.11 0.00 0.00 32.58 32.35 1m3d s HIS 121 CO 0.02 -0.00 0.44 -1.13 -0.85 0.00 0.00 174.74 173.22 1m3d n SER 122 N 2.46 0.55 -1.78 1.40 3.41 -0.83 -4.94 113.62 113.89 1m3d n SER 122 Ca -0.15 0.26 -0.15 0.00 -0.26 0.00 0.00 58.87 58.57 1m3d n SER 122 Cb 0.54 0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 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 -2.93 -1.73 -3.44 4.33 6.02 -1.26 -4.94 117.38 113.42 1m3d n GLN 123 Ca -0.23 0.68 -0.09 0.00 -0.01 0.00 0.00 57.00 57.35 1m3d n GLN 123 Cb 1.09 -4.98 0.01 0.00 1.02 0.00 0.00 30.24 27.37 1m3d n GLN 123 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1m3d n THR 124 N -4.04 0.00 1.71 5.09 -2.24 -1.26 -0.37 114.28 113.17 1m3d n THR 124 Ca -0.15 -1.10 0.15 0.00 -2.27 0.00 0.00 64.05 60.68 1m3d n THR 124 Cb 0.62 0.87 0.77 0.00 -2.10 0.00 0.00 70.33 70.49 1m3d n THR 124 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1m3d n ILE 125 N -0.47 0.00 -2.75 2.28 -5.35 -1.26 -2.15 119.36 109.67 1m3d n ILE 125 Ca -0.04 -0.07 -0.34 0.00 -0.27 0.00 0.00 62.75 62.03 1m3d n ILE 125 Cb 0.50 -0.19 -0.06 0.00 -1.74 0.00 0.00 39.64 38.15 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 -2.15 4.21 -0.25 6.28 -0.21 -1.26 -4.86 119.66 121.43 1m3d s GLN 126 Ca 0.40 1.22 -0.25 0.00 0.02 0.00 0.00 55.36 56.76 1m3d s GLN 126 Cb 0.21 -2.30 -0.00 0.00 1.00 0.00 0.00 33.01 31.92 1m3d s GLN 126 CO 0.39 -0.05 0.84 0.42 -2.12 0.00 0.00 175.29 174.77 1m3d s ILE 127 N -2.01 4.82 0.29 1.08 1.09 -1.26 -4.42 121.20 120.79 1m3d s ILE 127 Ca 0.61 1.55 -0.29 0.00 -1.10 0.00 0.00 60.65 61.41 1m3d s ILE 127 Cb -0.13 -4.13 -0.10 0.00 -1.06 0.00 0.00 42.46 37.04 1m3d s ILE 127 CO 0.17 -0.10 1.37 -2.16 -0.10 0.00 0.00 174.94 174.12 1m3d s PRO 128 N 2.88 4.30 0.38 2.79 0.04 -1.26 -4.98 135.00 139.16 1m3d s PRO 128 Ca 0.35 2.26 -0.24 0.00 0.04 0.00 0.00 61.00 63.42 1m3d s PRO 128 Cb -0.15 -3.09 -0.10 0.00 0.04 0.00 0.00 34.50 31.20 1m3d s PRO 128 CO 0.08 -0.31 0.98 -0.65 0.04 0.00 0.00 177.00 177.14 1m3d s GLN 129 N -1.11 4.33 0.46 4.56 -0.21 -1.26 -4.55 119.66 121.88 1m3d s GLN 129 Ca 0.54 1.31 -0.23 0.00 0.02 0.00 0.00 55.36 57.00 1m3d s GLN 129 Cb -0.41 -2.51 -0.07 0.00 1.00 0.00 0.00 33.01 31.02 1m3d s GLN 129 CO 0.49 0.04 1.16 0.00 -2.12 0.00 0.00 175.29 174.86 1m3d s PRO 131 N -2.68 3.11 0.17 0.00 0.02 -1.26 -4.84 135.00 129.51 1m3d s PRO 131 Ca 0.63 2.18 -0.34 0.00 0.02 0.00 0.00 61.00 63.50 1m3d s PRO 131 Cb -0.28 -2.21 -0.14 0.00 0.02 0.00 0.00 34.50 31.89 1m3d s PRO 131 CO 0.35 -1.20 1.60 -2.37 -0.33 0.00 0.00 177.00 175.05 1m3d n THR 132 N -1.10 0.01 0.00 0.99 5.66 -1.26 -0.91 114.28 117.67 1m3d n THR 132 Ca 0.11 -0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 1m3d n THR 132 Cb 0.46 -1.62 0.00 0.00 -1.55 0.00 0.00 70.33 67.62 1m3d n THR 132 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1m3d n GLY 133 N 3.49 0.43 3.37 1.09 0.00 -1.26 -5.07 105.19 107.23 1m3d n GLY 133 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 2.40 0.10 1.61 0.52 -0.09 -4.56 118.94 116.91 1m3d s TRP 134 Ca 0.00 -0.37 0.05 0.00 0.02 0.00 0.00 56.10 55.79 1m3d s TRP 134 Cb 0.00 -1.45 -0.04 0.00 -1.15 0.00 0.00 33.47 30.83 1m3d s TRP 134 CO 0.00 0.11 0.02 -1.12 0.02 0.00 0.00 176.95 175.98 1m3d s SER 135 N -1.06 5.14 0.29 2.95 0.01 0.20 -4.64 113.70 116.58 1m3d s SER 135 Ca 0.12 -0.15 -0.29 0.00 1.31 0.00 0.00 55.95 56.93 1m3d s SER 135 Cb -0.10 -1.26 -0.09 0.00 0.21 0.00 0.00 66.02 64.78 1m3d s SER 135 CO 0.02 0.16 1.08 -0.55 0.41 0.00 0.00 173.24 174.36 1m3d s SER 136 N -2.41 7.27 -0.14 2.44 0.15 -1.26 0.47 113.70 120.22 1m3d s SER 136 Ca 0.27 2.22 0.03 0.00 0.70 0.00 0.00 55.95 59.16 1m3d s SER 136 Cb -0.12 -2.62 -0.10 0.00 -1.71 0.00 0.00 66.02 61.47 1m3d s SER 136 CO 0.19 -0.14 -0.10 0.18 1.20 0.00 0.00 173.24 174.57 1m3d n LEU 137 N 1.12 2.50 -3.61 3.45 4.77 0.15 -4.87 117.00 120.51 1m3d n LEU 137 Ca -0.01 -0.07 -0.01 0.00 -0.03 0.00 0.00 56.01 55.90 1m3d n LEU 137 Cb 0.45 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1m3d n LEU 137 CO 0.53 0.67 1.06 -1.66 -1.33 0.00 0.00 177.39 176.66 1m3d s TRP 138 N -2.29 -0.07 0.33 -1.77 -2.14 -1.18 -4.91 118.94 106.91 1m3d s TRP 138 Ca -0.17 0.00 0.09 0.00 2.66 0.00 0.00 56.10 58.68 1m3d s TRP 138 Cb 0.05 0.53 -0.06 0.00 -3.10 0.00 0.00 33.47 30.88 1m3d s TRP 138 CO 0.36 -0.21 -0.10 0.96 -2.66 0.00 0.00 176.95 175.30 1m3d s ILE 139 N -2.36 2.20 0.00 0.66 -4.36 -1.26 -0.24 121.20 115.84 1m3d s ILE 139 Ca 0.12 -2.22 0.00 0.00 -0.26 0.00 0.00 60.65 58.29 1m3d s ILE 139 Cb 0.02 -2.59 0.00 0.00 1.25 0.00 0.00 42.46 41.14 1m3d s ILE 139 CO -0.04 -0.23 0.00 0.61 0.24 0.00 0.00 174.94 175.52 1m3d n GLY 140 N -0.75 1.84 3.28 6.27 0.00 -0.42 -4.40 105.19 111.00 1m3d n GLY 140 Ca -0.05 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.90 2.19 -0.58 1.61 1.51 0.61 -1.83 117.35 119.95 1m3d s TYR 141 Ca 0.00 -0.43 -0.26 0.00 -1.01 0.00 0.00 57.07 55.37 1m3d s TYR 141 Cb 0.00 -1.41 -0.04 0.00 -0.11 0.00 0.00 41.96 40.40 1m3d s TYR 141 CO 0.00 -0.05 2.04 -1.12 -1.11 0.00 0.00 175.55 175.31 1m3d s SER 142 N -0.54 4.99 -0.30 2.29 0.01 -0.36 -2.18 113.70 117.61 1m3d s SER 142 Ca 0.09 0.54 -0.14 0.00 1.31 0.00 0.00 55.95 57.74 1m3d s SER 142 Cb -0.10 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1m3d s SER 142 CO -0.01 -2.56 0.33 0.12 0.41 0.00 0.00 173.24 171.54 1m3d s PHE 143 N 10.13 3.22 -0.22 2.43 5.36 0.73 -1.62 117.98 138.01 1m3d s PHE 143 Ca 0.77 0.15 -0.16 0.00 -0.96 0.00 0.00 56.93 56.73 1m3d s PHE 143 Cb -0.14 -2.58 -0.08 0.00 -0.34 0.00 0.00 43.02 39.88 1m3d s PHE 143 CO 0.22 -0.31 -0.35 0.28 -1.46 0.00 0.00 175.22 173.60 1m3d n VAL 144 N 5.16 1.51 -3.62 3.12 0.31 0.02 -4.39 118.33 120.44 1m3d n VAL 144 Ca -0.10 -0.06 -0.07 0.00 -0.01 0.00 0.00 64.34 64.10 1m3d n VAL 144 Cb 0.50 -2.16 0.01 0.00 -0.91 0.00 0.00 33.84 31.27 1m3d n VAL 144 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1m3d n MET 145 N -4.37 0.61 -3.52 5.55 0.00 -1.11 -0.65 117.12 113.63 1m3d n MET 145 Ca -0.30 -1.50 -0.10 0.00 0.00 0.00 0.00 57.70 55.81 1m3d n MET 145 Cb 0.66 1.70 -0.02 0.00 0.00 0.00 0.00 33.22 35.56 1m3d n MET 145 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 175.97 172.59 1m3d s HIS 146 N -4.44 -0.41 0.03 3.17 -3.43 -0.76 -0.11 115.29 109.35 1m3d s HIS 146 Ca 0.13 0.19 -0.10 0.00 -0.80 0.00 0.00 55.06 54.47 1m3d s HIS 146 Cb -0.02 0.58 0.01 0.00 -1.43 0.00 0.00 32.58 31.71 1m3d s HIS 146 CO 0.09 -0.80 0.22 0.95 -2.00 0.00 0.00 174.74 173.19 1m3d s THR 147 N -3.55 0.10 0.00 -5.38 -4.23 -0.75 -2.83 115.64 99.00 1m3d s THR 147 Ca 0.04 -0.80 0.00 0.00 -1.18 0.00 0.00 61.69 59.76 1m3d s THR 147 Cb -0.02 -0.83 0.00 0.00 1.34 0.00 0.00 72.50 73.00 1m3d s THR 147 CO -0.08 -0.44 0.00 -0.24 -0.54 0.00 0.00 174.62 173.32 1m3d n SER 148 N 0.82 0.00 -4.65 3.99 2.88 -0.56 -0.98 113.62 115.12 1m3d n SER 148 Ca -0.20 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.89 1m3d n SER 148 Cb 0.58 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.01 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 0.74 -1.16 -1.46 0.00 -1.26 -0.82 120.51 113.55 1m3d n ALA 149 Ca 0.00 0.43 -0.06 0.00 0.00 0.00 0.00 53.44 53.81 1m3d n ALA 149 Cb 0.00 -2.23 -0.02 0.00 0.00 0.00 0.00 19.45 17.19 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 2.32 0.59 2.55 0.00 0.00 -1.26 -1.74 105.19 107.65 1m3d n GLY 150 Ca 0.13 -0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 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 1.10 -0.21 -2.18 4.61 0.00 0.00 -4.98 120.51 118.86 1m3d n ALA 151 Ca -0.06 0.22 -0.30 0.00 0.00 0.00 0.00 53.44 53.31 1m3d n ALA 151 Cb 0.49 -1.65 -0.03 0.00 0.00 0.00 0.00 19.45 18.26 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 -3.09 3.75 0.00 0.00 0.41 -0.71 -4.67 118.70 114.39 1m3d s GLU 152 Ca 0.00 0.46 0.00 0.00 -0.41 0.00 0.00 54.97 55.02 1m3d s GLU 152 Cb 0.00 -2.38 0.00 0.00 -1.78 0.00 0.00 34.13 29.97 1m3d s GLU 152 CO 0.00 -0.07 0.00 0.41 -0.49 0.00 0.00 175.26 175.11 1m3d n GLY 153 N -1.44 0.92 1.71 -1.39 0.00 -1.26 -1.50 105.19 102.22 1m3d n GLY 153 Ca 0.02 -0.63 -0.04 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.01 -1.04 -1.87 1.61 3.41 -1.13 -4.67 113.62 109.92 1m3d n SER 154 Ca 0.00 -1.72 -0.06 0.00 -0.26 0.00 0.00 58.87 56.83 1m3d n SER 154 Cb 0.00 1.74 -0.01 0.00 -0.26 0.00 0.00 64.21 65.68 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 -0.24 2.42 3.66 5.00 0.00 -1.26 -1.82 105.19 112.94 1m3d n GLY 155 Ca -0.04 -1.40 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.28 2.39 -0.17 1.61 -1.52 0.18 -4.79 119.66 115.08 1m3d s GLN 156 Ca 0.12 -1.09 -0.28 0.00 -1.95 0.00 0.00 55.36 52.16 1m3d s GLN 156 Cb -0.01 -2.36 -0.01 0.00 -0.22 0.00 0.00 33.01 30.41 1m3d s GLN 156 CO 0.08 0.46 0.96 0.00 -0.25 0.00 0.00 175.29 176.55 1m3d s ALA 157 N -1.68 3.54 -0.07 6.09 0.00 -1.26 -4.91 121.76 123.47 1m3d s ALA 157 Ca 0.27 0.19 0.28 0.00 0.00 0.00 0.00 51.96 52.70 1m3d s ALA 157 Cb -0.09 -3.41 1.39 0.00 0.00 0.00 0.00 23.12 21.01 1m3d s ALA 157 CO 0.18 -0.78 1.85 -0.07 0.00 0.00 0.00 175.76 176.94 1m3d h LEU 158 N 8.62 0.00 -0.02 0.00 3.38 -1.95 -0.60 115.31 124.74 1m3d h LEU 158 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1m3d h LEU 158 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1m3d h LEU 158 CO 0.89 0.00 -0.35 0.00 0.09 0.00 0.00 178.44 179.07 1m3d n ALA 159 N -1.87 3.19 -2.82 1.53 0.00 -1.26 -4.63 120.51 114.65 1m3d n ALA 159 Ca -0.01 -0.28 -0.30 0.00 0.00 0.00 0.00 53.44 52.85 1m3d n ALA 159 Cb 0.12 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.31 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 -2.97 6.40 0.66 0.00 0.15 -0.23 -1.73 113.70 115.99 1m3d s SER 160 Ca 0.13 0.38 0.40 0.00 0.70 0.00 0.00 55.95 57.56 1m3d s SER 160 Cb 0.18 -2.01 2.18 0.00 -1.71 0.00 0.00 66.02 64.67 1m3d s SER 160 CO 0.64 0.10 2.25 -0.65 1.20 0.00 0.00 173.24 176.78 1m3d h PRO 161 N 2.79 0.00 0.00 5.44 0.11 -1.85 -1.51 132.00 136.99 1m3d h PRO 161 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1m3d h PRO 161 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1m3d h PRO 161 CO 0.73 0.00 -0.06 0.78 -0.21 0.00 0.00 178.00 179.24 1m3d h GLY 162 N 0.00 0.00 -0.01 -0.55 0.00 -1.84 -0.17 103.07 100.50 1m3d h GLY 162 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 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 -3.72 0.78 -3.85 0.19 3.41 -0.57 -4.52 113.62 105.35 1m3d n SER 163 Ca -0.02 -1.49 -0.29 0.00 -0.26 0.00 0.00 58.87 56.80 1m3d n SER 163 Cb 0.16 -0.04 -0.13 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.34 4.39 0.35 0.00 1.43 -0.93 -4.73 118.68 118.85 1m3d s LEU 165 Ca 0.20 1.45 0.11 0.00 -1.03 0.00 0.00 54.13 54.86 1m3d s LEU 165 Cb -0.20 -3.31 0.65 0.00 0.03 0.00 0.00 46.19 43.36 1m3d s LEU 165 CO -0.04 -0.12 1.80 -0.33 0.23 0.00 0.00 176.35 177.89 1m3d h GLU 166 N 6.36 0.09 -5.02 1.70 5.08 -1.87 0.17 114.58 121.09 1m3d h GLU 166 Ca -0.42 -0.04 -0.66 0.00 -1.00 0.00 0.00 59.36 57.24 1m3d h GLU 166 Cb 1.21 -0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.15 1m3d h GLU 166 CO 0.74 0.44 -0.78 -1.21 -1.00 0.00 0.00 179.01 177.20 1m3d s GLU 167 N -4.23 3.23 0.17 2.33 0.41 -1.26 -4.71 118.70 114.63 1m3d s GLU 167 Ca -0.03 -0.71 -0.30 0.00 -0.41 0.00 0.00 54.97 53.52 1m3d s GLU 167 Cb 0.14 -2.84 -0.08 0.00 -1.78 0.00 0.00 34.13 29.58 1m3d s GLU 167 CO 0.74 -0.20 1.18 0.12 -0.49 0.00 0.00 175.26 176.61 1m3d s PHE 168 N 1.40 3.45 -0.03 1.61 2.19 -1.26 -4.96 117.98 120.38 1m3d s PHE 168 Ca 0.05 1.43 0.00 0.00 0.33 0.00 0.00 56.93 58.75 1m3d s PHE 168 Cb -0.14 -3.41 0.03 0.00 -1.31 0.00 0.00 43.02 38.19 1m3d s PHE 168 CO -0.07 -1.13 0.01 1.03 1.83 0.00 0.00 175.22 176.89 1m3d s ARG 169 N -0.07 0.17 0.38 10.12 1.81 -1.26 -5.00 118.95 125.10 1m3d s ARG 169 Ca 0.53 0.12 0.15 0.00 -1.72 0.00 0.00 55.73 54.81 1m3d s ARG 169 Cb -0.32 -0.39 0.78 0.00 -0.45 0.00 0.00 34.95 34.57 1m3d s ARG 169 CO 0.35 -0.15 1.83 1.03 -0.68 0.00 0.00 175.30 177.68 1m3d h SER 170 N 7.28 0.00 -2.90 0.23 0.87 -2.00 -3.30 113.55 113.74 1m3d h SER 170 Ca -0.44 0.00 -0.61 0.00 -1.23 0.00 0.00 61.79 59.52 1m3d h SER 170 Cb 1.13 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 62.69 1m3d h SER 170 CO 0.47 0.36 -0.75 0.00 -0.53 0.00 0.00 176.83 176.38 1m3d s ALA 171 N -4.09 2.64 -0.98 6.23 0.00 -1.26 -4.45 121.76 119.85 1m3d s ALA 171 Ca -0.02 -3.11 0.25 0.00 0.00 0.00 0.00 51.96 49.07 1m3d s ALA 171 Cb 0.14 -1.91 1.04 0.00 0.00 0.00 0.00 23.12 22.39 1m3d s ALA 171 CO 0.71 -2.04 1.79 -0.35 0.00 0.00 0.00 175.76 175.86 1m3d n PRO 172 N 2.57 0.02 -4.16 0.00 -0.04 -1.24 -4.86 135.00 127.28 1m3d n PRO 172 Ca 0.22 0.09 -0.10 0.00 -0.04 0.00 0.00 63.50 63.66 1m3d n PRO 172 Cb 0.40 -1.52 -0.10 0.00 -0.04 0.00 0.00 33.50 32.23 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 -3.01 0.87 0.08 0.54 -0.71 -1.26 -0.72 117.98 113.77 1m3d s PHE 173 Ca 0.12 -1.13 0.09 0.00 -1.04 0.00 0.00 56.93 54.97 1m3d s PHE 173 Cb 0.16 -0.51 -0.03 0.00 -1.21 0.00 0.00 43.02 41.42 1m3d s PHE 173 CO 0.46 -0.40 -0.25 -1.50 -1.34 0.00 0.00 175.22 172.19 1m3d s ILE 174 N -3.91 2.02 -0.21 -4.49 -1.16 0.06 -4.79 121.20 108.72 1m3d s ILE 174 Ca 0.20 -1.50 -0.11 0.00 -0.51 0.00 0.00 60.65 58.73 1m3d s ILE 174 Cb 0.07 -1.77 -0.05 0.00 0.61 0.00 0.00 42.46 41.32 1m3d s ILE 174 CO -0.01 0.18 0.15 -0.70 -2.81 0.00 0.00 174.94 171.75 1m3d s GLU 175 N -1.61 4.16 0.16 3.50 2.12 -0.94 -2.19 118.70 123.89 1m3d s GLU 175 Ca 0.11 -0.20 0.10 0.00 0.36 0.00 0.00 54.97 55.33 1m3d s GLU 175 Cb -0.10 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.79 1m3d s GLU 175 CO 0.04 0.22 -0.23 0.00 -0.54 0.00 0.00 175.26 174.75 1m3d s HIS 177 N -1.52 2.26 0.58 0.00 0.09 0.17 -1.81 115.29 115.06 1m3d s HIS 177 Ca 0.15 -0.36 0.28 0.00 -0.00 0.00 0.00 55.06 55.14 1m3d s HIS 177 Cb -0.08 -1.06 1.69 0.00 -0.00 0.00 0.00 32.58 33.13 1m3d s HIS 177 CO 0.07 0.58 2.15 0.78 -0.00 0.00 0.00 174.74 178.33 1m3d h GLY 178 N 2.79 0.00 2.00 -2.22 0.00 -1.66 -0.36 103.07 103.62 1m3d h GLY 178 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1m3d h GLY 178 CO 0.54 0.00 0.00 3.21 0.00 0.00 0.00 176.54 180.29 1m3d h ARG 179 N 0.00 0.00 0.00 4.80 3.08 -1.88 -3.45 114.38 116.93 1m3d h ARG 179 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1m3d h ARG 179 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1m3d h ARG 179 CO -0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1m3d n GLY 180 N -0.40 1.11 3.55 0.04 0.00 -0.14 -5.07 105.19 104.28 1m3d n GLY 180 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 3.24 0.02 2.61 -4.23 -1.23 -3.83 115.64 110.22 1m3d s THR 181 Ca 0.00 -1.24 -0.03 0.00 -1.18 0.00 0.00 61.69 59.25 1m3d s THR 181 Cb 0.00 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.34 1m3d s THR 181 CO 0.00 0.17 0.03 0.00 -0.54 0.00 0.00 174.62 174.28 1m3d s ASN 183 N -1.62 -0.13 -0.21 0.00 3.84 0.37 -0.43 114.94 116.76 1m3d s ASN 183 Ca -0.13 -0.19 -0.10 0.00 0.21 0.00 0.00 52.86 52.65 1m3d s ASN 183 Cb -0.07 0.28 -0.05 0.00 -0.55 0.00 0.00 41.25 40.85 1m3d s ASN 183 CO -0.01 -0.50 0.15 -0.31 -2.79 0.00 0.00 177.10 173.64 1m3d s TYR 184 N -2.74 3.39 0.16 0.43 1.51 -1.26 -2.22 117.35 116.62 1m3d s TYR 184 Ca 0.12 0.32 0.09 0.00 -1.01 0.00 0.00 57.07 56.59 1m3d s TYR 184 Cb 0.02 -2.21 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 1m3d s TYR 184 CO -0.03 0.22 -0.11 0.71 -1.11 0.00 0.00 175.55 175.23 1m3d s TYR 185 N 0.58 2.63 0.66 2.71 1.51 -1.26 -5.02 117.35 119.16 1m3d s TYR 185 Ca 0.09 -0.22 0.41 0.00 -1.01 0.00 0.00 57.07 56.34 1m3d s TYR 185 Cb -0.12 -1.31 2.25 0.00 -0.11 0.00 0.00 41.96 42.67 1m3d s TYR 185 CO 0.00 0.48 2.29 0.00 -1.11 0.00 0.00 175.55 177.22 1m3d h ALA 186 N 3.12 1.12 -0.49 3.71 0.00 -2.03 -1.89 119.26 122.80 1m3d h ALA 186 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1m3d h ALA 186 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1m3d h ALA 186 CO 0.53 -0.06 0.00 0.27 0.00 0.00 0.00 179.25 179.99 1m3d n ASN 187 N -3.14 3.03 -4.60 0.00 6.94 -1.26 -4.86 115.26 111.38 1m3d n ASN 187 Ca -0.03 -1.96 -0.43 0.00 -0.02 0.00 0.00 54.58 52.14 1m3d n ASN 187 Cb 0.13 -0.33 -0.02 0.00 -2.36 0.00 0.00 39.78 37.20 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 -1.35 3.02 -0.11 -2.53 0.00 -0.71 -4.32 121.76 115.76 1m3d s ALA 188 Ca 0.38 -0.29 -0.00 0.00 0.00 0.00 0.00 51.96 52.05 1m3d s ALA 188 Cb 0.21 -3.96 -0.02 0.00 0.00 0.00 0.00 23.12 19.34 1m3d s ALA 188 CO 0.28 -2.47 -0.10 0.71 0.00 0.00 0.00 175.76 174.18 1m3d s TYR 189 N 5.40 2.87 -0.13 0.00 4.12 -0.15 -4.99 117.35 124.48 1m3d s TYR 189 Ca 0.58 -0.37 -0.02 0.00 0.02 0.00 0.00 57.07 57.28 1m3d s TYR 189 Cb -0.12 -1.82 -0.03 0.00 -1.52 0.00 0.00 41.96 38.47 1m3d s TYR 189 CO 0.31 -0.01 -0.06 -1.54 0.02 0.00 0.00 175.55 174.28 1m3d s SER 190 N -0.00 4.67 -0.14 2.29 1.04 -1.26 -1.80 113.70 118.49 1m3d s SER 190 Ca -0.02 -0.12 -0.02 0.00 0.48 0.00 0.00 55.95 56.27 1m3d s SER 190 Cb -0.14 -1.59 -0.02 0.00 0.10 0.00 0.00 66.02 64.37 1m3d s SER 190 CO 0.04 0.23 -0.08 -0.36 0.98 0.00 0.00 173.24 174.04 1m3d s PHE 191 N 0.01 2.93 0.13 5.02 0.08 0.85 -4.98 117.98 122.02 1m3d s PHE 191 Ca -0.00 -0.45 0.07 0.00 0.12 0.00 0.00 56.93 56.67 1m3d s PHE 191 Cb -0.13 -1.91 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 1m3d s PHE 191 CO 0.03 -0.11 -0.16 -1.58 -0.10 0.00 0.00 175.22 173.30 1m3d s TRP 192 N 0.35 1.53 0.26 0.36 0.52 -1.26 -0.80 118.94 119.91 1m3d s TRP 192 Ca -0.07 -0.51 -0.30 0.00 0.02 0.00 0.00 56.10 55.24 1m3d s TRP 192 Cb -0.15 -0.80 -0.10 0.00 -1.15 0.00 0.00 33.47 31.28 1m3d s TRP 192 CO 0.04 0.19 1.32 -0.51 0.02 0.00 0.00 176.95 178.01 1m3d s LEU 193 N -2.40 4.42 0.68 2.99 1.43 -0.64 -4.88 118.68 120.29 1m3d s LEU 193 Ca 0.10 2.53 -0.07 0.00 -1.03 0.00 0.00 54.13 55.66 1m3d s LEU 193 Cb -0.06 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.58 1m3d s LEU 193 CO 0.04 -0.53 0.99 0.00 0.23 0.00 0.00 176.35 177.08 1m3d s ALA 194 N -0.41 3.18 -0.20 4.21 0.00 -1.26 -1.30 121.76 125.98 1m3d s ALA 194 Ca 0.54 -0.87 -0.15 0.00 0.00 0.00 0.00 51.96 51.48 1m3d s ALA 194 Cb -0.38 -2.61 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 1m3d s ALA 194 CO 0.44 -1.20 0.35 0.95 0.00 0.00 0.00 175.76 176.30 1m3d s THR 195 N -3.20 5.23 -0.12 0.00 -4.23 -1.25 -4.35 115.64 107.72 1m3d s THR 195 Ca 0.59 0.61 0.03 0.00 -1.18 0.00 0.00 61.69 61.74 1m3d s THR 195 Cb -0.11 -3.69 0.01 0.00 1.34 0.00 0.00 72.50 70.06 1m3d s THR 195 CO 0.45 0.28 -0.21 -0.63 -0.54 0.00 0.00 174.62 173.97 1m3d s ILE 196 N 1.20 1.94 0.18 2.99 1.01 0.50 -4.94 121.20 124.07 1m3d s ILE 196 Ca 0.17 -0.92 -0.30 0.00 0.00 0.00 0.00 60.65 59.60 1m3d s ILE 196 Cb -0.14 -1.71 -0.08 0.00 0.01 0.00 0.00 42.46 40.54 1m3d s ILE 196 CO 0.07 0.53 1.03 -1.61 0.00 0.00 0.00 174.94 174.96 1m3d s GLU 197 N 0.72 4.67 0.32 2.79 2.02 -1.26 -4.79 118.70 123.17 1m3d s GLU 197 Ca -0.10 1.61 0.08 0.00 0.02 0.00 0.00 54.97 56.58 1m3d s GLU 197 Cb -0.16 -3.30 0.81 0.00 0.10 0.00 0.00 34.13 31.58 1m3d s GLU 197 CO 0.01 0.20 1.78 -0.09 0.02 0.00 0.00 175.26 177.19 1m3d h ARG 198 N 4.94 0.67 0.00 1.61 2.43 -1.99 0.14 114.38 122.19 1m3d h ARG 198 Ca -0.44 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1m3d h ARG 198 Cb 1.21 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1m3d h ARG 198 CO 0.71 0.45 0.00 -1.13 -1.51 0.00 0.00 179.97 178.48 1m3d n SER 199 N -4.73 0.00 -0.25 -3.80 3.41 -1.26 -3.06 113.62 103.93 1m3d n SER 199 Ca 0.23 -0.27 0.02 0.00 -0.26 0.00 0.00 58.87 58.59 1m3d n SER 199 Cb 0.62 -0.20 0.06 0.00 -0.26 0.00 0.00 64.21 64.42 1m3d n SER 199 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1m3d n GLU 200 N -1.20 2.82 -0.31 4.33 1.02 0.47 -4.67 120.64 123.10 1m3d n GLU 200 Ca 0.14 -1.68 -0.04 0.00 -0.02 0.00 0.00 57.16 55.55 1m3d n GLU 200 Cb 0.16 -1.10 0.08 0.00 -0.02 0.00 0.00 31.44 30.55 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 0.79 1.15 -1.30 3.49 2.86 -1.44 -3.06 114.93 117.42 1m3d h MET 201 Ca 0.00 -0.12 -0.64 0.00 -2.06 0.00 0.00 59.70 56.88 1m3d h MET 201 Cb 0.57 -0.23 -0.36 0.00 0.06 0.00 0.00 31.60 31.64 1m3d h MET 201 CO 0.00 0.83 -0.04 1.19 1.06 0.00 0.00 176.91 179.95 1m3d n PHE 202 N -4.41 3.10 -4.13 -0.22 3.01 -1.26 -4.96 117.46 108.59 1m3d n PHE 202 Ca 0.08 -2.68 -0.13 0.00 1.01 0.00 0.00 57.45 55.73 1m3d n PHE 202 Cb 0.08 -0.67 -0.11 0.00 -0.01 0.00 0.00 39.48 38.77 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 0.71 0.12 -1.08 1.02 -1.16 -5.10 119.74 110.52 1m3d s LYS 203 Ca 0.53 -1.02 -0.35 0.00 0.02 0.00 0.00 55.97 55.15 1m3d s LYS 203 Cb 0.43 -0.38 -0.15 0.00 -0.52 0.00 0.00 37.83 37.22 1m3d s LYS 203 CO -0.14 0.05 1.52 1.17 -0.92 0.00 0.00 175.35 177.03 1m3d n LYS 204 N 0.83 1.81 -1.91 1.68 4.81 -1.26 -4.87 118.16 119.24 1m3d n LYS 204 Ca -0.18 0.65 -0.41 0.00 -0.87 0.00 0.00 58.31 57.50 1m3d n LYS 204 Cb 0.57 -2.38 -0.01 0.00 0.02 0.00 0.00 35.03 33.23 1m3d n LYS 204 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1m3d s PRO 205 N 0.98 4.20 -0.41 1.64 0.02 -1.26 -4.95 135.00 135.22 1m3d s PRO 205 Ca 0.82 2.44 -0.25 0.00 0.02 0.00 0.00 61.00 64.03 1m3d s PRO 205 Cb -0.78 -3.01 0.02 0.00 0.02 0.00 0.00 34.50 30.75 1m3d s PRO 205 CO 0.42 -0.42 0.87 0.99 -0.33 0.00 0.00 177.00 178.52 1m3d s THR 206 N -0.96 4.59 0.48 0.99 2.01 -1.26 -5.02 115.64 116.48 1m3d s THR 206 Ca 0.53 0.84 -0.24 0.00 0.31 0.00 0.00 61.69 63.13 1m3d s THR 206 Cb -0.44 -4.33 -0.07 0.00 0.01 0.00 0.00 72.50 67.66 1m3d s THR 206 CO 0.57 -0.64 1.37 -2.65 -0.69 0.00 0.00 174.62 172.58 1m3d n PRO 207 N 6.81 1.98 -3.73 4.92 -0.02 -1.26 -5.02 135.00 138.68 1m3d n PRO 207 Ca 0.05 0.71 -0.13 0.00 -2.02 0.00 0.00 63.50 62.11 1m3d n PRO 207 Cb 0.48 -2.56 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 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 -0.64 -0.43 -0.20 2.55 0.15 -1.26 -5.14 113.70 108.73 1m3d s SER 208 Ca 0.65 0.83 0.01 0.00 0.70 0.00 0.00 55.95 58.14 1m3d s SER 208 Cb -0.45 0.84 0.03 0.00 -1.71 0.00 0.00 66.02 64.73 1m3d s SER 208 CO 0.55 -0.15 -0.17 -0.89 1.20 0.00 0.00 173.24 173.78 1m3d s THR 209 N 0.28 2.16 0.05 6.45 2.01 -1.26 -5.12 115.64 120.20 1m3d s THR 209 Ca -0.00 -1.06 0.04 0.00 0.31 0.00 0.00 61.69 60.98 1m3d s THR 209 Cb -0.03 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1m3d s THR 209 CO -0.00 0.42 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.55 1m3d s LEU 210 N 1.26 3.34 0.35 4.42 1.43 -1.26 -5.14 118.68 123.08 1m3d s LEU 210 Ca 0.02 -0.16 0.09 0.00 -1.03 0.00 0.00 54.13 53.05 1m3d s LEU 210 Cb -0.14 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 1m3d s LEU 210 CO -0.11 0.23 0.05 -0.54 0.23 0.00 0.00 176.35 176.21 1m3d s LYS 211 N -1.89 2.14 0.19 1.70 1.02 -1.26 -4.95 119.74 116.69 1m3d s LYS 211 Ca 0.21 -1.73 -0.30 0.00 0.02 0.00 0.00 55.97 54.18 1m3d s LYS 211 Cb -0.11 -1.97 -0.17 0.00 -0.52 0.00 0.00 37.83 35.06 1m3d s LYS 211 CO 0.13 0.10 0.70 0.00 -0.92 0.00 0.00 175.35 175.36 1m3d n ALA 212 N -1.02 -2.42 0.00 5.17 0.00 -1.26 -1.23 120.51 119.76 1m3d n ALA 212 Ca -0.04 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1m3d n ALA 212 Cb 0.62 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.36 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 1.82 1.69 0.00 0.00 0.00 -1.26 -4.76 105.19 102.69 1m3d n GLY 213 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1m3d n GLY 213 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1m3d n GLU 214 N -2.00 1.03 0.00 1.61 2.13 -0.36 -4.88 120.64 118.16 1m3d n GLU 214 Ca 0.00 -0.90 0.00 0.00 0.66 0.00 0.00 57.16 56.92 1m3d n GLU 214 Cb 0.00 -0.88 0.00 0.00 0.27 0.00 0.00 31.44 30.83 1m3d n GLU 214 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1m3d n LEU 215 N -0.22 0.64 -0.40 4.31 4.77 -1.23 -4.15 117.00 120.71 1m3d n LEU 215 Ca 0.00 0.45 0.33 0.00 -0.03 0.00 0.00 56.01 56.76 1m3d n LEU 215 Cb 0.21 -0.37 0.60 0.00 -2.33 0.00 0.00 43.42 41.53 1m3d n LEU 215 CO 0.00 -0.37 1.20 0.03 -1.33 0.00 0.00 177.39 176.92 1m3d h ARG 216 N 0.00 0.15 0.00 3.23 3.08 -1.94 0.51 114.38 119.40 1m3d h ARG 216 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1m3d h ARG 216 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1m3d h ARG 216 CO 0.00 0.10 0.00 -2.37 -1.07 0.00 0.00 179.97 176.63 1m3d n THR 217 N -4.79 0.00 -0.95 2.04 5.66 -1.26 -2.63 114.28 112.36 1m3d n THR 217 Ca 0.35 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 61.41 1m3d n THR 217 Cb 1.28 -0.61 0.08 0.00 -1.55 0.00 0.00 70.33 69.54 1m3d n THR 217 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1m3d n HIS 218 N -0.93 0.00 -4.86 1.09 8.25 0.18 -4.89 115.22 114.06 1m3d n HIS 218 Ca 0.13 -0.69 -0.32 0.00 -0.26 0.00 0.00 57.72 56.58 1m3d n HIS 218 Cb 0.06 -0.10 -0.13 0.00 1.12 0.00 0.00 29.99 30.94 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 -1.89 3.02 0.46 1.59 1.01 -1.08 -3.85 120.40 119.67 1m3d s VAL 219 Ca 0.18 -0.79 -0.25 0.00 0.00 0.00 0.00 61.98 61.12 1m3d s VAL 219 Cb 0.16 -2.19 -0.08 0.00 0.00 0.00 0.00 36.38 34.27 1m3d s VAL 219 CO 0.02 0.55 1.42 -0.24 0.00 0.00 0.00 175.10 176.86 1m3d n SER 220 N 2.19 3.25 -4.98 3.32 2.88 -0.42 -4.61 113.62 115.25 1m3d n SER 220 Ca -0.17 1.10 -0.20 0.00 -1.33 0.00 0.00 58.87 58.27 1m3d n SER 220 Cb 0.52 -1.60 -0.01 0.00 -0.75 0.00 0.00 64.21 62.37 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 -2.49 3.29 0.17 -1.46 1.81 -0.91 -1.22 118.95 118.14 1m3d s ARG 221 Ca 0.62 -0.87 -0.10 0.00 -1.72 0.00 0.00 55.73 53.67 1m3d s ARG 221 Cb -0.45 -2.85 -0.01 0.00 -0.45 0.00 0.00 34.95 31.20 1m3d s ARG 221 CO 0.57 0.25 0.31 0.00 -0.68 0.00 0.00 175.30 175.75 1m3d s GLN 223 N -3.97 0.07 -0.23 0.00 0.74 -0.65 -1.31 119.66 114.31 1m3d s GLN 223 Ca 0.18 0.13 -0.11 0.00 0.05 0.00 0.00 55.36 55.61 1m3d s GLN 223 Cb 0.03 -0.02 -0.05 0.00 1.10 0.00 0.00 33.01 34.07 1m3d s GLN 223 CO 0.01 -0.04 0.19 0.08 -0.55 0.00 0.00 175.29 174.98 1m3d s VAL 224 N 0.27 5.34 0.17 1.34 1.01 0.67 -1.55 120.40 127.65 1m3d s VAL 224 Ca -0.02 0.25 0.09 0.00 0.00 0.00 0.00 61.98 62.30 1m3d s VAL 224 Cb -0.03 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1m3d s VAL 224 CO -0.01 0.34 -0.18 0.00 0.00 0.00 0.00 175.10 175.25 1m3d s MET 226 N -2.85 1.29 0.00 0.00 -2.45 0.18 -0.79 119.30 114.67 1m3d s MET 226 Ca 0.16 -0.46 0.05 0.00 -1.25 0.00 0.00 55.69 54.18 1m3d s MET 226 Cb -0.05 -1.18 0.27 0.00 1.25 0.00 0.00 34.83 35.12 1m3d s MET 226 CO 0.07 0.21 0.74 -2.13 1.05 0.00 0.00 175.02 174.96