#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y1m s LEU 6 N 0.00 4.42 -0.42 6.15 1.43 -0.33 -4.77 118.68 125.17 1y1m s LEU 6 Ca 0.00 2.62 -0.22 0.00 -1.03 0.00 0.00 54.13 55.50 1y1m s LEU 6 Cb 0.00 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.60 1y1m s LEU 6 CO 0.00 -0.55 0.71 -0.54 0.23 0.00 0.00 176.35 176.20 1y1m s LYS 7 N -1.25 3.46 -0.20 1.70 1.02 -1.26 -1.39 119.74 121.82 1y1m s LYS 7 Ca 0.52 -0.11 -0.10 0.00 0.02 0.00 0.00 55.97 56.30 1y1m s LYS 7 Cb -0.39 -3.90 -0.05 0.00 -0.52 0.00 0.00 37.83 32.97 1y1m s LYS 7 CO 0.48 -0.97 0.13 0.42 -0.92 0.00 0.00 175.35 174.50 1y1m s ILE 8 N 2.99 5.38 -0.07 2.17 -1.09 -0.17 0.64 121.20 131.05 1y1m s ILE 8 Ca 0.26 0.18 0.02 0.00 -2.23 0.00 0.00 60.65 58.88 1y1m s ILE 8 Cb -0.13 -3.46 -0.03 0.00 -1.58 0.00 0.00 42.46 37.26 1y1m s ILE 8 CO 0.19 0.43 -0.11 0.54 -1.23 0.00 0.00 174.94 174.76 1y1m s VAL 9 N 0.46 3.33 0.07 2.92 0.11 -0.63 -1.20 120.40 125.46 1y1m s VAL 9 Ca 0.08 -0.61 0.01 0.00 -2.93 0.00 0.00 61.98 58.52 1y1m s VAL 9 Cb -0.11 -2.34 -0.00 0.00 -1.53 0.00 0.00 36.38 32.39 1y1m s VAL 9 CO -0.01 0.59 0.07 1.07 -3.33 0.00 0.00 175.10 173.49 1y1m n THR 10 N 2.41 0.00 -3.71 5.04 5.66 -0.67 -1.82 114.28 121.19 1y1m n THR 10 Ca -0.18 -0.45 -0.12 0.00 -3.05 0.00 0.00 64.05 60.26 1y1m n THR 10 Cb 0.53 0.24 -0.07 0.00 -1.55 0.00 0.00 70.33 69.48 1y1m n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1y1m s ILE 11 N -2.35 0.08 -0.04 1.09 2.07 -1.26 -1.22 121.20 119.56 1y1m s ILE 11 Ca 0.07 -0.63 -0.30 0.00 -1.41 0.00 0.00 60.65 58.39 1y1m s ILE 11 Cb 0.00 -1.01 -0.05 0.00 0.13 0.00 0.00 42.46 41.53 1y1m s ILE 11 CO 0.05 -0.35 1.46 -2.28 -1.91 0.00 0.00 174.94 171.92 1y1m s HIS 12 N -2.83 2.58 -0.37 3.50 5.65 -1.26 -4.62 115.29 117.93 1y1m s HIS 12 Ca -0.03 0.65 -0.02 0.00 0.25 0.00 0.00 55.06 55.91 1y1m s HIS 12 Cb 0.00 -3.72 0.19 0.00 -1.18 0.00 0.00 32.58 27.87 1y1m s HIS 12 CO -0.05 -2.78 0.88 -1.14 -0.65 0.00 0.00 174.74 171.00 1y1m s GLN 13 N 3.10 0.48 0.56 2.88 2.00 -0.49 -4.99 119.66 123.19 1y1m s GLN 13 Ca 0.65 -0.22 -0.21 0.00 -2.00 0.00 0.00 55.36 53.58 1y1m s GLN 13 Cb -0.30 0.04 -0.04 0.00 0.80 0.00 0.00 33.01 33.50 1y1m s GLN 13 CO 0.25 -0.67 1.29 -1.21 -0.50 0.00 0.00 175.29 174.45 1y1m s GLU 14 N 1.74 3.12 -0.06 1.67 2.02 -1.23 -1.04 118.70 124.92 1y1m s GLU 14 Ca 0.17 2.06 0.13 0.00 0.02 0.00 0.00 54.97 57.35 1y1m s GLU 14 Cb 0.01 -2.16 0.47 0.00 0.10 0.00 0.00 34.13 32.56 1y1m s GLU 14 CO -0.11 -1.15 1.34 -0.35 0.02 0.00 0.00 175.26 175.01 1y1m n PRO 15 N -1.17 2.68 0.05 0.39 -0.04 -1.26 -4.85 135.00 130.79 1y1m n PRO 15 Ca 0.11 -1.88 -0.20 0.00 -0.04 0.00 0.00 63.50 61.50 1y1m n PRO 15 Cb 0.47 -1.62 -0.11 0.00 -0.04 0.00 0.00 33.50 32.20 1y1m n PRO 15 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1y1m h PHE 16 N 2.76 0.94 -2.59 0.54 -1.00 -1.42 -2.13 116.94 114.05 1y1m h PHE 16 Ca 0.00 -0.54 -0.34 0.00 2.81 0.00 0.00 57.97 59.90 1y1m h PHE 16 Cb 0.97 -0.10 -0.37 0.00 3.61 0.00 0.00 35.95 40.06 1y1m h PHE 16 CO 0.48 1.37 -0.65 0.08 -1.61 0.00 0.00 178.31 177.99 1y1m s VAL 17 N -3.18 -0.29 0.18 -0.55 1.01 -0.60 -1.09 120.40 115.88 1y1m s VAL 17 Ca -0.11 -0.14 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 1y1m s VAL 17 Cb 0.06 -0.68 -0.07 0.00 0.00 0.00 0.00 36.38 35.69 1y1m s VAL 17 CO 0.90 -0.23 0.49 -0.31 0.00 0.00 0.00 175.10 175.95 1y1m s TYR 18 N 2.30 3.48 -0.10 5.22 1.51 0.22 -1.40 117.35 128.57 1y1m s TYR 18 Ca 0.06 0.81 -0.01 0.00 -1.01 0.00 0.00 57.07 56.93 1y1m s TYR 18 Cb -0.16 -2.20 0.03 0.00 -0.11 0.00 0.00 41.96 39.52 1y1m s TYR 18 CO -0.12 0.36 -0.06 0.08 -1.11 0.00 0.00 175.55 174.70 1y1m s VAL 19 N -1.68 0.86 0.09 0.71 1.01 -1.26 -2.51 120.40 117.63 1y1m s VAL 19 Ca 0.43 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.24 1y1m s VAL 19 Cb -0.12 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1y1m s VAL 19 CO 0.21 0.34 -0.07 -0.54 0.00 0.00 0.00 175.10 175.04 1y1m s LYS 20 N 1.77 0.81 0.61 2.72 -0.14 0.09 -4.96 119.74 120.64 1y1m s LYS 20 Ca 0.05 -1.24 -0.16 0.00 -1.36 0.00 0.00 55.97 53.26 1y1m s LYS 20 Cb -0.12 -0.28 -0.02 0.00 -1.68 0.00 0.00 37.83 35.72 1y1m s LYS 20 CO -0.07 0.01 1.10 -2.14 -0.76 0.00 0.00 175.35 173.48 1y1m s PRO 21 N -3.38 3.08 0.67 -1.68 0.02 -1.26 0.59 135.00 133.04 1y1m s PRO 21 Ca 0.08 1.39 -0.11 0.00 0.02 0.00 0.00 61.00 62.38 1y1m s PRO 21 Cb 0.02 -1.99 -0.00 0.00 0.02 0.00 0.00 34.50 32.55 1y1m s PRO 21 CO -0.03 -1.03 1.06 0.95 -0.33 0.00 0.00 177.00 177.62 1y1m s THR 22 N -2.24 3.89 1.07 0.99 -4.23 -1.26 -4.62 115.64 109.23 1y1m s THR 22 Ca 0.67 0.56 -0.17 0.00 -1.18 0.00 0.00 61.69 61.57 1y1m s THR 22 Cb -0.20 -3.60 0.23 0.00 1.34 0.00 0.00 72.50 70.27 1y1m s THR 22 CO 0.37 -0.77 1.19 -0.04 -0.54 0.00 0.00 174.62 174.82 1y1m s MET 23 N -5.27 -0.16 0.54 3.99 -1.94 0.12 -4.82 119.30 111.76 1y1m s MET 23 Ca 0.57 -0.11 0.24 0.00 -1.71 0.00 0.00 55.69 54.68 1y1m s MET 23 Cb -0.11 -1.72 1.42 0.00 2.01 0.00 0.00 34.83 36.43 1y1m s MET 23 CO 0.52 -3.00 2.05 0.66 -0.01 0.00 0.00 175.02 175.24 1y1m h SER 24 N -2.07 0.00 -0.15 3.03 4.64 -1.97 0.11 113.55 117.15 1y1m h SER 24 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1y1m h SER 24 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1y1m h SER 24 CO 0.41 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.47 1y1m n ASP 25 N -4.28 1.49 0.00 4.97 5.75 -1.26 -4.92 116.55 118.29 1y1m n ASP 25 Ca 0.05 -1.68 0.00 0.00 -0.01 0.00 0.00 54.79 53.15 1y1m n ASP 25 Cb 0.44 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 1y1m n ASP 25 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1y1m n GLY 26 N 1.09 0.76 4.02 6.12 0.00 0.38 -5.06 105.19 112.51 1y1m n GLY 26 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 1y1m n GLY 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y1m s THR 27 N -2.81 2.52 -0.19 2.61 -4.23 -1.26 -4.73 115.64 107.57 1y1m s THR 27 Ca 0.00 -1.00 -0.09 0.00 -1.18 0.00 0.00 61.69 59.41 1y1m s THR 27 Cb 0.00 -2.53 -0.05 0.00 1.34 0.00 0.00 72.50 71.26 1y1m s THR 27 CO 0.00 0.00 0.12 0.00 -0.54 0.00 0.00 174.62 174.20 1y1m n LYS 29 N 3.33 1.58 -2.21 0.00 4.81 -1.26 -4.88 118.16 119.53 1y1m n LYS 29 Ca -0.17 0.57 -0.43 0.00 -0.87 0.00 0.00 58.31 57.41 1y1m n LYS 29 Cb 0.52 -2.24 -0.02 0.00 0.02 0.00 0.00 35.03 33.31 1y1m n LYS 29 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1y1m s GLU 30 N 0.44 3.90 0.20 1.64 2.12 -1.26 -4.99 118.70 120.74 1y1m s GLU 30 Ca 0.80 1.61 0.05 0.00 0.36 0.00 0.00 54.97 57.78 1y1m s GLU 30 Cb -0.82 -3.97 -0.05 0.00 0.26 0.00 0.00 34.13 29.56 1y1m s GLU 30 CO 0.45 -1.16 -0.08 -1.21 -0.54 0.00 0.00 175.26 172.72 1y1m s GLU 31 N 4.39 1.25 0.12 4.30 2.02 -1.26 -5.08 118.70 124.44 1y1m s GLU 31 Ca 0.66 -1.58 0.04 0.00 0.02 0.00 0.00 54.97 54.11 1y1m s GLU 31 Cb -0.23 -0.80 -0.04 0.00 0.10 0.00 0.00 34.13 33.16 1y1m s GLU 31 CO 0.26 0.05 -0.10 -0.06 0.02 0.00 0.00 175.26 175.43 1y1m s PHE 32 N -3.24 1.15 0.96 1.61 0.40 -1.26 -1.13 117.98 116.47 1y1m s PHE 32 Ca 0.23 -0.71 -0.14 0.00 -0.60 0.00 0.00 56.93 55.71 1y1m s PHE 32 Cb 0.03 -0.61 0.17 0.00 0.51 0.00 0.00 43.02 43.11 1y1m s PHE 32 CO 0.05 0.03 1.17 0.95 0.70 0.00 0.00 175.22 178.13 1y1m s THR 33 N -2.85 1.94 0.07 0.64 -4.23 0.15 -4.86 115.64 106.50 1y1m s THR 33 Ca 0.11 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.91 1y1m s THR 33 Cb -0.00 -2.77 0.30 0.00 1.34 0.00 0.00 72.50 71.36 1y1m s THR 33 CO 0.00 0.00 1.90 -0.37 -0.54 0.00 0.00 174.62 175.61 1y1m h VAL 34 N -1.65 0.00 -0.45 2.29 -1.51 -1.98 -0.92 116.25 112.02 1y1m h VAL 34 Ca -0.48 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.96 1y1m h VAL 34 Cb 1.31 0.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.18 1y1m h VAL 34 CO 0.54 0.00 0.00 -0.46 -1.23 0.00 0.00 177.57 176.42 1y1m n ASN 35 N -2.54 4.39 0.00 4.19 0.23 -1.26 -4.96 115.26 115.31 1y1m n ASN 35 Ca -0.02 -2.68 0.00 0.00 -0.53 0.00 0.00 54.58 51.35 1y1m n ASN 35 Cb 0.07 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.23 1y1m n ASN 35 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1y1m n GLY 36 N 0.36 0.77 3.75 4.83 0.00 -0.35 -5.04 105.19 109.50 1y1m n GLY 36 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1y1m n GLY 36 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y1m s ASP 37 N -2.56 7.52 0.34 1.61 2.15 -1.26 -4.72 116.67 119.76 1y1m s ASP 37 Ca 0.00 1.81 -0.29 0.00 0.43 0.00 0.00 52.55 54.50 1y1m s ASP 37 Cb 0.00 -2.57 -0.11 0.00 -0.30 0.00 0.00 42.92 39.94 1y1m s ASP 37 CO 0.00 0.08 1.39 -2.84 -0.17 0.00 0.00 175.17 173.62 1y1m s PRO 38 N -0.67 4.25 -0.28 4.34 0.02 -1.26 0.33 135.00 141.74 1y1m s PRO 38 Ca 0.42 2.37 -0.21 0.00 0.02 0.00 0.00 61.00 63.60 1y1m s PRO 38 Cb -0.24 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.24 1y1m s PRO 38 CO 0.30 -0.34 0.66 0.08 -0.33 0.00 0.00 177.00 177.37 1y1m s VAL 39 N -1.05 4.93 0.11 3.83 1.01 -0.29 -4.79 120.40 124.14 1y1m s VAL 39 Ca 0.51 1.05 -0.30 0.00 0.00 0.00 0.00 61.98 63.24 1y1m s VAL 39 Cb -0.43 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 1y1m s VAL 39 CO 0.56 -0.09 1.05 -0.54 0.00 0.00 0.00 175.10 176.08 1y1m s LYS 40 N 2.63 4.60 0.05 2.72 1.02 -1.26 -4.71 119.74 124.79 1y1m s LYS 40 Ca 0.27 1.59 0.03 0.00 0.02 0.00 0.00 55.97 57.88 1y1m s LYS 40 Cb -0.15 -3.35 -0.02 0.00 -0.52 0.00 0.00 37.83 33.79 1y1m s LYS 40 CO 0.10 0.05 -0.09 0.15 -0.92 0.00 0.00 175.35 174.64 1y1m s LYS 41 N 0.19 0.58 0.09 1.68 1.02 -1.26 -4.57 119.74 117.47 1y1m s LYS 41 Ca 0.50 -0.79 0.07 0.00 0.02 0.00 0.00 55.97 55.77 1y1m s LYS 41 Cb -0.26 -0.40 -0.03 0.00 -0.52 0.00 0.00 37.83 36.62 1y1m s LYS 41 CO 0.31 0.08 -0.17 0.14 -0.92 0.00 0.00 175.35 174.78 1y1m s VAL 42 N -1.35 1.40 0.02 3.17 -7.23 -0.41 -4.97 120.40 111.02 1y1m s VAL 42 Ca -0.08 -1.42 -0.29 0.00 -1.81 0.00 0.00 61.98 58.37 1y1m s VAL 42 Cb -0.10 -1.30 -0.04 0.00 0.56 0.00 0.00 36.38 35.50 1y1m s VAL 42 CO 0.01 -0.15 0.95 -0.63 -0.31 0.00 0.00 175.10 174.97 1y1m s ILE 43 N -1.22 4.81 -0.10 -0.62 -1.09 -1.26 -0.96 121.20 120.76 1y1m s ILE 43 Ca 0.02 2.01 -0.00 0.00 -2.23 0.00 0.00 60.65 60.45 1y1m s ILE 43 Cb -0.10 -4.30 0.02 0.00 -1.58 0.00 0.00 42.46 36.51 1y1m s ILE 43 CO 0.03 0.20 -0.07 0.00 -1.23 0.00 0.00 174.94 173.87 1y1m s THR 45 N 1.55 4.73 -4.18 0.00 -4.23 -0.74 -0.62 115.64 112.14 1y1m s THR 45 Ca 0.01 0.75 0.00 0.00 -1.18 0.00 0.00 61.69 61.28 1y1m s THR 45 Cb -0.13 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.93 1y1m s THR 45 CO -0.06 -0.73 0.00 0.61 -0.54 0.00 0.00 174.62 173.90 1y1m n GLY 46 N -1.79 -1.81 3.51 3.99 0.00 -1.11 0.11 105.19 108.11 1y1m n GLY 46 Ca 0.04 -1.20 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 1y1m n GLY 46 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y1m n PRO 47 N -0.29 0.17 -4.13 1.61 -0.02 -1.26 -1.48 135.00 129.59 1y1m n PRO 47 Ca 0.00 -0.16 -0.35 0.00 -2.02 0.00 0.00 63.50 60.97 1y1m n PRO 47 Cb 0.00 -1.75 -0.14 0.00 -0.02 0.00 0.00 33.50 31.60 1y1m n PRO 47 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1y1m s THR 58 N 5.16 3.50 0.04 3.45 -4.23 -1.26 -5.09 115.64 117.22 1y1m s THR 58 Ca 1.23 -0.47 -0.04 0.00 -1.18 0.00 0.00 61.69 61.24 1y1m s THR 58 Cb -0.75 -2.57 -0.02 0.00 1.34 0.00 0.00 72.50 70.50 1y1m s THR 58 CO 0.44 0.45 0.05 0.68 -0.54 0.00 0.00 174.62 175.70 1y1m s VAL 59 N 1.08 0.16 0.21 2.29 -7.23 -0.55 -5.13 120.40 111.23 1y1m s VAL 59 Ca 0.01 -1.31 -0.30 0.00 -1.81 0.00 0.00 61.98 58.57 1y1m s VAL 59 Cb -0.15 -1.05 -0.09 0.00 0.56 0.00 0.00 36.38 35.65 1y1m s VAL 59 CO -0.00 -0.72 1.42 -2.84 -0.31 0.00 0.00 175.10 172.65 1y1m s PRO 60 N -2.99 4.30 0.34 4.82 0.02 -1.26 -2.73 135.00 137.50 1y1m s PRO 60 Ca -0.02 2.22 0.03 0.00 0.02 0.00 0.00 61.00 63.25 1y1m s PRO 60 Cb 0.01 -3.16 -0.04 0.00 0.02 0.00 0.00 34.50 31.33 1y1m s PRO 60 CO -0.06 -0.41 0.11 -0.65 -0.33 0.00 0.00 177.00 175.66 1y1m s GLN 61 N 0.11 1.71 -0.20 5.54 -0.21 0.21 -4.44 119.66 122.38 1y1m s GLN 61 Ca 0.61 -1.99 -0.07 0.00 0.02 0.00 0.00 55.36 53.93 1y1m s GLN 61 Cb -0.40 -0.50 -0.04 0.00 1.00 0.00 0.00 33.01 33.07 1y1m s GLN 61 CO 0.38 -0.37 0.06 0.00 -2.12 0.00 0.00 175.29 173.24 1y1m s TYR 64 N -0.66 -0.29 -3.76 0.00 -0.85 -1.04 -1.29 117.35 109.45 1y1m s TYR 64 Ca 0.10 -0.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.63 1y1m s TYR 64 Cb -0.10 0.63 0.00 0.00 0.38 0.00 0.00 41.96 42.87 1y1m s TYR 64 CO -0.00 -0.97 0.00 0.41 -1.52 0.00 0.00 175.55 173.47 1y1m n GLY 65 N -0.41 0.88 0.22 5.49 0.00 -1.26 0.69 105.19 110.81 1y1m n GLY 65 Ca -0.09 -2.02 -0.04 0.00 0.00 0.00 0.00 46.02 43.87 1y1m n GLY 65 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1y1m h PHE 66 N 0.00 -0.37 -0.02 1.61 3.04 -1.01 -0.60 116.94 119.59 1y1m h PHE 66 Ca 0.00 0.05 -0.10 0.00 3.98 0.00 0.00 57.97 61.90 1y1m h PHE 66 Cb 0.00 0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.73 1y1m h PHE 66 CO 0.00 -0.25 -0.44 0.00 -2.02 0.00 0.00 178.31 175.61 1y1m h ILE 68 N 0.04 1.30 -0.89 0.00 1.08 -1.47 0.58 117.51 118.14 1y1m h ILE 68 Ca 0.00 -1.91 -0.02 0.00 -0.39 0.00 0.00 64.86 62.55 1y1m h ILE 68 Cb 0.79 2.01 -0.04 0.00 -3.07 0.00 0.00 36.82 36.51 1y1m h ILE 68 CO 0.06 0.60 0.49 0.44 -0.69 0.00 0.00 178.15 179.04 1y1m h ASP 69 N 0.44 1.11 -0.36 1.72 5.19 -1.00 0.17 116.42 123.69 1y1m h ASP 69 Ca -0.04 -0.10 -0.05 0.00 -0.62 0.00 0.00 57.03 56.22 1y1m h ASP 69 Cb 1.32 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.53 1y1m h ASP 69 CO 0.14 0.89 0.03 0.25 -3.12 0.00 0.00 179.24 177.43 1y1m h LEU 70 N 1.24 0.60 -0.59 1.55 5.85 -1.05 -1.98 115.31 120.93 1y1m h LEU 70 Ca 0.31 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1y1m h LEU 70 Cb 0.03 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 1y1m h LEU 70 CO -0.05 0.74 0.39 0.25 -0.34 0.00 0.00 178.44 179.43 1y1m h LEU 71 N 0.45 0.68 -0.80 2.25 5.85 -0.39 -0.55 115.31 122.80 1y1m h LEU 71 Ca 0.11 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1y1m h LEU 71 Cb 0.41 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1y1m h LEU 71 CO 0.01 0.50 0.51 0.40 -0.34 0.00 0.00 178.44 179.52 1y1m h ILE 72 N 0.80 1.21 -0.44 4.05 2.04 -0.85 -0.33 117.51 124.00 1y1m h ILE 72 Ca 0.22 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1y1m h ILE 72 Cb -0.09 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.04 1y1m h ILE 72 CO -0.05 0.21 0.12 0.50 0.00 0.00 0.00 178.15 178.93 1y1m h LYS 73 N 1.08 0.69 -0.44 2.37 1.63 -0.93 -2.14 116.57 118.83 1y1m h LYS 73 Ca 0.29 -0.16 -0.05 0.00 -0.85 0.00 0.00 60.65 59.88 1y1m h LYS 73 Cb -0.09 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.43 1y1m h LYS 73 CO -0.06 0.69 0.08 -0.07 -3.45 0.00 0.00 179.45 176.64 1y1m h LEU 74 N 0.57 0.70 -0.95 5.20 3.38 -0.72 -0.86 115.31 122.63 1y1m h LEU 74 Ca 0.14 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1y1m h LEU 74 Cb 0.30 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1y1m h LEU 74 CO -0.00 0.78 0.43 0.00 0.09 0.00 0.00 178.44 179.74 1y1m h ALA 75 N 0.95 1.19 0.09 1.53 0.00 -1.01 0.19 119.26 122.19 1y1m h ALA 75 Ca 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1y1m h ALA 75 Cb 0.37 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1y1m h ALA 75 CO 0.01 0.64 -0.04 -0.09 0.00 0.00 0.00 179.25 179.76 1y1m h ARG 76 N 1.18 -0.11 -0.45 0.00 9.65 -1.24 -1.03 114.38 122.38 1y1m h ARG 76 Ca 0.29 0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 59.16 1y1m h ARG 76 Cb 0.06 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.65 1y1m h ARG 76 CO -0.04 0.30 0.19 1.15 2.80 0.00 0.00 179.97 184.36 1y1m h THR 77 N -0.56 1.17 -0.60 0.20 2.02 -1.00 -2.95 112.91 111.18 1y1m h THR 77 Ca -0.01 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 66.65 1y1m h THR 77 Cb 0.47 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1y1m h THR 77 CO 0.02 0.20 0.00 0.23 0.37 0.00 0.00 175.52 176.34 1y1m n MET 78 N -4.37 2.70 -3.79 6.66 2.81 0.65 -5.00 117.12 116.78 1y1m n MET 78 Ca 0.03 -2.47 -0.25 0.00 -1.81 0.00 0.00 57.70 53.20 1y1m n MET 78 Cb 0.14 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.17 1y1m n MET 78 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1y1m n ASN 79 N 1.39 -1.90 -4.20 7.83 4.05 -0.48 -5.00 115.26 116.96 1y1m n ASN 79 Ca 0.21 -0.94 -0.17 0.00 0.45 0.00 0.00 54.58 54.13 1y1m n ASN 79 Cb 0.58 -3.52 -0.11 0.00 1.23 0.00 0.00 39.78 37.95 1y1m n ASN 79 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 177.26 174.93 1y1m s PHE 80 N -3.73 1.25 0.30 1.20 -0.12 -0.70 -5.06 117.98 111.11 1y1m s PHE 80 Ca 0.12 -0.54 0.07 0.00 -0.05 0.00 0.00 56.93 56.53 1y1m s PHE 80 Cb -0.04 -0.68 -0.03 0.00 -0.63 0.00 0.00 43.02 41.65 1y1m s PHE 80 CO 0.85 0.08 0.28 0.95 -0.05 0.00 0.00 175.22 177.33 1y1m s THR 81 N -1.89 4.08 0.28 -4.49 -4.23 -1.26 -4.67 115.64 103.46 1y1m s THR 81 Ca 0.04 -1.32 -0.18 0.00 -1.18 0.00 0.00 61.69 59.05 1y1m s THR 81 Cb -0.06 -3.35 0.01 0.00 1.34 0.00 0.00 72.50 70.45 1y1m s THR 81 CO 0.02 -0.25 0.65 -0.72 -0.54 0.00 0.00 174.62 173.78 1y1m s TYR 82 N -2.20 0.00 -0.02 3.99 1.13 -1.26 -1.19 117.35 117.81 1y1m s TYR 82 Ca 0.38 -0.44 0.00 0.00 -1.41 0.00 0.00 57.07 55.60 1y1m s TYR 82 Cb -0.07 0.55 0.03 0.00 -1.10 0.00 0.00 41.96 41.37 1y1m s TYR 82 CO 0.27 -1.18 0.02 -1.83 -2.51 0.00 0.00 175.55 170.32 1y1m s GLU 83 N -3.87 0.04 -0.12 -3.49 -1.05 -0.49 -4.87 118.70 104.86 1y1m s GLU 83 Ca 0.15 0.16 -0.04 0.00 -0.15 0.00 0.00 54.97 55.09 1y1m s GLU 83 Cb -0.04 -0.30 -0.04 0.00 -0.44 0.00 0.00 34.13 33.31 1y1m s GLU 83 CO 0.08 -0.16 0.05 0.08 0.95 0.00 0.00 175.26 176.26 1y1m s VAL 84 N 1.05 4.74 0.04 1.83 1.01 -1.26 -1.00 120.40 126.80 1y1m s VAL 84 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1y1m s VAL 84 Cb -0.13 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 1y1m s VAL 84 CO -0.03 0.58 -0.04 -1.38 0.00 0.00 0.00 175.10 174.23 1y1m s HIS 85 N -0.67 0.44 0.11 5.22 -3.43 -0.34 -1.80 115.29 114.82 1y1m s HIS 85 Ca 0.11 -0.65 -0.25 0.00 -0.80 0.00 0.00 55.06 53.48 1y1m s HIS 85 Cb -0.12 -0.29 -0.07 0.00 -1.43 0.00 0.00 32.58 30.67 1y1m s HIS 85 CO 0.02 -0.20 0.75 -0.51 -2.00 0.00 0.00 174.74 172.81 1y1m s LEU 86 N -1.86 4.53 0.12 5.38 1.43 0.12 -1.67 118.68 126.74 1y1m s LEU 86 Ca -0.09 1.53 -0.35 0.00 -1.03 0.00 0.00 54.13 54.19 1y1m s LEU 86 Cb -0.06 -3.23 -0.16 0.00 0.03 0.00 0.00 46.19 42.77 1y1m s LEU 86 CO -0.03 0.14 1.35 0.55 0.23 0.00 0.00 176.35 178.60 1y1m n VAL 87 N 2.06 0.19 -0.22 -1.59 3.14 -0.36 -4.66 118.33 116.90 1y1m n VAL 87 Ca -0.05 -0.05 -0.01 0.00 -2.96 0.00 0.00 64.34 61.28 1y1m n VAL 87 Cb 0.49 -0.97 0.11 0.00 -1.06 0.00 0.00 33.84 32.41 1y1m n VAL 87 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1y1m h ALA 88 N 4.57 0.86 -0.43 1.55 0.00 -1.92 -2.61 119.26 121.28 1y1m h ALA 88 Ca -0.46 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1y1m h ALA 88 Cb 1.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1y1m h ALA 88 CO 0.78 -0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.58 1y1m n ASP 89 N -4.87 2.60 -2.15 0.00 5.68 -1.26 -4.88 116.55 111.67 1y1m n ASP 89 Ca 0.09 -1.95 -0.21 0.00 -0.50 0.00 0.00 54.79 52.22 1y1m n ASP 89 Cb 0.22 -0.28 -0.03 0.00 -1.14 0.00 0.00 41.12 39.89 1y1m n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1y1m n GLY 90 N 1.30 0.20 3.43 6.12 0.00 -0.98 -4.95 105.19 110.30 1y1m n GLY 90 Ca 0.17 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1y1m n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y1m s LYS 91 N -4.68 1.54 -0.11 1.61 1.02 -1.26 -5.04 119.74 112.83 1y1m s LYS 91 Ca 0.00 -1.61 -0.27 0.00 0.02 0.00 0.00 55.97 54.11 1y1m s LYS 91 Cb 0.00 -1.73 -0.24 0.00 -0.52 0.00 0.00 37.83 35.34 1y1m s LYS 91 CO 0.00 0.35 0.88 0.74 -0.92 0.00 0.00 175.35 176.40 1y1m h PHE 92 N 2.84 -0.01 0.00 3.18 -1.00 -1.93 -2.20 116.94 117.82 1y1m h PHE 92 Ca -0.43 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.35 1y1m h PHE 92 Cb 1.23 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.79 1y1m h PHE 92 CO 0.73 0.82 0.00 0.41 -1.61 0.00 0.00 178.31 178.66 1y1m n GLY 93 N 1.23 3.40 3.09 -1.45 0.00 -1.26 -1.48 105.19 108.72 1y1m n GLY 93 Ca -0.09 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.40 1y1m n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y1m s THR 94 N 0.00 0.30 -0.19 2.61 -4.23 -1.26 -4.91 115.64 107.96 1y1m s THR 94 Ca 0.00 -1.72 -0.21 0.00 -1.18 0.00 0.00 61.69 58.57 1y1m s THR 94 Cb 0.00 -1.40 -0.02 0.00 1.34 0.00 0.00 72.50 72.42 1y1m s THR 94 CO 0.00 -0.91 0.66 -1.10 -0.54 0.00 0.00 174.62 172.73 1y1m s GLN 95 N -3.60 4.23 0.08 3.99 -0.21 -1.26 -2.45 119.66 120.44 1y1m s GLN 95 Ca 0.05 0.68 0.05 0.00 0.02 0.00 0.00 55.36 56.15 1y1m s GLN 95 Cb 0.05 -3.57 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 1y1m s GLN 95 CO -0.08 -0.24 -0.13 -1.21 -2.12 0.00 0.00 175.29 171.51 1y1m s GLU 96 N 1.90 0.82 -0.05 2.91 0.41 -0.76 -4.90 118.70 119.04 1y1m s GLU 96 Ca 0.30 -1.00 -0.30 0.00 -0.41 0.00 0.00 54.97 53.56 1y1m s GLU 96 Cb -0.16 -0.75 -0.03 0.00 -1.78 0.00 0.00 34.13 31.41 1y1m s GLU 96 CO 0.11 0.16 1.12 0.50 -0.49 0.00 0.00 175.26 176.65 1y1m s ARG 97 N -1.99 4.40 0.00 1.61 3.52 -1.26 -1.10 118.95 124.13 1y1m s ARG 97 Ca -0.00 1.57 0.00 0.00 -0.13 0.00 0.00 55.73 57.17 1y1m s ARG 97 Cb -0.08 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 29.78 1y1m s ARG 97 CO 0.02 -0.35 0.30 1.33 -0.81 0.00 0.00 175.30 175.79 1y1m n VAL 98 N 4.46 0.00 -3.61 7.11 0.24 -1.26 -4.97 118.33 120.30 1y1m n VAL 98 Ca 0.10 -0.46 -0.06 0.00 -2.04 0.00 0.00 64.34 61.88 1y1m n VAL 98 Cb 0.47 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 33.90 1y1m n VAL 98 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1y1m n ASN 99 N -0.30 -0.99 0.02 -1.34 0.23 -1.26 -5.03 115.26 106.58 1y1m n ASN 99 Ca 0.00 -1.92 0.11 0.00 -0.53 0.00 0.00 54.58 52.24 1y1m n ASN 99 Cb 0.01 1.72 0.49 0.00 -2.08 0.00 0.00 39.78 39.93 1y1m n ASN 99 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1y1m n ASN 100 N -1.55 0.12 -4.11 0.53 3.02 -1.26 -4.85 115.26 107.16 1y1m n ASN 100 Ca -0.02 0.52 -0.29 0.00 -0.03 0.00 0.00 54.58 54.75 1y1m n ASN 100 Cb 0.31 -0.55 0.22 0.00 -0.61 0.00 0.00 39.78 39.16 1y1m n ASN 100 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1y1m s SER 101 N -3.22 1.36 -0.00 6.41 1.04 -1.26 -4.94 113.70 113.09 1y1m s SER 101 Ca 0.11 0.85 0.20 0.00 0.48 0.00 0.00 55.95 57.59 1y1m s SER 101 Cb 0.15 -1.25 0.59 0.00 0.10 0.00 0.00 66.02 65.60 1y1m s SER 101 CO 0.44 -3.87 1.49 -0.46 0.98 0.00 0.00 173.24 171.82 1y1m n ASN 102 N -4.62 3.59 -4.23 7.02 0.23 -1.26 -4.84 115.26 111.15 1y1m n ASN 102 Ca 0.10 -2.01 -0.37 0.00 -0.53 0.00 0.00 54.58 51.77 1y1m n ASN 102 Cb 0.59 -0.45 -0.12 0.00 -2.08 0.00 0.00 39.78 37.72 1y1m n ASN 102 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1y1m s LYS 103 N -1.13 2.49 0.95 -3.83 2.20 -1.26 -5.09 119.74 114.07 1y1m s LYS 103 Ca 0.45 -1.33 -0.11 0.00 -0.36 0.00 0.00 55.97 54.61 1y1m s LYS 103 Cb 0.23 -3.46 0.16 0.00 -1.51 0.00 0.00 37.83 33.26 1y1m s LYS 103 CO 0.30 -0.75 1.09 0.15 -0.36 0.00 0.00 175.35 175.78 1y1m s LYS 104 N 1.33 0.76 0.01 4.03 1.02 -1.26 -4.76 119.74 120.88 1y1m s LYS 104 Ca -0.00 0.96 0.04 0.00 0.02 0.00 0.00 55.97 56.99 1y1m s LYS 104 Cb -0.21 -1.74 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 1y1m s LYS 104 CO 0.01 -2.62 -0.12 -1.21 -0.92 0.00 0.00 175.35 170.49 1y1m s GLU 105 N -4.78 0.89 0.27 1.68 0.41 -0.25 -4.89 118.70 112.03 1y1m s GLU 105 Ca 0.65 -0.57 -0.29 0.00 -0.41 0.00 0.00 54.97 54.36 1y1m s GLU 105 Cb -0.20 -0.86 -0.09 0.00 -1.78 0.00 0.00 34.13 31.19 1y1m s GLU 105 CO 0.59 0.22 0.97 -1.58 -0.49 0.00 0.00 175.26 174.97 1y1m s TRP 106 N -0.57 3.82 0.00 1.61 0.52 -1.26 -1.82 118.94 121.24 1y1m s TRP 106 Ca 0.02 1.84 0.00 0.00 0.02 0.00 0.00 56.10 57.98 1y1m s TRP 106 Cb -0.06 -3.02 0.00 0.00 -1.15 0.00 0.00 33.47 29.24 1y1m s TRP 106 CO 0.00 0.20 0.00 0.27 0.02 0.00 0.00 176.95 177.44 1y1m n ASN 107 N 1.15 1.17 0.00 2.95 2.04 -1.02 -3.99 115.26 117.55 1y1m n ASN 107 Ca -0.01 -0.73 0.00 0.00 -0.44 0.00 0.00 54.58 53.41 1y1m n ASN 107 Cb 0.48 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.73 1y1m n ASN 107 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1y1m n GLY 108 N 5.00 0.97 0.20 4.83 0.00 -1.26 -1.53 105.19 113.41 1y1m n GLY 108 Ca 0.00 -0.65 0.03 0.00 0.00 0.00 0.00 46.02 45.41 1y1m n GLY 108 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1y1m h MET 109 N 0.00 0.01 -0.38 1.61 2.86 -0.59 -2.46 114.93 115.98 1y1m h MET 109 Ca 0.00 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1y1m h MET 109 Cb 0.00 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1y1m h MET 109 CO 0.00 0.30 0.23 0.52 1.06 0.00 0.00 176.91 179.02 1y1m h MET 110 N 0.01 0.52 -0.60 1.72 2.07 -1.45 -0.41 114.93 116.79 1y1m h MET 110 Ca -0.00 -0.05 -0.03 0.00 -2.07 0.00 0.00 59.70 57.55 1y1m h MET 110 Cb 0.52 -0.11 -0.03 0.00 -1.87 0.00 0.00 31.60 30.12 1y1m h MET 110 CO 0.04 0.40 0.26 0.78 1.07 0.00 0.00 176.91 179.46 1y1m h GLY 111 N 0.50 0.94 1.34 8.32 0.00 -0.89 -1.90 103.07 111.38 1y1m h GLY 111 Ca 0.14 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1y1m h GLY 111 CO -0.02 0.46 -0.06 0.83 0.00 0.00 0.00 176.54 177.75 1y1m h GLU 112 N 0.82 0.80 -0.31 4.80 5.08 -1.14 -1.10 114.58 123.52 1y1m h GLU 112 Ca 0.20 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1y1m h GLU 112 Cb 0.16 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1y1m h GLU 112 CO -0.02 0.84 -0.05 1.25 -1.00 0.00 0.00 179.01 180.03 1y1m h LEU 113 N 0.73 0.59 -1.19 1.33 5.85 -0.89 -0.13 115.31 121.60 1y1m h LEU 113 Ca 0.13 -0.35 -0.08 0.00 0.84 0.00 0.00 57.88 58.42 1y1m h LEU 113 Cb 0.53 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1y1m h LEU 113 CO 0.03 0.80 -0.38 -0.07 -0.34 0.00 0.00 178.44 178.48 1y1m h LEU 114 N 0.37 0.05 0.00 2.25 3.38 -1.19 -2.96 115.31 117.21 1y1m h LEU 114 Ca 0.08 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1y1m h LEU 114 Cb 0.53 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1y1m h LEU 114 CO 0.03 0.43 -0.35 0.77 0.09 0.00 0.00 178.44 179.40 1y1m h SER 115 N 0.05 0.00 0.00 -0.43 4.64 -1.08 -3.48 113.55 113.25 1y1m h SER 115 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1y1m h SER 115 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1y1m h SER 115 CO 0.05 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 1y1m n GLY 116 N 1.20 0.56 0.23 -0.77 0.00 -0.70 -4.92 105.19 100.79 1y1m n GLY 116 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.21 1y1m n GLY 116 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1y1m h GLN 117 N 4.83 0.00 -4.34 1.61 4.20 -1.32 -3.43 115.11 116.67 1y1m h GLN 117 Ca 0.00 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.48 1y1m h GLN 117 Cb 0.00 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 27.57 1y1m h GLN 117 CO 0.00 0.00 -0.72 0.00 -0.67 0.00 0.00 178.83 177.44 1y1m s ALA 118 N -3.53 0.41 -0.10 3.87 0.00 -0.79 -4.89 121.76 116.73 1y1m s ALA 118 Ca 0.03 -0.72 0.16 0.00 0.00 0.00 0.00 51.96 51.42 1y1m s ALA 118 Cb 0.09 0.09 -0.23 0.00 0.00 0.00 0.00 23.12 23.07 1y1m s ALA 118 CO 0.51 -0.09 0.20 -0.25 0.00 0.00 0.00 175.76 176.13 1y1m n ASP 119 N 1.44 1.00 -3.78 0.00 8.00 0.21 -4.41 116.55 119.01 1y1m n ASP 119 Ca -0.23 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.14 1y1m n ASP 119 Cb 0.55 1.29 -0.11 0.00 -0.02 0.00 0.00 41.12 42.83 1y1m n ASP 119 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1y1m s MET 120 N -2.75 0.37 -0.30 -1.24 -1.94 -1.05 -4.49 119.30 107.90 1y1m s MET 120 Ca -0.07 0.32 -0.10 0.00 -1.71 0.00 0.00 55.69 54.13 1y1m s MET 120 Cb 0.08 0.18 -0.02 0.00 2.01 0.00 0.00 34.83 37.07 1y1m s MET 120 CO 0.69 -0.05 0.16 0.42 -0.01 0.00 0.00 175.02 176.23 1y1m s ILE 121 N -0.03 4.80 -0.48 2.53 1.01 0.09 -1.61 121.20 127.53 1y1m s ILE 121 Ca -0.02 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.44 1y1m s ILE 121 Cb -0.02 -3.38 0.13 0.00 0.01 0.00 0.00 42.46 39.19 1y1m s ILE 121 CO 0.01 0.15 0.23 -0.69 0.00 0.00 0.00 174.94 174.63 1y1m s VAL 122 N 1.66 2.73 0.22 2.92 1.01 -0.76 -1.62 120.40 126.57 1y1m s VAL 122 Ca 0.06 -2.93 -0.22 0.00 0.00 0.00 0.00 61.98 58.88 1y1m s VAL 122 Cb -0.17 -2.90 0.05 0.00 0.00 0.00 0.00 36.38 33.37 1y1m s VAL 122 CO 0.07 -0.75 0.89 0.00 0.00 0.00 0.00 175.10 175.31 1y1m s ALA 123 N 0.15 -1.42 -1.13 5.51 0.00 -1.26 -4.49 121.76 119.11 1y1m s ALA 123 Ca 0.15 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.78 1y1m s ALA 123 Cb -0.23 0.72 -0.06 0.00 0.00 0.00 0.00 23.12 23.55 1y1m s ALA 123 CO -0.03 -1.04 2.12 -0.35 0.00 0.00 0.00 175.76 176.46 1y1m n PRO 124 N -0.51 2.25 -3.35 0.00 -0.04 -1.26 -4.65 135.00 127.45 1y1m n PRO 124 Ca -0.05 -2.20 -0.40 0.00 -0.04 0.00 0.00 63.50 60.81 1y1m n PRO 124 Cb 0.60 -3.07 -0.09 0.00 -0.04 0.00 0.00 33.50 30.90 1y1m n PRO 124 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1y1m s LEU 125 N 1.57 4.19 0.08 1.53 2.96 -1.26 -5.02 118.68 122.73 1y1m s LEU 125 Ca 0.52 0.12 -0.31 0.00 -0.22 0.00 0.00 54.13 54.25 1y1m s LEU 125 Cb 0.14 -2.46 -0.08 0.00 0.50 0.00 0.00 46.19 44.30 1y1m s LEU 125 CO 0.01 -0.29 1.47 -0.89 -1.32 0.00 0.00 176.35 175.33 1y1m s THR 126 N 2.15 3.25 -0.47 3.68 2.01 -1.26 -2.47 115.64 122.53 1y1m s THR 126 Ca 0.16 0.82 -0.29 0.00 0.31 0.00 0.00 61.69 62.68 1y1m s THR 126 Cb -0.16 -3.52 0.03 0.00 0.01 0.00 0.00 72.50 68.86 1y1m s THR 126 CO 0.11 0.03 1.14 -0.63 -0.69 0.00 0.00 174.62 174.58 1y1m s ILE 127 N 1.74 4.22 0.28 1.82 1.01 -0.28 -4.94 121.20 125.04 1y1m s ILE 127 Ca 0.67 1.25 0.02 0.00 0.00 0.00 0.00 60.65 62.59 1y1m s ILE 127 Cb -0.37 -4.60 -0.06 0.00 0.01 0.00 0.00 42.46 37.44 1y1m s ILE 127 CO 0.30 -0.99 0.07 0.54 0.00 0.00 0.00 174.94 174.85 1y1m s ASN 128 N 2.43 1.70 0.12 3.58 2.20 -1.26 -4.62 114.94 119.09 1y1m s ASN 128 Ca 0.48 -1.35 -0.20 0.00 -0.94 0.00 0.00 52.86 50.84 1y1m s ASN 128 Cb -0.07 0.05 -0.04 0.00 -2.00 0.00 0.00 41.25 39.19 1y1m s ASN 128 CO 0.31 -0.65 1.72 -1.13 -2.94 0.00 0.00 177.10 174.40 1y1m h ASN 129 N 2.31 -0.12 -0.52 3.54 -0.73 -1.98 -1.45 115.58 116.63 1y1m h ASN 129 Ca -0.39 0.05 0.02 0.00 1.87 0.00 0.00 56.30 57.85 1y1m h ASN 129 Cb 1.24 0.09 -0.03 0.00 0.27 0.00 0.00 38.32 39.89 1y1m h ASN 129 CO 0.64 -0.04 0.32 -0.08 -0.37 0.00 0.00 177.43 177.91 1y1m h GLU 130 N 0.03 0.61 -0.32 6.67 4.81 -2.00 -2.50 114.58 121.89 1y1m h GLU 130 Ca 0.09 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.14 1y1m h GLU 130 Cb 0.12 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1y1m h GLU 130 CO -0.17 0.41 -0.35 0.00 -0.73 0.00 0.00 179.01 178.16 1y1m h ARG 131 N 0.63 0.72 0.00 1.92 3.08 -1.92 -2.83 114.38 115.98 1y1m h ARG 131 Ca 0.20 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1y1m h ARG 131 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1y1m h ARG 131 CO -0.08 0.97 0.00 0.00 -1.07 0.00 0.00 179.97 179.78 1y1m h ALA 132 N 1.00 1.00 0.00 0.04 0.00 -0.92 -0.48 119.26 119.90 1y1m h ALA 132 Ca 0.06 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1y1m h ALA 132 Cb 0.89 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1y1m h ALA 132 CO 0.08 0.00 -0.17 1.96 0.00 0.00 0.00 179.25 181.12 1y1m h GLN 133 N 0.00 0.00 0.00 0.00 4.20 -1.19 -3.36 115.11 114.75 1y1m h GLN 133 Ca 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 1y1m h GLN 133 Cb 0.16 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1y1m h GLN 133 CO 0.00 0.17 -1.45 0.66 -0.67 0.00 0.00 178.83 177.54 1y1m n TYR 134 N -3.25 0.00 -4.46 2.96 4.02 -0.33 -5.08 117.16 111.02 1y1m n TYR 134 Ca 0.01 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.66 1y1m n TYR 134 Cb 0.46 -0.32 -0.08 0.00 -0.02 0.00 0.00 39.34 39.38 1y1m n TYR 134 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1y1m s ILE 135 N -2.20 0.52 0.21 -0.72 -4.36 -0.39 -4.61 121.20 109.65 1y1m s ILE 135 Ca -0.03 -2.00 0.11 0.00 -0.26 0.00 0.00 60.65 58.47 1y1m s ILE 135 Cb 0.02 -2.40 -0.05 0.00 1.25 0.00 0.00 42.46 41.29 1y1m s ILE 135 CO 0.28 0.00 -0.23 -1.61 0.24 0.00 0.00 174.94 173.62 1y1m s GLU 136 N -3.70 1.54 0.17 0.37 2.02 -0.30 -4.37 118.70 114.43 1y1m s GLU 136 Ca 0.27 -1.57 0.11 0.00 0.02 0.00 0.00 54.97 53.80 1y1m s GLU 136 Cb 0.03 -1.80 -0.04 0.00 0.10 0.00 0.00 34.13 32.42 1y1m s GLU 136 CO 0.16 0.38 -0.23 -0.06 0.02 0.00 0.00 175.26 175.53 1y1m s PHE 137 N -1.87 2.17 0.94 1.61 0.40 -1.26 -1.36 117.98 118.61 1y1m s PHE 137 Ca 0.22 -0.39 -0.15 0.00 -0.60 0.00 0.00 56.93 56.02 1y1m s PHE 137 Cb -0.07 -1.10 0.17 0.00 0.51 0.00 0.00 43.02 42.53 1y1m s PHE 137 CO 0.11 0.42 1.24 -1.54 0.70 0.00 0.00 175.22 176.15 1y1m s SER 138 N -2.52 3.33 0.64 1.36 1.04 -0.51 -4.95 113.70 112.09 1y1m s SER 138 Ca 0.18 0.53 -0.17 0.00 0.48 0.00 0.00 55.95 56.96 1y1m s SER 138 Cb -0.08 -0.78 -0.01 0.00 0.10 0.00 0.00 66.02 65.25 1y1m s SER 138 CO 0.08 -2.62 1.22 -0.54 0.98 0.00 0.00 173.24 172.36 1y1m s LYS 139 N -5.68 2.66 0.21 4.02 -0.14 -1.26 -4.55 119.74 115.00 1y1m s LYS 139 Ca 0.69 1.84 -0.31 0.00 -1.36 0.00 0.00 55.97 56.82 1y1m s LYS 139 Cb -0.08 -1.89 -0.11 0.00 -1.68 0.00 0.00 37.83 34.07 1y1m s LYS 139 CO 0.52 -1.45 1.63 -2.14 -0.76 0.00 0.00 175.35 173.16 1y1m s PRO 140 N -3.53 4.16 0.00 -1.68 0.02 -1.26 -4.63 135.00 128.09 1y1m s PRO 140 Ca 0.77 2.50 0.25 0.00 0.02 0.00 0.00 61.00 64.54 1y1m s PRO 140 Cb -0.31 -3.10 0.40 0.00 0.02 0.00 0.00 34.50 31.52 1y1m s PRO 140 CO 0.38 -0.67 1.34 1.97 -0.33 0.00 0.00 177.00 179.70 1y1m n PHE 141 N 3.62 0.00 -3.71 6.54 1.16 0.05 -4.85 117.46 120.27 1y1m n PHE 141 Ca 0.14 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.60 1y1m n PHE 141 Cb 0.37 -0.09 -0.11 0.00 -1.61 0.00 0.00 39.48 38.04 1y1m n PHE 141 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 1y1m s LYS 142 N -2.61 0.40 -0.17 3.97 2.47 -1.23 -5.00 119.74 117.57 1y1m s LYS 142 Ca 0.19 0.71 -0.05 0.00 -1.56 0.00 0.00 55.97 55.26 1y1m s LYS 142 Cb 0.18 0.04 -0.03 0.00 -1.46 0.00 0.00 37.83 36.56 1y1m s LYS 142 CO 0.59 -0.13 0.00 0.71 0.16 0.00 0.00 175.35 176.69 1y1m s TYR 143 N 1.07 3.11 0.00 4.03 1.51 -1.26 -1.19 117.35 124.62 1y1m s TYR 143 Ca -0.07 -0.17 0.00 0.00 -1.01 0.00 0.00 57.07 55.82 1y1m s TYR 143 Cb -0.07 -2.02 0.00 0.00 -0.11 0.00 0.00 41.96 39.76 1y1m s TYR 143 CO -0.09 0.01 0.00 0.00 -1.11 0.00 0.00 175.55 174.37 1y1m n GLN 144 N 3.61 0.00 -3.08 -0.62 -0.00 0.04 -4.98 117.38 112.36 1y1m n GLN 144 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.83 1y1m n GLN 144 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.76 1y1m n GLN 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1y1m n GLY 145 N 0.00 -1.24 3.81 2.61 0.00 -1.26 -0.84 105.19 108.27 1y1m n GLY 145 Ca 0.00 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 1y1m n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y1m s LEU 146 N 0.00 4.39 0.00 0.99 1.43 -0.06 0.25 118.68 125.69 1y1m s LEU 146 Ca 0.00 1.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.54 1y1m s LEU 146 Cb 0.00 -3.48 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 1y1m s LEU 146 CO 0.00 0.08 0.08 1.07 0.23 0.00 0.00 176.35 177.81 1y1m n THR 147 N 0.92 0.00 -4.82 5.49 5.66 -0.38 -2.08 114.28 119.07 1y1m n THR 147 Ca -0.04 -0.53 -0.27 0.00 -3.05 0.00 0.00 64.05 60.17 1y1m n THR 147 Cb 0.51 0.28 -0.16 0.00 -1.55 0.00 0.00 70.33 69.41 1y1m n THR 147 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1y1m s ILE 148 N -2.38 1.44 -0.21 1.09 1.01 -1.25 -2.51 121.20 118.39 1y1m s ILE 148 Ca 0.09 -0.70 -0.07 0.00 0.00 0.00 0.00 60.65 59.98 1y1m s ILE 148 Cb 0.00 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 1y1m s ILE 148 CO 0.06 0.42 0.05 -0.22 0.00 0.00 0.00 174.94 175.25 1y1m s LEU 149 N 0.26 3.53 0.24 2.97 2.96 -0.11 -1.22 118.68 127.31 1y1m s LEU 149 Ca -0.09 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.74 1y1m s LEU 149 Cb -0.14 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 1y1m s LEU 149 CO 0.04 0.08 0.18 0.68 -1.32 0.00 0.00 176.35 176.00 1y1m s VAL 150 N 0.94 0.00 0.32 1.68 -7.23 -0.39 -1.35 120.40 114.38 1y1m s VAL 150 Ca 0.03 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.92 1y1m s VAL 150 Cb -0.14 -2.50 -0.09 0.00 0.56 0.00 0.00 36.38 34.21 1y1m s VAL 150 CO 0.02 0.00 1.06 -1.59 -0.31 0.00 0.00 175.10 174.29 1y1m s LYS 151 N -3.93 4.50 0.13 4.82 0.00 -1.26 -1.58 119.74 122.43 1y1m s LYS 151 Ca 0.40 1.66 -0.34 0.00 0.00 0.00 0.00 55.97 57.69 1y1m s LYS 151 Cb 0.05 -2.98 -0.17 0.00 0.00 0.00 0.00 37.83 34.74 1y1m s LYS 151 CO 0.17 0.13 1.14 1.17 0.00 0.00 0.00 175.35 177.96 1y1m n LYS 152 N 0.79 0.89 0.00 1.78 4.81 -0.49 -1.43 118.16 124.51 1y1m n LYS 152 Ca 0.01 0.32 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 1y1m n LYS 152 Cb 0.47 -1.81 0.00 0.00 0.02 0.00 0.00 35.03 33.71 1y1m n LYS 152 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1y1m n GLY 153 N 2.04 2.42 3.79 3.14 0.00 -1.26 -5.02 105.19 110.30 1y1m n GLY 153 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1y1m n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y1m s THR 154 N -2.63 4.86 -0.16 2.61 2.01 -0.52 -5.07 115.64 116.75 1y1m s THR 154 Ca 0.00 1.17 0.01 0.00 0.31 0.00 0.00 61.69 63.17 1y1m s THR 154 Cb 0.00 -3.88 0.02 0.00 0.01 0.00 0.00 72.50 68.65 1y1m s THR 154 CO 0.00 0.49 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.13 1y1m s ARG 155 N -0.66 2.52 -0.08 4.92 1.81 -1.26 -4.91 118.95 121.30 1y1m s ARG 155 Ca 0.29 -0.67 0.02 0.00 -1.72 0.00 0.00 55.73 53.65 1y1m s ARG 155 Cb -0.18 -2.28 0.01 0.00 -0.45 0.00 0.00 34.95 32.05 1y1m s ARG 155 CO 0.17 -0.24 -0.14 0.42 -0.68 0.00 0.00 175.30 174.84 1y1m s ILE 156 N 1.41 1.31 0.30 1.52 -1.09 -1.26 -5.04 121.20 118.35 1y1m s ILE 156 Ca 0.05 -0.56 0.08 0.00 -2.23 0.00 0.00 60.65 57.99 1y1m s ILE 156 Cb -0.13 -1.20 0.03 0.00 -1.58 0.00 0.00 42.46 39.58 1y1m s ILE 156 CO -0.11 0.40 1.70 0.71 -1.23 0.00 0.00 174.94 176.41 1y1m h THR 157 N 5.96 1.32 0.00 2.92 1.35 -1.96 -2.03 112.91 120.47 1y1m h THR 157 Ca -0.30 -1.57 0.00 0.00 -0.55 0.00 0.00 66.41 63.99 1y1m h THR 157 Cb 1.18 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1y1m h THR 157 CO 0.47 0.46 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 1y1m n GLY 158 N -0.15 -0.04 0.10 5.82 0.00 -1.26 -1.02 105.19 108.63 1y1m n GLY 158 Ca -0.02 -1.20 0.09 0.00 0.00 0.00 0.00 46.02 44.90 1y1m n GLY 158 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1y1m n ILE 159 N 9.00 1.07 0.91 -0.61 0.13 -1.26 -2.22 119.36 126.37 1y1m n ILE 159 Ca 0.00 0.39 0.11 0.00 -1.10 0.00 0.00 62.75 62.15 1y1m n ILE 159 Cb 0.00 -1.31 0.07 0.00 -0.84 0.00 0.00 39.64 37.56 1y1m n ILE 159 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1y1m n ASN 160 N -2.00 2.64 -4.73 9.51 3.02 -1.26 -4.74 115.26 117.70 1y1m n ASN 160 Ca 0.01 -1.82 -0.42 0.00 -0.03 0.00 0.00 54.58 52.32 1y1m n ASN 160 Cb 0.14 0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 1y1m n ASN 160 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1y1m n ASP 161 N 0.98 3.48 -0.26 6.41 -0.08 -0.94 -4.77 116.55 121.37 1y1m n ASP 161 Ca 0.12 1.16 0.03 0.00 -1.51 0.00 0.00 54.79 54.59 1y1m n ASP 161 Cb 0.52 -1.54 0.26 0.00 2.34 0.00 0.00 41.12 42.69 1y1m n ASP 161 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1y1m h PRO 162 N 4.25 0.96 0.00 -0.67 0.13 -1.94 -0.71 132.00 134.03 1y1m h PRO 162 Ca -0.47 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1y1m h PRO 162 Cb 1.24 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1y1m h PRO 162 CO 0.75 0.64 0.00 0.54 -0.23 0.00 0.00 178.00 179.70 1y1m n ARG 163 N -4.46 0.15 -0.13 0.86 1.74 -1.26 0.12 116.66 113.68 1y1m n ARG 163 Ca 0.12 0.61 -0.20 0.00 -0.77 0.00 0.00 57.85 57.61 1y1m n ARG 163 Cb 0.15 -1.96 -0.11 0.00 -1.02 0.00 0.00 32.46 29.52 1y1m n ARG 163 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1y1m n LEU 164 N -2.27 2.72 0.12 0.55 4.32 -0.42 -4.08 117.00 117.93 1y1m n LEU 164 Ca -0.01 -0.03 0.00 0.00 -0.02 0.00 0.00 56.01 55.96 1y1m n LEU 164 Cb 0.06 -0.85 0.01 0.00 -1.62 0.00 0.00 43.42 41.03 1y1m n LEU 164 CO 0.11 0.83 0.40 0.03 -1.22 0.00 0.00 177.39 177.54 1y1m h ARG 165 N -0.23 0.00 -2.19 3.23 2.47 -0.62 -3.35 114.38 113.69 1y1m h ARG 165 Ca -0.58 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 57.55 1y1m h ARG 165 Cb 1.80 0.00 -0.41 0.00 -1.65 0.00 0.00 29.97 29.71 1y1m h ARG 165 CO -0.16 0.63 -0.76 0.09 0.56 0.00 0.00 179.97 180.33 1y1m n ASN 166 N -3.29 2.52 -4.76 7.04 5.03 0.33 -4.81 115.26 117.32 1y1m n ASN 166 Ca 0.01 -3.18 -0.32 0.00 0.87 0.00 0.00 54.58 51.97 1y1m n ASN 166 Cb 0.77 -0.66 0.08 0.00 -1.02 0.00 0.00 39.78 38.95 1y1m n ASN 166 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1y1m s PRO 167 N -1.96 2.40 0.27 3.52 0.04 -1.26 -4.54 135.00 133.47 1y1m s PRO 167 Ca 0.37 1.35 -0.20 0.00 0.04 0.00 0.00 61.00 62.56 1y1m s PRO 167 Cb 0.14 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.80 1y1m s PRO 167 CO -0.06 -1.56 0.68 -1.54 0.04 0.00 0.00 177.00 174.56 1y1m s SER 168 N -2.86 -0.26 0.00 6.66 1.04 -1.26 -5.04 113.70 111.98 1y1m s SER 168 Ca 0.65 -0.61 0.16 0.00 0.48 0.00 0.00 55.95 56.64 1y1m s SER 168 Cb -0.20 0.70 0.77 0.00 0.10 0.00 0.00 66.02 67.39 1y1m s SER 168 CO 0.49 -1.29 1.49 0.47 0.98 0.00 0.00 173.24 175.37 1y1m n ASP 169 N -0.44 0.00 0.26 7.02 8.00 -1.26 -2.84 116.55 127.29 1y1m n ASP 169 Ca -0.05 0.23 0.14 0.00 0.71 0.00 0.00 54.79 55.82 1y1m n ASP 169 Cb 0.60 -0.37 0.61 0.00 -0.02 0.00 0.00 41.12 41.94 1y1m n ASP 169 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1y1m h LYS 170 N 0.00 0.00 -2.53 -1.24 1.57 -2.00 -3.39 116.57 108.98 1y1m h LYS 170 Ca 0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.35 1y1m h LYS 170 Cb 0.20 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 32.14 1y1m h LYS 170 CO 0.00 0.10 -0.71 0.12 -0.57 0.00 0.00 179.45 178.39 1y1m s PHE 171 N -3.72 -0.04 -0.13 -1.35 5.36 -1.13 -5.06 117.98 111.91 1y1m s PHE 171 Ca 0.00 -0.49 -0.13 0.00 -0.96 0.00 0.00 56.93 55.35 1y1m s PHE 171 Cb 0.10 -0.68 -0.05 0.00 -0.34 0.00 0.00 43.02 42.06 1y1m s PHE 171 CO 0.58 -0.83 0.31 0.42 -1.46 0.00 0.00 175.22 174.24 1y1m s ILE 172 N 2.22 5.27 0.16 3.12 1.01 -1.26 -4.51 121.20 127.21 1y1m s ILE 172 Ca 0.09 0.59 0.05 0.00 0.00 0.00 0.00 60.65 61.37 1y1m s ILE 172 Cb -0.15 -3.63 -0.05 0.00 0.01 0.00 0.00 42.46 38.64 1y1m s ILE 172 CO -0.32 0.44 -0.10 -0.72 0.00 0.00 0.00 174.94 174.25 1y1m s TYR 173 N 0.05 1.32 0.09 3.97 1.13 -1.26 -1.24 117.35 121.41 1y1m s TYR 173 Ca 0.18 -0.76 -0.26 0.00 -1.41 0.00 0.00 57.07 54.82 1y1m s TYR 173 Cb -0.14 -0.67 0.09 0.00 -1.10 0.00 0.00 41.96 40.14 1y1m s TYR 173 CO 0.06 0.09 1.14 0.00 -2.51 0.00 0.00 175.55 174.33 1y1m s ALA 174 N -3.31 -1.96 0.00 9.51 0.00 -0.72 -4.46 121.76 120.81 1y1m s ALA 174 Ca 0.18 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1y1m s ALA 174 Cb 0.03 0.70 0.00 0.00 0.00 0.00 0.00 23.12 23.84 1y1m s ALA 174 CO 0.02 -1.08 0.00 -2.37 0.00 0.00 0.00 175.76 172.32 1y1m n THR 175 N -0.68 0.00 -3.35 0.00 5.66 -1.26 -1.29 114.28 113.36 1y1m n THR 175 Ca -0.03 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.59 1y1m n THR 175 Cb 0.60 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.32 1y1m n THR 175 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1y1m s VAL 176 N -1.08 5.20 0.40 1.08 1.01 -1.26 -1.23 120.40 124.52 1y1m s VAL 176 Ca 0.00 0.87 -0.27 0.00 0.00 0.00 0.00 61.98 62.58 1y1m s VAL 176 Cb 0.00 -3.78 -0.10 0.00 0.00 0.00 0.00 36.38 32.50 1y1m s VAL 176 CO 0.00 0.32 1.42 -1.59 0.00 0.00 0.00 175.10 175.25 1y1m s LYS 177 N 0.73 3.98 -0.31 2.72 0.00 0.10 -2.70 119.74 124.27 1y1m s LYS 177 Ca 0.24 2.42 0.00 0.00 0.00 0.00 0.00 55.97 58.63 1y1m s LYS 177 Cb -0.15 -2.85 0.00 0.00 0.00 0.00 0.00 37.83 34.83 1y1m s LYS 177 CO 0.09 -0.58 0.00 0.00 0.00 0.00 0.00 175.35 174.86 1y1m n GLN 178 N 0.24 -1.24 -2.36 1.78 0.00 -1.26 -4.95 117.38 109.59 1y1m n GLN 178 Ca 0.03 0.46 -0.24 0.00 0.00 0.00 0.00 57.00 57.25 1y1m n GLN 178 Cb 0.41 -4.47 0.07 0.00 0.00 0.00 0.00 30.24 26.25 1y1m n GLN 178 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1y1m s SER 179 N -2.18 4.80 0.47 2.61 1.04 -1.10 -4.93 113.70 114.41 1y1m s SER 179 Ca 0.00 0.21 0.25 0.00 0.48 0.00 0.00 55.95 56.89 1y1m s SER 179 Cb 0.00 -0.86 1.12 0.00 0.10 0.00 0.00 66.02 66.38 1y1m s SER 179 CO 0.00 -1.56 1.92 0.77 0.98 0.00 0.00 173.24 175.35 1y1m h SER 180 N -0.45 0.00 -0.10 7.02 4.64 -1.91 -1.86 113.55 120.89 1y1m h SER 180 Ca -0.43 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.71 1y1m h SER 180 Cb 1.30 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.40 1y1m h SER 180 CO 0.54 0.20 -0.66 0.58 -0.87 0.00 0.00 176.83 176.62 1y1m h VAL 181 N 0.00 1.33 -0.60 0.95 2.07 -1.93 -0.52 116.25 117.55 1y1m h VAL 181 Ca -0.00 -1.94 0.01 0.00 0.82 0.00 0.00 66.70 65.59 1y1m h VAL 181 Cb 0.59 2.18 -0.03 0.00 -1.52 0.00 0.00 31.29 32.50 1y1m h VAL 181 CO 0.03 0.59 0.39 -0.78 0.02 0.00 0.00 177.57 177.82 1y1m h ASP 182 N 0.27 0.67 -0.65 0.57 3.58 -1.65 -1.88 116.42 117.33 1y1m h ASP 182 Ca -0.05 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.34 1y1m h ASP 182 Cb 1.30 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 42.16 1y1m h ASP 182 CO 0.13 0.48 0.25 0.40 -2.88 0.00 0.00 179.24 177.62 1y1m h ILE 183 N 0.79 1.24 -0.37 2.25 1.08 -1.25 -1.64 117.51 119.61 1y1m h ILE 183 Ca 0.23 -0.78 0.06 0.00 -0.39 0.00 0.00 64.86 63.98 1y1m h ILE 183 Cb -0.06 0.46 -0.06 0.00 -3.07 0.00 0.00 36.82 34.09 1y1m h ILE 183 CO -0.06 0.31 0.02 0.22 -0.69 0.00 0.00 178.15 177.95 1y1m h TYR 184 N 0.99 0.02 -0.30 1.37 3.20 -0.29 -1.71 116.97 120.25 1y1m h TYR 184 Ca 0.23 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.98 1y1m h TYR 184 Cb 0.23 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1y1m h TYR 184 CO 0.02 -0.04 -0.40 0.74 -1.64 0.00 0.00 178.16 176.83 1y1m h PHE 185 N 0.13 0.87 -0.06 -3.82 -1.00 -1.14 -2.65 116.94 109.27 1y1m h PHE 185 Ca 0.18 -0.26 -0.03 0.00 2.81 0.00 0.00 57.97 60.67 1y1m h PHE 185 Cb 0.24 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.61 1y1m h PHE 185 CO -0.23 1.01 -0.10 0.00 -1.61 0.00 0.00 178.31 177.38 1y1m h ARG 186 N 0.59 0.09 0.00 1.51 3.08 -0.83 -2.83 114.38 116.00 1y1m h ARG 186 Ca 0.05 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1y1m h ARG 186 Cb 0.94 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1y1m h ARG 186 CO 0.09 0.20 -1.10 0.54 -1.07 0.00 0.00 179.97 178.62 1y1m n ARG 187 N -4.37 0.48 -2.46 0.04 1.74 -0.68 -4.75 116.66 106.65 1y1m n ARG 187 Ca -0.02 0.04 -0.40 0.00 -0.77 0.00 0.00 57.85 56.70 1y1m n ARG 187 Cb 0.20 -1.70 -0.03 0.00 -1.02 0.00 0.00 32.46 29.91 1y1m n ARG 187 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1y1m s GLN 188 N -3.31 3.19 0.36 5.56 -1.52 -1.00 -4.86 119.66 118.07 1y1m s GLN 188 Ca 0.00 -0.36 0.09 0.00 -1.95 0.00 0.00 55.36 53.14 1y1m s GLN 188 Cb 0.12 -4.55 0.83 0.00 -0.22 0.00 0.00 33.01 29.18 1y1m s GLN 188 CO 0.80 -2.30 1.87 -0.24 -0.25 0.00 0.00 175.29 175.17 1y1m h VAL 189 N 6.39 0.84 0.00 1.09 3.04 -1.85 0.15 116.25 125.91 1y1m h VAL 189 Ca -0.14 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 1y1m h VAL 189 Cb 1.05 0.10 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1y1m h VAL 189 CO 1.31 0.12 0.00 -0.62 -1.01 0.00 0.00 177.57 177.37 1y1m n GLU 190 N -4.55 0.15 -0.53 4.17 4.71 -1.26 -2.55 120.64 120.77 1y1m n GLU 190 Ca 0.17 0.41 0.06 0.00 -0.01 0.00 0.00 57.16 57.79 1y1m n GLU 190 Cb 0.46 -1.80 0.26 0.00 -1.01 0.00 0.00 31.44 29.35 1y1m n GLU 190 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1y1m n LEU 191 N -2.08 4.07 -0.36 -4.62 4.77 0.51 -4.69 117.00 114.60 1y1m n LEU 191 Ca 0.02 -3.14 0.01 0.00 -0.03 0.00 0.00 56.01 52.87 1y1m n LEU 191 Cb 0.20 -0.57 0.17 0.00 -2.33 0.00 0.00 43.42 40.88 1y1m n LEU 191 CO 0.17 0.76 1.27 0.77 -1.33 0.00 0.00 177.39 179.04 1y1m h SER 192 N 1.75 1.06 -0.04 -1.43 4.64 -1.44 -0.58 113.55 117.51 1y1m h SER 192 Ca 0.05 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1y1m h SER 192 Cb 1.54 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1y1m h SER 192 CO 0.28 0.71 0.02 0.74 -0.87 0.00 0.00 176.83 177.71 1y1m h THR 193 N 1.22 1.04 0.04 2.95 2.02 -1.86 -0.71 112.91 117.61 1y1m h THR 193 Ca 0.40 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.49 1y1m h THR 193 Cb 0.06 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1y1m h THR 193 CO -0.14 0.03 -0.06 0.24 0.37 0.00 0.00 175.52 175.96 1y1m h MET 194 N 0.02 -0.12 -0.66 6.66 2.07 -1.69 -2.75 114.93 118.46 1y1m h MET 194 Ca 0.01 0.01 0.10 0.00 -2.07 0.00 0.00 59.70 57.75 1y1m h MET 194 Cb 0.03 0.03 -0.07 0.00 -1.87 0.00 0.00 31.60 29.72 1y1m h MET 194 CO -0.00 -0.08 0.29 -0.92 1.07 0.00 0.00 176.91 177.26 1y1m h TYR 195 N -0.13 0.50 -0.96 -0.22 5.03 -0.95 0.25 116.97 120.50 1y1m h TYR 195 Ca 0.01 0.03 0.08 0.00 2.58 0.00 0.00 58.73 61.43 1y1m h TYR 195 Cb 0.13 -0.13 -0.07 0.00 1.55 0.00 0.00 36.73 38.22 1y1m h TYR 195 CO -0.11 0.15 0.62 0.00 -1.32 0.00 0.00 178.16 177.50 1y1m h ARG 196 N 0.49 1.03 -0.12 1.82 2.47 -0.90 0.12 114.38 119.30 1y1m h ARG 196 Ca 0.33 -0.06 -0.10 0.00 -1.26 0.00 0.00 59.98 58.89 1y1m h ARG 196 Cb 0.39 -0.23 0.00 0.00 -1.65 0.00 0.00 29.97 28.48 1y1m h ARG 196 CO -0.30 0.68 -0.32 1.25 0.56 0.00 0.00 179.97 181.85 1y1m h HIS 197 N 1.06 0.55 -0.50 3.04 -0.00 -0.94 -3.32 115.15 115.05 1y1m h HIS 197 Ca 0.43 -0.21 -0.05 0.00 -0.00 0.00 0.00 60.37 60.53 1y1m h HIS 197 Cb 0.27 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.56 1y1m h HIS 197 CO -0.00 0.94 0.11 0.52 -0.00 0.00 0.00 177.93 179.49 1y1m h MET 198 N 0.01 0.80 0.00 5.26 2.07 -0.45 -2.69 114.93 119.93 1y1m h MET 198 Ca -0.01 -0.20 0.00 0.00 -2.07 0.00 0.00 59.70 57.43 1y1m h MET 198 Cb 0.93 -0.10 0.00 0.00 -1.87 0.00 0.00 31.60 30.56 1y1m h MET 198 CO 0.07 0.78 0.24 0.93 1.07 0.00 0.00 176.91 180.00 1y1m h GLU 199 N 0.69 0.00 -0.00 1.72 5.08 -0.87 0.88 114.58 122.07 1y1m h GLU 199 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1y1m h GLU 199 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1y1m h GLU 199 CO 0.00 0.00 -0.55 0.36 -1.00 0.00 0.00 179.01 177.83 1y1m n LYS 200 N -2.51 0.45 0.00 2.33 0.00 -1.01 -4.44 118.16 112.97 1y1m n LYS 200 Ca -0.02 -0.32 0.00 0.00 -0.00 0.00 0.00 58.31 57.98 1y1m n LYS 200 Cb 0.28 -1.49 0.00 0.00 -0.00 0.00 0.00 35.03 33.81 1y1m n LYS 200 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1y1m n HIS 201 N -1.00 0.00 -1.70 5.58 8.25 0.27 -5.10 115.22 121.52 1y1m n HIS 201 Ca 0.08 -0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 57.11 1y1m n HIS 201 Cb 0.36 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1y1m n HIS 201 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1y1m n ASN 202 N -0.01 2.70 -4.96 0.41 3.02 0.71 -4.78 115.26 112.35 1y1m n ASN 202 Ca 0.00 1.15 -0.22 0.00 -0.03 0.00 0.00 54.58 55.48 1y1m n ASN 202 Cb 0.20 -1.50 0.01 0.00 -0.61 0.00 0.00 39.78 37.88 1y1m n ASN 202 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1y1m s TYR 203 N -1.15 3.25 0.19 3.10 1.51 -0.36 -4.74 117.35 119.14 1y1m s TYR 203 Ca 0.58 0.18 0.13 0.00 -1.01 0.00 0.00 57.07 56.96 1y1m s TYR 203 Cb -0.53 -2.20 0.37 0.00 -0.11 0.00 0.00 41.96 39.49 1y1m s TYR 203 CO 0.60 -0.23 1.60 1.49 -1.11 0.00 0.00 175.55 177.90 1y1m h GLU 204 N 0.53 0.00 -3.50 -0.62 4.57 -1.92 0.33 114.58 113.96 1y1m h GLU 204 Ca -0.47 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 57.65 1y1m h GLU 204 Cb 1.25 0.00 -0.13 0.00 -0.16 0.00 0.00 28.75 29.71 1y1m h GLU 204 CO 0.57 0.58 -0.14 -1.54 -1.18 0.00 0.00 179.01 177.31 1y1m s SER 205 N -6.67 -0.15 0.18 1.04 1.04 -1.26 -4.72 113.70 103.16 1y1m s SER 205 Ca -0.00 -0.46 -0.11 0.00 0.48 0.00 0.00 55.95 55.87 1y1m s SER 205 Cb 0.11 0.46 0.08 0.00 0.10 0.00 0.00 66.02 66.77 1y1m s SER 205 CO 0.74 -0.86 1.69 0.00 0.98 0.00 0.00 173.24 175.79 1y1m h ALA 206 N 2.43 0.82 -0.55 5.32 0.00 -1.96 -2.28 119.26 123.03 1y1m h ALA 206 Ca -0.33 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.42 1y1m h ALA 206 Cb 1.24 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1y1m h ALA 206 CO 0.47 0.52 0.23 0.00 0.00 0.00 0.00 179.25 180.47 1y1m h ALA 207 N 1.05 0.70 -0.64 0.00 0.00 -1.99 1.00 119.26 119.38 1y1m h ALA 207 Ca 0.20 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 1y1m h ALA 207 Cb 0.35 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1y1m h ALA 207 CO 0.00 -0.16 0.14 0.93 0.00 0.00 0.00 179.25 180.16 1y1m h GLU 208 N 0.43 1.04 -0.30 0.00 5.08 -1.93 -1.43 114.58 117.46 1y1m h GLU 208 Ca 0.26 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1y1m h GLU 208 Cb 0.27 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1y1m h GLU 208 CO -0.24 0.94 -0.01 0.00 -1.00 0.00 0.00 179.01 178.70 1y1m h ALA 209 N 1.05 0.40 -0.83 3.43 0.00 -0.81 -1.00 119.26 121.51 1y1m h ALA 209 Ca 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1y1m h ALA 209 Cb 0.38 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1y1m h ALA 209 CO 0.01 0.16 0.49 0.82 0.00 0.00 0.00 179.25 180.72 1y1m h ILE 210 N 0.32 1.23 -0.52 0.00 2.04 -0.71 -1.57 117.51 118.30 1y1m h ILE 210 Ca 0.08 -0.52 -0.08 0.00 1.00 0.00 0.00 64.86 65.35 1y1m h ILE 210 Cb 0.45 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1y1m h ILE 210 CO 0.02 0.25 0.03 -0.61 0.00 0.00 0.00 178.15 177.83 1y1m h GLN 211 N 1.14 0.90 -0.30 2.37 5.75 -1.09 -2.59 115.11 121.29 1y1m h GLN 211 Ca 0.30 -0.27 0.01 0.00 -0.15 0.00 0.00 58.65 58.54 1y1m h GLN 211 Cb -0.03 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 1y1m h GLN 211 CO -0.05 0.91 0.20 0.00 -2.65 0.00 0.00 178.83 177.23 1y1m h ALA 212 N 0.96 1.84 -0.29 3.38 0.00 -0.34 -0.59 119.26 124.21 1y1m h ALA 212 Ca 0.15 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1y1m h ALA 212 Cb 0.48 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1y1m h ALA 212 CO 0.02 0.13 -0.43 0.28 0.00 0.00 0.00 179.25 179.26 1y1m h VAL 213 N 0.36 1.29 -0.03 0.00 2.07 -0.94 0.18 116.25 119.18 1y1m h VAL 213 Ca 0.12 -1.61 -0.14 0.00 0.82 0.00 0.00 66.70 65.89 1y1m h VAL 213 Cb 0.03 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1y1m h VAL 213 CO -0.03 0.52 -0.62 0.03 0.02 0.00 0.00 177.57 177.50 1y1m h ARG 214 N 0.59 0.09 -0.18 1.57 3.08 -1.09 -2.90 114.38 115.55 1y1m h ARG 214 Ca 0.04 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1y1m h ARG 214 Cb 0.98 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1y1m h ARG 214 CO 0.09 0.68 0.00 -0.25 -1.07 0.00 0.00 179.97 179.42 1y1m n ASP 215 N -3.83 1.23 -2.11 7.04 10.43 -0.31 -4.91 116.55 124.09 1y1m n ASP 215 Ca -0.02 -1.79 -0.20 0.00 2.57 0.00 0.00 54.79 55.35 1y1m n ASP 215 Cb 0.62 -0.11 -0.04 0.00 1.84 0.00 0.00 41.12 43.43 1y1m n ASP 215 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1y1m n ASN 216 N 0.09 -5.66 0.00 -2.24 3.02 -0.88 -4.83 115.26 104.77 1y1m n ASN 216 Ca 0.12 0.18 0.05 0.00 -0.03 0.00 0.00 54.58 54.90 1y1m n ASN 216 Cb 0.23 -4.81 -0.12 0.00 -0.61 0.00 0.00 39.78 34.47 1y1m n ASN 216 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1y1m n LYS 217 N -2.77 0.65 -4.44 3.52 4.76 0.53 -4.85 118.16 115.56 1y1m n LYS 217 Ca -0.23 -0.01 -0.23 0.00 -2.87 0.00 0.00 58.31 54.96 1y1m n LYS 217 Cb 0.68 -1.64 -0.17 0.00 -1.84 0.00 0.00 35.03 32.07 1y1m n LYS 217 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1y1m s LEU 218 N -5.12 1.54 0.14 -0.35 2.96 -0.67 -4.97 118.68 112.20 1y1m s LEU 218 Ca -0.06 -0.25 0.16 0.00 -0.22 0.00 0.00 54.13 53.77 1y1m s LEU 218 Cb 0.11 -0.72 -0.07 0.00 0.50 0.00 0.00 46.19 46.01 1y1m s LEU 218 CO 0.85 0.00 1.03 0.45 -1.32 0.00 0.00 176.35 177.37 1y1m h HIS 219 N 7.07 0.00 -2.67 5.38 3.86 -1.49 -3.33 115.15 123.98 1y1m h HIS 219 Ca -0.33 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 58.77 1y1m h HIS 219 Cb 1.18 0.00 -0.25 0.00 1.06 0.00 0.00 27.41 29.40 1y1m h HIS 219 CO 0.49 0.53 -0.25 0.00 0.86 0.00 0.00 177.93 179.55 1y1m s ALA 220 N -2.96 -1.06 -0.16 2.45 0.00 -0.91 -4.33 121.76 114.79 1y1m s ALA 220 Ca -0.01 1.36 0.02 0.00 0.00 0.00 0.00 51.96 53.33 1y1m s ALA 220 Cb 0.08 -0.81 0.02 0.00 0.00 0.00 0.00 23.12 22.41 1y1m s ALA 220 CO 0.79 -0.23 -0.21 0.12 0.00 0.00 0.00 175.76 176.23 1y1m s PHE 221 N 0.76 2.73 -0.23 0.00 5.36 -0.46 -1.76 117.98 124.39 1y1m s PHE 221 Ca -0.04 -1.51 -0.14 0.00 -0.96 0.00 0.00 56.93 54.28 1y1m s PHE 221 Cb -0.05 -1.87 -0.04 0.00 -0.34 0.00 0.00 43.02 40.71 1y1m s PHE 221 CO -0.06 -0.72 0.30 0.42 -1.46 0.00 0.00 175.22 173.71 1y1m s ILE 222 N 1.07 5.26 0.15 3.12 1.01 -0.41 -0.94 121.20 130.46 1y1m s ILE 222 Ca -0.01 0.49 -0.08 0.00 0.00 0.00 0.00 60.65 61.05 1y1m s ILE 222 Cb -0.14 -3.64 0.03 0.00 0.01 0.00 0.00 42.46 38.72 1y1m s ILE 222 CO -0.08 0.27 0.42 1.87 0.00 0.00 0.00 174.94 177.43 1y1m n TRP 223 N 4.52 -1.41 -1.76 3.97 -0.00 -1.04 -4.53 117.44 117.18 1y1m n TRP 223 Ca -0.11 -0.80 -0.42 0.00 -0.00 0.00 0.00 57.50 56.18 1y1m n TRP 223 Cb 0.51 0.40 -0.02 0.00 -0.00 0.00 0.00 31.31 32.19 1y1m n TRP 223 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 1y1m s ASP 224 N -2.06 6.39 0.34 5.87 -0.00 -1.26 -1.24 116.67 124.70 1y1m s ASP 224 Ca 0.09 2.88 0.07 0.00 -0.00 0.00 0.00 52.55 55.59 1y1m s ASP 224 Cb -0.02 -2.61 0.62 0.00 -0.00 0.00 0.00 42.92 40.90 1y1m s ASP 224 CO 0.05 -0.94 1.82 0.77 -0.00 0.00 0.00 175.17 176.87 1y1m h SER 225 N 6.09 0.30 0.10 0.27 4.64 -0.50 0.12 113.55 124.56 1y1m h SER 225 Ca -0.44 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 60.78 1y1m h SER 225 Cb 1.21 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1y1m h SER 225 CO 0.90 0.53 -0.07 0.00 -0.87 0.00 0.00 176.83 177.31 1y1m h ALA 226 N 1.51 1.72 0.01 5.18 0.00 -1.91 0.24 119.26 126.00 1y1m h ALA 226 Ca 0.05 -0.06 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 1y1m h ALA 226 Cb 0.53 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1y1m h ALA 226 CO 0.04 0.09 -1.53 0.28 0.00 0.00 0.00 179.25 178.12 1y1m n VAL 227 N -4.22 1.55 -0.03 0.00 0.31 -0.83 -4.12 118.33 111.00 1y1m n VAL 227 Ca -0.03 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1y1m n VAL 227 Cb 0.15 -1.99 0.30 0.00 -0.91 0.00 0.00 33.84 31.39 1y1m n VAL 227 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1y1m h LEU 228 N -0.92 0.54 -0.95 7.52 3.38 -0.65 -0.93 115.31 123.31 1y1m h LEU 228 Ca -0.41 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 1y1m h LEU 228 Cb 1.41 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 1y1m h LEU 228 CO -0.22 0.55 0.38 -0.33 0.09 0.00 0.00 178.44 178.91 1y1m h GLU 229 N 0.57 1.14 0.01 1.13 5.08 -0.74 0.10 114.58 121.88 1y1m h GLU 229 Ca 0.13 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1y1m h GLU 229 Cb 0.24 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1y1m h GLU 229 CO -0.00 0.87 -0.01 0.35 -1.00 0.00 0.00 179.01 179.23 1y1m h PHE 230 N 1.13 -0.02 -0.95 4.33 3.57 -1.57 -2.36 116.94 121.07 1y1m h PHE 230 Ca 0.27 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.90 1y1m h PHE 230 Cb 0.11 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 38.78 1y1m h PHE 230 CO 0.01 0.44 0.60 0.93 -2.23 0.00 0.00 178.31 178.07 1y1m h GLU 231 N -0.48 0.84 -0.40 1.11 4.39 -0.95 -1.17 114.58 117.92 1y1m h GLU 231 Ca -0.00 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.56 1y1m h GLU 231 Cb 0.47 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1y1m h GLU 231 CO 0.00 0.56 -0.09 0.00 -1.16 0.00 0.00 179.01 178.32 1y1m h ALA 232 N 1.57 0.55 0.00 3.43 0.00 -0.95 -2.75 119.26 121.12 1y1m h ALA 232 Ca 0.47 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1y1m h ALA 232 Cb 0.57 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1y1m h ALA 232 CO -0.24 0.41 -0.03 0.66 0.00 0.00 0.00 179.25 180.05 1y1m h SER 233 N 0.58 0.00 0.89 0.00 4.64 -0.68 -2.67 113.55 116.32 1y1m h SER 233 Ca 0.10 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1y1m h SER 233 Cb 0.61 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 1y1m h SER 233 CO 0.04 0.03 -1.13 0.00 -0.87 0.00 0.00 176.83 174.90 1y1m n GLN 234 N -3.29 0.61 -3.98 4.77 1.13 -0.82 -4.82 117.38 110.98 1y1m n GLN 234 Ca -0.02 0.13 -0.30 0.00 -1.94 0.00 0.00 57.00 54.88 1y1m n GLN 234 Cb 0.17 -1.81 -0.16 0.00 0.11 0.00 0.00 30.24 28.55 1y1m n GLN 234 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1y1m s LYS 235 N -3.28 1.97 0.57 -1.09 1.02 -1.00 -5.01 119.74 112.91 1y1m s LYS 235 Ca -0.01 -0.63 0.31 0.00 0.02 0.00 0.00 55.97 55.66 1y1m s LYS 235 Cb 0.10 -2.15 1.73 0.00 -0.52 0.00 0.00 37.83 36.98 1y1m s LYS 235 CO 0.80 -0.35 2.19 0.00 -0.92 0.00 0.00 175.35 177.07 1y1m n ASP 237 N -3.64 1.31 -4.25 0.00 5.75 -1.26 -4.77 116.55 109.69 1y1m n ASP 237 Ca -0.02 -1.72 -0.25 0.00 -0.01 0.00 0.00 54.79 52.79 1y1m n ASP 237 Cb 0.15 -0.10 -0.14 0.00 -1.03 0.00 0.00 41.12 40.00 1y1m n ASP 237 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1y1m s LEU 238 N -1.44 2.20 0.08 -2.12 1.02 -0.73 -1.40 118.68 116.29 1y1m s LEU 238 Ca 0.28 -0.55 -0.15 0.00 0.02 0.00 0.00 54.13 53.73 1y1m s LEU 238 Cb 0.15 -0.92 0.03 0.00 0.02 0.00 0.00 46.19 45.46 1y1m s LEU 238 CO 0.22 0.13 0.35 0.68 0.02 0.00 0.00 176.35 177.75 1y1m s VAL 239 N -0.89 0.08 0.21 -1.59 -7.23 -0.61 -4.75 120.40 105.63 1y1m s VAL 239 Ca 0.07 -0.66 -0.00 0.00 -1.81 0.00 0.00 61.98 59.58 1y1m s VAL 239 Cb -0.09 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.73 1y1m s VAL 239 CO 0.02 -0.36 0.40 0.42 -0.31 0.00 0.00 175.10 175.27 1y1m s THR 240 N -3.16 5.20 0.01 5.32 -4.23 -1.26 -1.26 115.64 116.26 1y1m s THR 240 Ca -0.01 -0.39 -0.11 0.00 -1.18 0.00 0.00 61.69 60.00 1y1m s THR 240 Cb 0.01 -3.75 0.01 0.00 1.34 0.00 0.00 72.50 70.12 1y1m s THR 240 CO -0.07 -0.21 0.24 0.28 -0.54 0.00 0.00 174.62 174.32 1y1m s THR 241 N -1.91 0.08 0.00 3.99 -1.32 -0.36 -4.94 115.64 111.19 1y1m s THR 241 Ca 0.38 -0.65 0.00 0.00 -1.21 0.00 0.00 61.69 60.22 1y1m s THR 241 Cb -0.11 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 70.22 1y1m s THR 241 CO 0.29 -0.36 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 1y1m n GLY 242 N 1.11 -1.59 3.81 6.08 0.00 -0.76 -3.85 105.19 109.99 1y1m n GLY 242 Ca -0.21 -1.55 -0.33 0.00 0.00 0.00 0.00 46.02 43.93 1y1m n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y1m s GLU 243 N -1.79 3.98 0.44 1.61 2.02 -0.19 -4.88 118.70 119.88 1y1m s GLU 243 Ca 0.00 1.21 -0.22 0.00 0.02 0.00 0.00 54.97 55.97 1y1m s GLU 243 Cb 0.00 -2.13 -0.09 0.00 0.10 0.00 0.00 34.13 32.01 1y1m s GLU 243 CO 0.00 -0.26 1.06 -0.51 0.02 0.00 0.00 175.26 175.57 1y1m s LEU 244 N -3.46 4.02 0.12 1.80 1.43 -1.26 -4.53 118.68 116.79 1y1m s LEU 244 Ca 0.64 2.02 0.04 0.00 -1.03 0.00 0.00 54.13 55.80 1y1m s LEU 244 Cb -0.12 -4.33 -0.04 0.00 0.03 0.00 0.00 46.19 41.73 1y1m s LEU 244 CO 0.19 -0.64 -0.10 0.72 0.23 0.00 0.00 176.35 176.75 1y1m s PHE 245 N -1.76 1.15 -1.02 0.29 -0.12 -0.89 -4.85 117.98 110.78 1y1m s PHE 245 Ca 0.62 -0.72 -0.12 0.00 -0.05 0.00 0.00 56.93 56.66 1y1m s PHE 245 Cb -0.21 -0.61 -0.02 0.00 -0.63 0.00 0.00 43.02 41.55 1y1m s PHE 245 CO 0.25 0.03 0.80 0.34 -0.05 0.00 0.00 175.22 176.60 1y1m n PHE 246 N 0.18 -2.25 -2.14 3.49 7.35 -1.26 -0.88 117.46 121.95 1y1m n PHE 246 Ca -0.13 0.70 -0.36 0.00 -0.76 0.00 0.00 57.45 56.90 1y1m n PHE 246 Cb 0.59 -3.69 0.01 0.00 0.35 0.00 0.00 39.48 36.74 1y1m n PHE 246 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1y1m s ARG 247 N -4.97 3.39 0.35 -4.13 0.52 -1.26 -3.28 118.95 109.57 1y1m s ARG 247 Ca 0.36 1.81 -0.17 0.00 -0.52 0.00 0.00 55.73 57.20 1y1m s ARG 247 Cb -0.10 -2.17 0.05 0.00 0.52 0.00 0.00 34.95 33.25 1y1m s ARG 247 CO 0.81 -0.87 0.77 -1.54 0.02 0.00 0.00 175.30 174.50 1y1m s SER 248 N -1.47 -0.08 0.23 0.23 1.04 -0.02 -4.92 113.70 108.72 1y1m s SER 248 Ca 0.70 -0.98 0.09 0.00 0.48 0.00 0.00 55.95 56.25 1y1m s SER 248 Cb -0.29 0.81 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 1y1m s SER 248 CO 0.34 -1.58 -0.17 -0.83 0.98 0.00 0.00 173.24 171.98 1y1m s GLY 249 N -3.03 1.60 -0.15 7.32 0.00 -1.26 -0.78 107.32 111.02 1y1m s GLY 249 Ca 0.14 -1.72 -0.05 0.00 0.00 0.00 0.00 44.72 43.09 1y1m s GLY 249 CO 0.10 -1.81 0.03 -1.36 0.00 0.00 0.00 173.10 170.06 1y1m s PHE 250 N -2.65 3.19 0.10 1.90 0.08 -0.33 -1.13 117.98 119.14 1y1m s PHE 250 Ca 0.24 0.03 -0.00 0.00 0.12 0.00 0.00 56.93 57.32 1y1m s PHE 250 Cb -0.03 -1.98 -0.04 0.00 -0.57 0.00 0.00 43.02 40.40 1y1m s PHE 250 CO 0.10 0.21 -0.01 0.20 -0.10 0.00 0.00 175.22 175.62 1y1m s GLY 251 N 0.01 0.78 0.03 4.36 0.00 -1.03 -0.77 107.32 110.70 1y1m s GLY 251 Ca 0.04 -1.36 -0.30 0.00 0.00 0.00 0.00 44.72 43.09 1y1m s GLY 251 CO 0.01 -1.38 1.07 -0.42 0.00 0.00 0.00 173.10 172.38 1y1m s ILE 252 N -3.88 4.51 -0.06 0.90 1.01 -1.26 -4.57 121.20 117.86 1y1m s ILE 252 Ca 0.15 1.80 -0.14 0.00 0.00 0.00 0.00 60.65 62.46 1y1m s ILE 252 Cb 0.07 -4.16 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 1y1m s ILE 252 CO -0.04 0.14 0.37 -0.83 0.00 0.00 0.00 174.94 174.59 1y1m s GLY 253 N 1.03 2.39 0.05 6.18 0.00 -0.64 -1.43 107.32 114.90 1y1m s GLY 253 Ca 0.55 -0.29 -0.04 0.00 0.00 0.00 0.00 44.72 44.94 1y1m s GLY 253 CO 0.29 0.23 0.05 1.06 0.00 0.00 0.00 173.10 174.73 1y1m s MET 254 N -0.57 0.60 0.66 2.90 -1.94 -0.46 -0.73 119.30 119.76 1y1m s MET 254 Ca 0.22 -0.94 -0.16 0.00 -1.71 0.00 0.00 55.69 53.10 1y1m s MET 254 Cb -0.15 0.23 0.00 0.00 2.01 0.00 0.00 34.83 36.91 1y1m s MET 254 CO 0.10 -0.14 1.13 1.03 -0.01 0.00 0.00 175.02 177.14 1y1m s ARG 255 N -3.16 2.73 0.52 2.03 0.52 -1.26 -1.14 118.95 119.18 1y1m s ARG 255 Ca -0.00 1.50 -0.21 0.00 -0.52 0.00 0.00 55.73 56.50 1y1m s ARG 255 Cb 0.02 -1.93 -0.08 0.00 0.52 0.00 0.00 34.95 33.48 1y1m s ARG 255 CO -0.07 -1.32 0.84 1.63 0.02 0.00 0.00 175.30 176.39 1y1m n LYS 256 N -2.33 0.93 -3.13 3.54 5.02 -1.26 -2.91 118.16 118.02 1y1m n LYS 256 Ca 0.11 0.35 -0.23 0.00 -2.02 0.00 0.00 58.31 56.52 1y1m n LYS 256 Cb 0.51 -1.96 0.03 0.00 -0.02 0.00 0.00 35.03 33.59 1y1m n LYS 256 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1y1m n ASP 257 N 0.12 -5.61 -4.75 4.39 10.43 -1.26 -4.97 116.55 114.90 1y1m n ASP 257 Ca 0.12 -0.32 -0.40 0.00 2.57 0.00 0.00 54.79 56.75 1y1m n ASP 257 Cb 0.44 -4.54 -0.04 0.00 1.84 0.00 0.00 41.12 38.82 1y1m n ASP 257 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 1y1m s SER 258 N -2.74 7.28 0.00 -2.24 0.15 -1.14 -4.92 113.70 110.09 1y1m s SER 258 Ca 0.34 2.21 0.19 0.00 0.70 0.00 0.00 55.95 59.39 1y1m s SER 258 Cb -0.16 -2.62 0.85 0.00 -1.71 0.00 0.00 66.02 62.38 1y1m s SER 258 CO 0.42 -0.15 1.61 -0.81 1.20 0.00 0.00 173.24 175.51 1y1m n PRO 259 N 1.51 0.07 0.07 5.44 -0.04 -1.26 -2.92 135.00 137.87 1y1m n PRO 259 Ca -0.00 0.16 0.07 0.00 -0.04 0.00 0.00 63.50 63.68 1y1m n PRO 259 Cb 0.45 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.37 1y1m n PRO 259 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1y1m n TRP 260 N -1.45 0.90 -0.07 0.54 8.01 -1.26 -4.56 117.44 119.56 1y1m n TRP 260 Ca 0.06 0.28 -0.09 0.00 -1.31 0.00 0.00 57.50 56.43 1y1m n TRP 260 Cb 0.20 -0.99 -0.03 0.00 -2.01 0.00 0.00 31.31 28.49 1y1m n TRP 260 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.69 176.46 1y1m h LYS 261 N 0.00 -0.32 -0.15 -0.99 3.64 -1.94 -1.75 116.57 115.06 1y1m h LYS 261 Ca -0.07 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1y1m h LYS 261 Cb 1.25 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 33.09 1y1m h LYS 261 CO 0.02 -0.21 -0.19 0.37 -2.27 0.00 0.00 179.45 177.17 1y1m h GLN 262 N -0.33 -0.22 0.00 1.90 5.75 -1.81 -0.50 115.11 119.91 1y1m h GLN 262 Ca 0.13 0.01 -0.10 0.00 -0.15 0.00 0.00 58.65 58.54 1y1m h GLN 262 Cb 0.55 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 1y1m h GLN 262 CO -0.47 -0.14 -0.50 -0.91 -2.65 0.00 0.00 178.83 174.16 1y1m h ASN 263 N -0.22 0.00 -0.31 -0.69 -0.26 -1.82 0.38 115.58 112.65 1y1m h ASN 263 Ca 0.11 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.80 1y1m h ASN 263 Cb 0.38 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.63 1y1m h ASN 263 CO -0.28 0.50 0.01 0.58 -1.06 0.00 0.00 177.43 177.17 1y1m h VAL 264 N 0.00 1.25 -0.52 2.81 2.07 -0.94 -1.18 116.25 119.74 1y1m h VAL 264 Ca -0.00 -0.93 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1y1m h VAL 264 Cb 0.91 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1y1m h VAL 264 CO 0.06 0.30 0.16 0.28 0.02 0.00 0.00 177.57 178.40 1y1m h SER 265 N 0.34 0.75 -0.72 0.57 0.02 -0.83 -1.76 113.55 111.92 1y1m h SER 265 Ca 0.09 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 1y1m h SER 265 Cb 0.43 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1y1m h SER 265 CO 0.01 0.76 0.29 -0.07 -1.14 0.00 0.00 176.83 176.69 1y1m h LEU 266 N 0.71 1.01 -0.30 5.07 3.38 -0.81 -0.52 115.31 123.84 1y1m h LEU 266 Ca 0.17 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1y1m h LEU 266 Cb 0.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1y1m h LEU 266 CO -0.01 0.90 0.04 -1.28 0.09 0.00 0.00 178.44 178.18 1y1m h SER 267 N 1.07 0.49 -0.56 -0.43 0.87 -1.00 -0.94 113.55 113.05 1y1m h SER 267 Ca 0.25 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 1y1m h SER 267 Cb 0.21 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 1y1m h SER 267 CO -0.02 0.64 0.25 0.40 -0.53 0.00 0.00 176.83 177.56 1y1m h ILE 268 N 0.33 1.21 -0.75 2.23 2.04 -1.03 0.24 117.51 121.77 1y1m h ILE 268 Ca 0.09 -0.63 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 1y1m h ILE 268 Cb 0.36 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1y1m h ILE 268 CO 0.01 0.25 0.34 -0.07 0.00 0.00 0.00 178.15 178.67 1y1m h LEU 269 N 0.75 1.01 -0.86 1.44 3.38 -1.00 -1.99 115.31 118.05 1y1m h LEU 269 Ca 0.19 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1y1m h LEU 269 Cb 0.16 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1y1m h LEU 269 CO -0.02 0.88 0.41 0.50 0.09 0.00 0.00 178.44 180.31 1y1m h LYS 270 N 1.07 1.24 -0.02 1.13 1.63 -0.71 -2.48 116.57 118.43 1y1m h LYS 270 Ca 0.26 -0.18 -0.07 0.00 -0.85 0.00 0.00 60.65 59.80 1y1m h LYS 270 Cb 0.16 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.56 1y1m h LYS 270 CO -0.03 0.95 -0.32 0.77 -3.45 0.00 0.00 179.45 177.37 1y1m h SER 271 N 1.23 0.04 0.78 4.20 0.02 -0.46 0.26 113.55 119.61 1y1m h SER 271 Ca 0.30 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.13 1y1m h SER 271 Cb 0.12 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1y1m h SER 271 CO -0.04 0.36 -0.48 0.45 -1.14 0.00 0.00 176.83 175.98 1y1m h HIS 272 N 0.03 0.00 0.00 3.45 3.86 -0.94 -1.48 115.15 120.07 1y1m h HIS 272 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1y1m h HIS 272 Cb 0.59 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.06 1y1m h HIS 272 CO 0.00 0.48 -1.18 0.39 0.86 0.00 0.00 177.93 178.48 1y1m n GLU 273 N -3.63 0.53 -0.25 2.45 1.02 -0.71 -4.34 120.64 115.70 1y1m n GLU 273 Ca -0.01 0.03 0.07 0.00 -0.02 0.00 0.00 57.16 57.23 1y1m n GLU 273 Cb 0.56 -1.71 0.19 0.00 -0.02 0.00 0.00 31.44 30.46 1y1m n GLU 273 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1y1m n ASN 274 N -2.40 3.22 0.00 1.62 2.04 -0.00 -4.98 115.26 114.76 1y1m n ASN 274 Ca -0.00 -2.20 0.00 0.00 -0.44 0.00 0.00 54.58 51.94 1y1m n ASN 274 Cb 0.52 -0.31 0.00 0.00 -2.53 0.00 0.00 39.78 37.46 1y1m n ASN 274 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1y1m n GLY 275 N 0.41 1.71 0.18 4.83 0.00 -1.20 -4.93 105.19 106.19 1y1m n GLY 275 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 1y1m n GLY 275 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1y1m h PHE 276 N 0.00 0.49 -0.40 1.61 3.57 -1.79 -0.37 116.94 120.05 1y1m h PHE 276 Ca 0.00 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 1y1m h PHE 276 Cb 0.00 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 1y1m h PHE 276 CO 0.00 0.29 -0.11 1.98 -2.23 0.00 0.00 178.31 178.23 1y1m h MET 277 N 0.52 0.70 -0.54 1.11 4.05 -1.62 -1.92 114.93 117.23 1y1m h MET 277 Ca 0.17 -0.23 -0.06 0.00 -0.28 0.00 0.00 59.70 59.30 1y1m h MET 277 Cb -0.00 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 1y1m h MET 277 CO -0.07 0.79 0.09 0.93 0.23 0.00 0.00 176.91 178.88 1y1m h GLU 278 N 0.64 0.86 -0.46 0.39 3.07 -1.69 -1.67 114.58 115.72 1y1m h GLU 278 Ca 0.11 -0.20 -0.08 0.00 -0.50 0.00 0.00 59.36 58.69 1y1m h GLU 278 Cb 0.57 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.34 1y1m h GLU 278 CO 0.04 0.81 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.99 1y1m h ASP 279 N 0.82 0.75 -0.34 1.42 3.32 -0.48 -1.66 116.42 120.25 1y1m h ASP 279 Ca 0.17 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 1y1m h ASP 279 Cb 0.36 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1y1m h ASP 279 CO 0.01 0.83 -0.21 -0.07 -1.72 0.00 0.00 179.24 178.07 1y1m h LEU 280 N 0.72 0.84 -0.25 1.55 3.38 -0.91 -0.99 115.31 119.66 1y1m h LEU 280 Ca 0.14 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.81 1y1m h LEU 280 Cb 0.48 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1y1m h LEU 280 CO 0.02 1.03 0.13 0.44 0.09 0.00 0.00 178.44 180.16 1y1m h ASP 281 N 0.72 0.21 -0.17 -0.43 3.45 -0.90 -0.82 116.42 118.48 1y1m h ASP 281 Ca 0.10 0.01 -0.11 0.00 0.43 0.00 0.00 57.03 57.46 1y1m h ASP 281 Cb 0.74 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 39.46 1y1m h ASP 281 CO 0.06 0.15 -0.25 0.11 -1.57 0.00 0.00 179.24 177.75 1y1m h LYS 282 N 0.28 0.63 -0.30 3.56 1.57 -1.18 -1.69 116.57 119.43 1y1m h LYS 282 Ca 0.10 -0.25 -0.17 0.00 -1.87 0.00 0.00 60.65 58.46 1y1m h LYS 282 Cb 0.01 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 1y1m h LYS 282 CO -0.06 0.82 -0.47 1.15 -0.57 0.00 0.00 179.45 180.32 1y1m h THR 283 N 0.55 1.28 -0.02 -0.16 2.02 -0.89 -3.32 112.91 112.36 1y1m h THR 283 Ca 0.08 -1.66 0.00 0.00 0.77 0.00 0.00 66.41 65.60 1y1m h THR 283 Cb 0.71 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 1y1m h THR 283 CO 0.05 0.54 -0.14 0.79 0.37 0.00 0.00 175.52 177.13 1y1m n TRP 284 N -4.02 0.00 -1.52 3.16 7.02 -0.34 -5.08 117.44 116.66 1y1m n TRP 284 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.45 1y1m n TRP 284 Cb 0.58 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.47 1y1m n TRP 284 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95