#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1smn s ILE 6 N 0.00 4.55 -0.39 0.44 1.01 -1.26 -5.04 121.20 120.50 1smn s ILE 6 Ca 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.14 1smn s ILE 6 Cb 0.00 -3.30 0.05 0.00 0.01 0.00 0.00 42.46 39.22 1smn s ILE 6 CO 0.00 0.09 0.22 -0.62 0.00 0.00 0.00 174.94 174.64 1smn s ASP 7 N 1.61 5.66 0.00 3.58 -1.08 -1.26 -4.92 116.67 120.27 1smn s ASP 7 Ca 0.05 -1.24 0.22 0.00 -0.52 0.00 0.00 52.55 51.06 1smn s ASP 7 Cb -0.17 -2.00 0.57 0.00 -1.46 0.00 0.00 42.92 39.86 1smn s ASP 7 CO 0.06 -0.45 1.48 0.59 0.52 0.00 0.00 175.17 177.37 1smn n ASN 8 N 4.95 3.77 -0.02 -0.34 3.02 -1.26 -4.46 115.26 120.92 1smn n ASN 8 Ca -0.11 -1.99 -0.02 0.00 -0.03 0.00 0.00 54.58 52.43 1smn n ASN 8 Cb 0.44 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 1smn n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1smn n ALA 10 N -2.12 0.00 -1.67 0.00 0.00 -1.26 -4.14 120.51 111.31 1smn n ALA 10 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.45 1smn n ALA 10 Cb 0.60 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.24 1smn n ALA 10 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1smn n VAL 11 N 0.00 1.96 -0.05 0.00 0.24 -1.26 -5.04 118.33 114.18 1smn n VAL 11 Ca 0.00 -2.96 0.00 0.00 -2.04 0.00 0.00 64.34 59.34 1smn n VAL 11 Cb 0.00 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.26 1smn n VAL 11 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1smn n GLY 12 N -0.96 0.85 3.72 7.63 0.00 -1.26 -0.64 105.19 114.53 1smn n GLY 12 Ca 0.17 -1.12 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 1smn n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1smn s PRO 14 N -4.74 2.96 0.27 0.00 0.02 -1.26 -4.21 135.00 128.04 1smn s PRO 14 Ca 0.64 1.99 0.08 0.00 0.02 0.00 0.00 61.00 63.73 1smn s PRO 14 Cb -0.20 -2.03 -0.04 0.00 0.02 0.00 0.00 34.50 32.25 1smn s PRO 14 CO 0.56 -1.26 0.17 0.95 -0.33 0.00 0.00 177.00 177.10 1smn s THR 15 N -1.46 4.09 0.00 0.99 -4.23 -0.65 -4.67 115.64 109.71 1smn s THR 15 Ca 0.76 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.78 1smn s THR 15 Cb -0.35 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.23 1smn s THR 15 CO 0.39 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 1smn n GLY 16 N -1.16 0.38 3.77 3.99 0.00 -1.26 -1.44 105.19 109.47 1smn n GLY 16 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1smn n GLY 16 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1smn s GLY 17 N -1.42 2.45 0.54 -0.02 0.00 -1.26 -4.74 107.32 102.88 1smn s GLY 17 Ca 0.00 0.72 0.27 0.00 0.00 0.00 0.00 44.72 45.71 1smn s GLY 17 CO 0.00 1.07 2.13 1.48 0.00 0.00 0.00 173.10 177.78 1smn h SER 18 N 0.76 0.00 -2.90 1.64 4.64 -1.93 -3.42 113.55 112.34 1smn h SER 18 Ca -0.49 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.20 1smn h SER 18 Cb 1.26 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.29 1smn h SER 18 CO 0.56 0.08 -0.51 -0.44 -0.87 0.00 0.00 176.83 175.65 1smn s SER 19 N -6.25 6.25 0.15 4.97 0.01 -1.25 -4.99 113.70 112.59 1smn s SER 19 Ca -0.04 0.27 0.24 0.00 1.31 0.00 0.00 55.95 57.73 1smn s SER 19 Cb 0.14 -1.92 0.26 0.00 0.21 0.00 0.00 66.02 64.72 1smn s SER 19 CO 0.58 0.22 1.27 0.78 0.41 0.00 0.00 173.24 176.50 1smn h ASN 20 N 3.47 0.00 -3.62 2.44 -0.26 -1.94 -3.45 115.58 112.22 1smn h ASN 20 Ca -0.47 -0.16 -0.67 0.00 -0.56 0.00 0.00 56.30 54.44 1smn h ASN 20 Cb 1.17 0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 38.21 1smn h ASN 20 CO 0.71 0.08 -0.72 -0.69 -1.06 0.00 0.00 177.43 175.75 1smn s VAL 21 N -3.21 3.45 0.15 2.81 1.01 -1.26 -5.12 120.40 118.23 1smn s VAL 21 Ca 0.05 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.56 1smn s VAL 21 Cb 0.12 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1smn s VAL 21 CO 0.74 0.56 -0.12 -0.44 0.00 0.00 0.00 175.10 175.84 1smn s SER 22 N -0.35 4.15 -0.08 3.32 0.01 -1.26 -4.63 113.70 114.87 1smn s SER 22 Ca 0.04 -0.55 -0.21 0.00 1.31 0.00 0.00 55.95 56.54 1smn s SER 22 Cb -0.12 -0.68 -0.04 0.00 0.21 0.00 0.00 66.02 65.39 1smn s SER 22 CO 0.02 0.13 0.61 -0.63 0.41 0.00 0.00 173.24 173.79 1smn s ILE 23 N -1.49 5.08 -0.17 1.44 -1.09 0.43 -4.90 121.20 120.50 1smn s ILE 23 Ca 0.22 1.25 -0.01 0.00 -2.23 0.00 0.00 60.65 59.89 1smn s ILE 23 Cb -0.10 -3.95 -0.01 0.00 -1.58 0.00 0.00 42.46 36.83 1smn s ILE 23 CO 0.14 0.30 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.33 1smn s VAL 24 N 0.61 2.93 0.30 2.92 1.01 -1.26 -0.70 120.40 126.21 1smn s VAL 24 Ca 0.33 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.67 1smn s VAL 24 Cb -0.17 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1smn s VAL 24 CO 0.15 0.49 0.17 -0.13 0.00 0.00 0.00 175.10 175.79 1smn s ARG 25 N 0.91 1.57 0.22 2.72 0.52 0.64 -5.00 118.95 120.53 1smn s ARG 25 Ca -0.03 -1.89 0.05 0.00 -0.52 0.00 0.00 55.73 53.34 1smn s ARG 25 Cb -0.15 -0.00 0.17 0.00 0.52 0.00 0.00 34.95 35.49 1smn s ARG 25 CO -0.01 -0.47 1.50 0.45 0.02 0.00 0.00 175.30 176.80 1smn h HIS 26 N 2.25 0.22 -0.24 -0.53 3.86 -1.99 -3.12 115.15 115.60 1smn h HIS 26 Ca -0.33 -0.10 -0.13 0.00 -1.16 0.00 0.00 60.37 58.65 1smn h HIS 26 Cb 1.25 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.67 1smn h HIS 26 CO 1.04 0.81 -0.40 0.00 0.86 0.00 0.00 177.93 180.24 1smn h ALA 27 N 1.16 0.85 -1.45 2.45 0.00 -1.92 -3.47 119.26 116.88 1smn h ALA 27 Ca -0.02 -0.44 0.37 0.00 0.00 0.00 0.00 54.91 54.83 1smn h ALA 27 Cb 1.25 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.82 1smn h ALA 27 CO 0.10 0.64 0.94 1.52 0.00 0.00 0.00 179.25 182.46 1smn s TYR 28 N -4.26 -0.01 -0.07 0.00 -0.85 -1.18 -4.66 117.35 106.33 1smn s TYR 28 Ca -0.08 -0.04 0.06 0.00 -0.52 0.00 0.00 57.07 56.49 1smn s TYR 28 Cb 0.12 0.52 -0.01 0.00 0.38 0.00 0.00 41.96 42.98 1smn s TYR 28 CO 0.82 -0.12 -0.25 0.99 -1.52 0.00 0.00 175.55 175.48 1smn s THR 29 N -2.12 2.07 0.01 -3.49 2.01 -0.21 -0.26 115.64 113.65 1smn s THR 29 Ca 0.20 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 61.16 1smn s THR 29 Cb 0.05 -1.75 -0.01 0.00 0.01 0.00 0.00 72.50 70.79 1smn s THR 29 CO -0.05 0.57 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.18 1smn s LEU 30 N -0.04 2.11 -0.23 4.42 0.20 0.13 -0.63 118.68 124.64 1smn s LEU 30 Ca -0.07 -0.26 0.01 0.00 0.69 0.00 0.00 54.13 54.50 1smn s LEU 30 Cb -0.15 -0.15 0.04 0.00 -0.43 0.00 0.00 46.19 45.50 1smn s LEU 30 CO 0.05 -0.07 -0.13 0.21 -0.29 0.00 0.00 176.35 176.12 1smn s ASN 31 N -0.69 3.90 0.35 3.68 3.84 -0.82 -0.43 114.94 124.77 1smn s ASN 31 Ca -0.04 -0.97 -0.15 0.00 0.21 0.00 0.00 52.86 51.91 1smn s ASN 31 Cb -0.05 -1.55 -0.09 0.00 -0.55 0.00 0.00 41.25 39.01 1smn s ASN 31 CO -0.00 -0.10 0.77 0.21 -2.79 0.00 0.00 177.10 175.19 1smn s ASN 32 N 1.23 6.75 -0.30 -4.21 2.47 -1.26 0.41 114.94 120.03 1smn s ASN 32 Ca -0.01 1.31 -0.02 0.00 0.42 0.00 0.00 52.86 54.56 1smn s ASN 32 Cb -0.16 -2.39 0.05 0.00 -1.45 0.00 0.00 41.25 37.30 1smn s ASN 32 CO -0.08 -0.26 0.01 0.21 -3.72 0.00 0.00 177.10 173.26 1smn s ASN 33 N -2.41 4.92 0.23 -4.21 3.84 -1.02 -3.87 114.94 112.43 1smn s ASN 33 Ca 0.55 -1.27 0.23 0.00 0.21 0.00 0.00 52.86 52.58 1smn s ASN 33 Cb -0.10 -1.72 0.94 0.00 -0.55 0.00 0.00 41.25 39.81 1smn s ASN 33 CO 0.19 -0.27 1.70 -1.54 -2.79 0.00 0.00 177.10 174.40 1smn n SER 34 N 4.63 0.62 -0.07 -4.21 3.41 -1.26 -1.18 113.62 115.56 1smn n SER 34 Ca -0.13 0.64 -0.19 0.00 -0.26 0.00 0.00 58.87 58.93 1smn n SER 34 Cb 0.43 -0.78 -0.12 0.00 -0.26 0.00 0.00 64.21 63.48 1smn n SER 34 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1smn h THR 35 N 0.00 1.30 0.00 6.66 2.02 -1.93 -3.38 112.91 117.58 1smn h THR 35 Ca 0.00 -2.28 -0.14 0.00 0.77 0.00 0.00 66.41 64.76 1smn h THR 35 Cb 0.40 2.78 -0.02 0.00 -1.74 0.00 0.00 68.15 69.57 1smn h THR 35 CO 0.00 0.49 -0.67 0.71 0.37 0.00 0.00 175.52 176.42 1smn h THR 36 N -0.91 1.17 0.00 3.16 1.35 -1.87 -3.38 112.91 112.44 1smn h THR 36 Ca -0.20 -2.60 0.00 0.00 -0.55 0.00 0.00 66.41 63.06 1smn h THR 36 Cb 1.24 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 1smn h THR 36 CO -0.09 0.66 0.00 0.29 -0.25 0.00 0.00 175.52 176.13 1smn n LYS 37 N -3.29 0.00 -4.43 4.72 4.76 -0.32 -2.06 118.16 117.54 1smn n LYS 37 Ca 0.01 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.17 1smn n LYS 37 Cb 0.79 -2.19 -0.13 0.00 -1.84 0.00 0.00 35.03 31.66 1smn n LYS 37 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1smn s PHE 38 N -2.78 2.20 0.40 2.13 0.08 -1.23 -4.18 117.98 114.60 1smn s PHE 38 Ca 0.00 -0.39 -0.26 0.00 0.12 0.00 0.00 56.93 56.40 1smn s PHE 38 Cb 0.00 -1.21 -0.09 0.00 -0.57 0.00 0.00 43.02 41.15 1smn s PHE 38 CO 0.00 0.29 1.33 0.00 -0.10 0.00 0.00 175.22 176.74 1smn s ALA 39 N -1.05 3.31 0.18 5.36 0.00 -1.26 -2.42 121.76 125.88 1smn s ALA 39 Ca 0.12 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.30 1smn s ALA 39 Cb -0.10 -3.51 0.07 0.00 0.00 0.00 0.00 23.12 19.58 1smn s ALA 39 CO 0.05 -0.86 1.52 -0.91 0.00 0.00 0.00 175.76 175.57 1smn h ASN 40 N 2.76 0.83 -4.87 0.00 2.35 -0.31 -3.40 115.58 112.94 1smn h ASN 40 Ca -0.50 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 54.87 1smn h ASN 40 Cb 1.25 -0.23 -0.16 0.00 0.05 0.00 0.00 38.32 39.22 1smn h ASN 40 CO 0.63 1.13 0.27 -1.66 -1.65 0.00 0.00 177.43 176.15 1smn s TRP 41 N -4.33 -0.54 -0.05 1.19 1.48 -1.21 -4.25 118.94 111.23 1smn s TRP 41 Ca -0.09 0.62 -0.00 0.00 -1.06 0.00 0.00 56.10 55.56 1smn s TRP 41 Cb 0.12 0.49 0.03 0.00 -1.16 0.00 0.00 33.47 32.95 1smn s TRP 41 CO 0.86 -0.68 0.00 0.08 -4.06 0.00 0.00 176.95 173.16 1smn s VAL 42 N -2.52 0.25 -0.12 -0.66 1.01 -0.00 -1.94 120.40 116.42 1smn s VAL 42 Ca -0.03 0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1smn s VAL 42 Cb -0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 1smn s VAL 42 CO -0.03 0.20 -0.11 0.00 0.00 0.00 0.00 175.10 175.16 1smn s ALA 43 N 1.48 2.73 0.11 5.51 0.00 0.20 -0.80 121.76 130.99 1smn s ALA 43 Ca -0.03 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 1smn s ALA 43 Cb -0.13 -1.24 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 1smn s ALA 43 CO -0.03 0.32 0.03 1.52 0.00 0.00 0.00 175.76 177.60 1smn s TYR 44 N 0.10 0.79 -0.24 0.00 1.13 0.02 -1.05 117.35 118.09 1smn s TYR 44 Ca -0.05 -1.19 -0.01 0.00 -1.41 0.00 0.00 57.07 54.41 1smn s TYR 44 Cb -0.14 -0.46 0.07 0.00 -1.10 0.00 0.00 41.96 40.33 1smn s TYR 44 CO 0.04 -0.48 0.04 -1.58 -2.51 0.00 0.00 175.55 171.07 1smn s HIS 45 N -4.00 1.55 0.06 -3.49 2.46 -1.26 -1.10 115.29 109.50 1smn s HIS 45 Ca 0.20 -1.36 -0.20 0.00 0.47 0.00 0.00 55.06 54.17 1smn s HIS 45 Cb 0.08 -1.39 -0.06 0.00 -0.13 0.00 0.00 32.58 31.07 1smn s HIS 45 CO -0.01 -0.74 0.60 0.42 -2.47 0.00 0.00 174.74 172.54 1smn s ILE 46 N 1.68 4.76 0.31 0.89 1.01 0.66 -4.92 121.20 125.59 1smn s ILE 46 Ca 0.02 1.28 0.04 0.00 0.00 0.00 0.00 60.65 61.98 1smn s ILE 46 Cb -0.17 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 1smn s ILE 46 CO -0.14 0.51 0.18 0.42 0.00 0.00 0.00 174.94 175.91 1smn s THR 47 N -0.81 0.25 0.55 2.92 -4.23 -1.26 -1.29 115.64 111.77 1smn s THR 47 Ca 0.30 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.05 1smn s THR 47 Cb -0.19 -2.49 0.35 0.00 1.34 0.00 0.00 72.50 71.50 1smn s THR 47 CO 0.19 0.00 2.09 0.11 -0.54 0.00 0.00 174.62 176.47 1smn h LYS 48 N 2.18 0.00 -0.01 3.99 1.79 -1.86 -1.84 116.57 120.82 1smn h LYS 48 Ca -0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 1smn h LYS 48 Cb 1.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1smn h LYS 48 CO 0.49 0.00 -0.33 -0.25 -1.08 0.00 0.00 179.45 178.28 1smn n ASP 49 N -4.21 0.85 0.03 0.86 8.00 -1.26 -4.43 116.55 116.38 1smn n ASP 49 Ca 0.03 -0.68 -0.04 0.00 0.71 0.00 0.00 54.79 54.81 1smn n ASP 49 Cb 0.34 0.16 -0.10 0.00 -0.02 0.00 0.00 41.12 41.51 1smn n ASP 49 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1smn h THR 50 N 0.82 0.80 -4.09 -3.53 1.35 -1.57 -3.43 112.91 103.26 1smn h THR 50 Ca 0.00 -2.44 -0.52 0.00 -0.55 0.00 0.00 66.41 62.91 1smn h THR 50 Cb 0.50 2.31 0.10 0.00 -1.73 0.00 0.00 68.15 69.32 1smn h THR 50 CO 0.00 0.46 0.46 -2.84 -0.25 0.00 0.00 175.52 173.34 1smn s PRO 51 N -2.79 3.15 -0.28 4.72 0.02 -0.96 0.40 135.00 139.27 1smn s PRO 51 Ca -0.02 1.74 -0.16 0.00 0.02 0.00 0.00 61.00 62.58 1smn s PRO 51 Cb 0.08 -1.97 0.10 0.00 0.02 0.00 0.00 34.50 32.73 1smn s PRO 51 CO 0.81 -1.04 0.78 0.00 -0.33 0.00 0.00 177.00 177.22 1smn s ALA 52 N -1.66 -2.02 0.35 -1.55 0.00 -0.54 -4.24 121.76 112.10 1smn s ALA 52 Ca 0.75 2.35 0.07 0.00 0.00 0.00 0.00 51.96 55.14 1smn s ALA 52 Cb -0.28 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 1smn s ALA 52 CO 0.31 -0.38 0.36 -1.54 0.00 0.00 0.00 175.76 174.50 1smn s SER 53 N 1.58 5.45 -0.86 0.00 1.04 -1.26 -4.48 113.70 115.17 1smn s SER 53 Ca -0.10 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.89 1smn s SER 53 Cb -0.05 -0.98 0.00 0.00 0.10 0.00 0.00 66.02 65.09 1smn s SER 53 CO -0.18 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.23 1smn n GLY 54 N -1.48 1.00 3.85 7.32 0.00 -1.26 -5.01 105.19 109.60 1smn n GLY 54 Ca -0.00 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 1smn n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1smn s LYS 55 N -2.57 3.99 0.65 1.61 -0.14 -1.26 -5.06 119.74 116.97 1smn s LYS 55 Ca 0.00 0.71 -0.09 0.00 -1.36 0.00 0.00 55.97 55.24 1smn s LYS 55 Cb 0.00 -2.37 0.01 0.00 -1.68 0.00 0.00 37.83 33.79 1smn s LYS 55 CO 0.00 0.07 1.00 0.95 -0.76 0.00 0.00 175.35 176.61 1smn s THR 56 N -2.12 3.59 -0.66 2.17 -4.23 -1.26 -5.05 115.64 108.08 1smn s THR 56 Ca 0.55 0.26 0.00 0.00 -1.18 0.00 0.00 61.69 61.32 1smn s THR 56 Cb -0.10 -3.47 0.16 0.00 1.34 0.00 0.00 72.50 70.43 1smn s THR 56 CO 0.20 -0.56 0.46 -0.13 -0.54 0.00 0.00 174.62 174.05 1smn s ARG 57 N -5.18 2.53 -0.72 3.99 0.52 -1.26 -5.02 118.95 113.82 1smn s ARG 57 Ca 0.56 -2.81 -0.16 0.00 -0.52 0.00 0.00 55.73 52.80 1smn s ARG 57 Cb -0.11 -3.62 0.16 0.00 0.52 0.00 0.00 34.95 31.90 1smn s ARG 57 CO 0.49 -1.19 0.74 -0.80 0.02 0.00 0.00 175.30 174.55 1smn s ASN 58 N -0.02 6.47 0.50 0.23 0.02 -1.26 -5.04 114.94 115.84 1smn s ASN 58 Ca 0.20 -2.10 -0.23 0.00 -1.02 0.00 0.00 52.86 49.71 1smn s ASN 58 Cb -0.17 -2.26 -0.07 0.00 0.02 0.00 0.00 41.25 38.77 1smn s ASN 58 CO -0.06 -0.83 1.26 0.79 0.02 0.00 0.00 177.10 178.28 1smn n TRP 59 N 5.17 2.01 -3.54 2.20 5.03 -1.26 -4.76 117.44 122.29 1smn n TRP 59 Ca 0.03 0.46 -0.17 0.00 3.03 0.00 0.00 57.50 60.85 1smn n TRP 59 Cb 0.45 -2.34 -0.06 0.00 -1.03 0.00 0.00 31.31 28.33 1smn n TRP 59 CO 0.00 0.00 0.00 0.21 -0.03 0.00 0.00 177.69 177.87 1smn s LYS 60 N -2.58 1.01 0.16 -0.99 2.20 -1.05 -4.87 119.74 113.63 1smn s LYS 60 Ca 0.68 0.42 -0.31 0.00 -0.36 0.00 0.00 55.97 56.40 1smn s LYS 60 Cb -0.45 0.48 -0.09 0.00 -1.51 0.00 0.00 37.83 36.25 1smn s LYS 60 CO 0.53 -0.28 1.45 0.99 -0.36 0.00 0.00 175.35 177.67 1smn s THR 61 N -0.84 2.96 0.01 3.43 2.01 -1.26 -0.18 115.64 121.76 1smn s THR 61 Ca -0.09 0.72 -0.30 0.00 0.31 0.00 0.00 61.69 62.33 1smn s THR 61 Cb -0.01 -3.46 -0.08 0.00 0.01 0.00 0.00 72.50 68.96 1smn s THR 61 CO 0.08 0.07 1.91 -0.62 -0.69 0.00 0.00 174.62 175.37 1smn s ASP 62 N 0.89 6.47 0.06 3.53 -1.08 -1.26 -4.83 116.67 120.45 1smn s ASP 62 Ca 0.64 2.57 0.21 0.00 -0.52 0.00 0.00 52.55 55.46 1smn s ASP 62 Cb -0.40 -2.53 0.87 0.00 -1.46 0.00 0.00 42.92 39.40 1smn s ASP 62 CO 0.34 -1.05 1.67 -0.81 0.52 0.00 0.00 175.17 175.84 1smn n PRO 63 N 7.49 0.06 0.02 4.34 -0.04 -1.26 -2.48 135.00 143.13 1smn n PRO 63 Ca 0.20 0.20 0.13 0.00 -0.04 0.00 0.00 63.50 63.99 1smn n PRO 63 Cb 0.41 -1.59 0.39 0.00 -0.04 0.00 0.00 33.50 32.68 1smn n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1smn n ALA 64 N -1.57 2.87 -2.75 0.55 0.00 -1.26 -4.88 120.51 113.48 1smn n ALA 64 Ca 0.04 -0.21 -0.23 0.00 0.00 0.00 0.00 53.44 53.05 1smn n ALA 64 Cb 0.25 -1.29 -0.06 0.00 0.00 0.00 0.00 19.45 18.35 1smn n ALA 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1smn s LEU 65 N -3.32 3.56 0.13 0.00 1.43 -1.03 -5.08 118.68 114.37 1smn s LEU 65 Ca 0.11 -0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 52.51 1smn s LEU 65 Cb 0.17 -2.10 -0.07 0.00 0.03 0.00 0.00 46.19 44.22 1smn s LEU 65 CO 0.63 -0.01 1.25 0.21 0.23 0.00 0.00 176.35 178.65 1smn s ASN 66 N -3.72 7.02 0.61 2.29 3.84 -1.26 -4.90 114.94 118.82 1smn s ASN 66 Ca 0.32 2.20 0.30 0.00 0.21 0.00 0.00 52.86 55.88 1smn s ASN 66 Cb -0.07 -2.59 1.61 0.00 -0.55 0.00 0.00 41.25 39.64 1smn s ASN 66 CO 0.23 -0.47 1.99 1.55 -2.79 0.00 0.00 177.10 177.60 1smn h PRO 67 N 6.07 0.00 0.00 0.43 0.13 -1.91 -1.31 132.00 135.41 1smn h PRO 67 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1smn h PRO 67 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1smn h PRO 67 CO 0.79 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.56 1smn h ALA 68 N 1.55 1.00 -0.52 -0.56 0.00 -2.00 -3.29 119.26 115.43 1smn h ALA 68 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1smn h ALA 68 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1smn h ALA 68 CO -0.00 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 1smn n ASP 69 N -2.44 3.64 -3.94 0.00 8.00 -0.49 -4.97 116.55 116.34 1smn n ASP 69 Ca 0.04 -1.99 -0.10 0.00 0.71 0.00 0.00 54.79 53.46 1smn n ASP 69 Cb 0.40 -0.34 -0.06 0.00 -0.02 0.00 0.00 41.12 41.10 1smn n ASP 69 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1smn s THR 70 N -1.27 0.04 0.46 -3.53 -1.32 -1.24 -4.38 115.64 104.40 1smn s THR 70 Ca 0.42 -1.32 -0.03 0.00 -1.21 0.00 0.00 61.69 59.55 1smn s THR 70 Cb 0.23 -1.90 -0.03 0.00 -1.51 0.00 0.00 72.50 69.30 1smn s THR 70 CO 0.32 -0.19 0.73 -0.76 -2.21 0.00 0.00 174.62 172.50 1smn s LEU 71 N -2.97 3.68 0.26 9.08 1.43 -1.26 -4.93 118.68 123.97 1smn s LEU 71 Ca 0.18 0.70 0.10 0.00 -1.03 0.00 0.00 54.13 54.08 1smn s LEU 71 Cb 0.02 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.59 1smn s LEU 71 CO 0.02 -0.58 -0.10 0.00 0.23 0.00 0.00 176.35 175.92 1smn s ALA 72 N -2.64 2.96 0.36 4.21 0.00 -1.26 -4.59 121.76 120.79 1smn s ALA 72 Ca 0.46 -1.71 0.11 0.00 0.00 0.00 0.00 51.96 50.83 1smn s ALA 72 Cb -0.10 -0.57 0.90 0.00 0.00 0.00 0.00 23.12 23.35 1smn s ALA 72 CO 0.42 0.31 1.83 -1.35 0.00 0.00 0.00 175.76 176.96 1smn h PRO 73 N 2.23 0.59 0.00 0.00 0.11 -1.89 0.56 132.00 133.59 1smn h PRO 73 Ca -0.43 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1smn h PRO 73 Cb 1.24 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1smn h PRO 73 CO 0.59 0.39 -0.00 0.00 -0.21 0.00 0.00 178.00 178.76 1smn h ALA 74 N 1.61 1.95 0.00 -0.75 0.00 -1.96 -2.61 119.26 117.51 1smn h ALA 74 Ca 0.51 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 1smn h ALA 74 Cb 0.98 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1smn h ALA 74 CO -0.26 0.00 -0.04 -0.44 0.00 0.00 0.00 179.25 178.52 1smn h ASP 75 N 0.00 0.00 0.05 0.00 3.32 -1.09 -2.49 116.42 116.21 1smn h ASP 75 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1smn h ASP 75 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1smn h ASP 75 CO 0.00 0.04 -0.03 -1.22 -1.72 0.00 0.00 179.24 176.31 1smn n TYR 76 N -3.37 0.00 -1.69 4.55 4.02 -0.98 -4.08 117.16 115.60 1smn n TYR 76 Ca -0.02 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.44 1smn n TYR 76 Cb 0.17 -0.03 -0.03 0.00 -0.02 0.00 0.00 39.34 39.43 1smn n TYR 76 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1smn n THR 77 N -0.37 0.17 -0.79 -0.72 -1.04 -0.94 -1.39 114.28 109.21 1smn n THR 77 Ca 0.20 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1smn n THR 77 Cb 0.27 -1.93 0.00 0.00 -1.82 0.00 0.00 70.33 66.86 1smn n THR 77 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1smn n GLY 78 N 3.97 1.27 0.19 3.41 0.00 -1.26 -2.87 105.19 109.89 1smn n GLY 78 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1smn n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1smn h ALA 79 N 0.00 0.48 -0.33 4.61 0.00 -1.57 -1.35 119.26 121.10 1smn h ALA 79 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1smn h ALA 79 Cb 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1smn h ALA 79 CO 0.00 0.13 0.22 -0.97 0.00 0.00 0.00 179.25 178.63 1smn h ASN 80 N 0.44 0.38 -0.48 0.00 -0.73 -1.79 0.38 115.58 113.78 1smn h ASN 80 Ca 0.12 -0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.25 1smn h ASN 80 Cb 0.28 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.75 1smn h ASN 80 CO -0.00 0.28 0.23 0.00 -0.37 0.00 0.00 177.43 177.57 1smn h ALA 81 N 1.12 0.62 -0.01 1.57 0.00 -1.87 0.32 119.26 121.01 1smn h ALA 81 Ca 0.12 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1smn h ALA 81 Cb -0.05 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.57 1smn h ALA 81 CO -0.03 0.18 -0.71 0.00 0.00 0.00 0.00 179.25 178.69 1smn h ALA 82 N 1.07 0.10 -0.00 0.00 0.00 -1.10 -3.40 119.26 115.93 1smn h ALA 82 Ca 0.16 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1smn h ALA 82 Cb 0.12 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1smn h ALA 82 CO -0.02 0.44 -0.21 1.28 0.00 0.00 0.00 179.25 180.73 1smn n LEU 83 N -4.13 0.57 -3.43 0.00 4.77 0.11 -5.01 117.00 109.88 1smn n LEU 83 Ca -0.10 -0.61 -0.20 0.00 -0.03 0.00 0.00 56.01 55.06 1smn n LEU 83 Cb 0.72 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.90 1smn n LEU 83 CO 0.49 0.13 0.17 1.17 -1.33 0.00 0.00 177.39 178.02 1smn n LYS 84 N -0.79 -7.07 -4.26 3.23 3.00 0.11 -4.93 118.16 107.45 1smn n LYS 84 Ca 0.02 0.82 -0.27 0.00 -0.00 0.00 0.00 58.31 58.87 1smn n LYS 84 Cb 0.11 -5.78 -0.09 0.00 0.00 0.00 0.00 35.03 29.27 1smn n LYS 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1smn s VAL 85 N -3.33 3.31 0.33 3.15 -7.23 -1.26 -1.61 120.40 113.76 1smn s VAL 85 Ca 0.27 -1.55 0.09 0.00 -1.81 0.00 0.00 61.98 58.98 1smn s VAL 85 Cb -0.12 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 1smn s VAL 85 CO 0.71 -0.07 0.04 -1.81 -0.31 0.00 0.00 175.10 173.66 1smn s ASP 86 N -2.73 4.35 -0.87 4.85 1.01 0.97 -3.83 116.67 120.41 1smn s ASP 86 Ca 0.25 -0.89 -0.24 0.00 0.71 0.00 0.00 52.55 52.37 1smn s ASP 86 Cb -0.09 -0.62 0.05 0.00 1.01 0.00 0.00 42.92 43.27 1smn s ASP 86 CO 0.15 -0.22 1.32 -0.13 0.21 0.00 0.00 175.17 176.51 1smn s ARG 87 N -3.74 3.39 0.04 8.23 0.52 -1.26 -1.69 118.95 124.44 1smn s ARG 87 Ca 0.35 -0.79 -0.18 0.00 -0.52 0.00 0.00 55.73 54.59 1smn s ARG 87 Cb -0.02 -4.77 -0.06 0.00 0.52 0.00 0.00 34.95 30.62 1smn s ARG 87 CO 0.20 -2.12 0.53 0.20 0.02 0.00 0.00 175.30 174.12 1smn s GLY 88 N 4.29 2.60 0.31 -3.53 0.00 -0.21 -4.90 107.32 105.88 1smn s GLY 88 Ca 0.39 -0.04 -0.27 0.00 0.00 0.00 0.00 44.72 44.80 1smn s GLY 88 CO 0.02 0.43 0.97 0.30 0.00 0.00 0.00 173.10 174.82 1smn s HIS 89 N -0.92 3.70 0.00 1.90 3.76 -1.26 -1.93 115.29 120.53 1smn s HIS 89 Ca 0.28 1.79 0.00 0.00 -0.15 0.00 0.00 55.06 56.98 1smn s HIS 89 Cb -0.18 -3.00 0.00 0.00 1.11 0.00 0.00 32.58 30.51 1smn s HIS 89 CO 0.17 0.09 0.00 1.04 -0.85 0.00 0.00 174.74 175.19 1smn n GLN 90 N 0.77 0.00 -2.45 1.40 6.02 0.53 -4.75 117.38 118.91 1smn n GLN 90 Ca 0.01 0.31 -0.42 0.00 -0.01 0.00 0.00 57.00 56.89 1smn n GLN 90 Cb 0.49 -0.79 -0.03 0.00 1.02 0.00 0.00 30.24 30.93 1smn n GLN 90 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1smn s ALA 91 N -3.23 3.41 0.28 -1.58 0.00 -1.26 -4.97 121.76 114.40 1smn s ALA 91 Ca 0.00 0.76 -0.29 0.00 0.00 0.00 0.00 51.96 52.42 1smn s ALA 91 Cb 0.00 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.56 1smn s ALA 91 CO 0.00 -0.54 1.26 -1.25 0.00 0.00 0.00 175.76 175.23 1smn s PRO 92 N 1.46 4.43 0.02 0.00 0.04 -1.26 -4.98 135.00 134.71 1smn s PRO 92 Ca 0.58 2.07 -0.27 0.00 0.04 0.00 0.00 61.00 63.42 1smn s PRO 92 Cb -0.27 -3.14 -0.16 0.00 0.04 0.00 0.00 34.50 30.97 1smn s PRO 92 CO 0.27 -0.11 1.21 1.25 0.04 0.00 0.00 177.00 179.65 1smn h LEU 93 N 4.11 -0.65 -1.72 -3.56 5.85 -1.93 -3.12 115.31 114.28 1smn h LEU 93 Ca -0.47 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.18 1smn h LEU 93 Cb 1.22 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.41 1smn h LEU 93 CO 0.69 -0.30 -0.16 0.00 -0.34 0.00 0.00 178.44 178.34 1smn h ALA 94 N -0.83 1.65 0.00 1.25 0.00 -1.94 0.77 119.26 120.16 1smn h ALA 94 Ca -0.08 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1smn h ALA 94 Cb 0.65 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1smn h ALA 94 CO 0.13 0.20 -0.20 0.77 0.00 0.00 0.00 179.25 180.15 1smn h SER 95 N 0.00 0.00 0.00 0.00 0.02 -1.84 -1.43 113.55 110.30 1smn h SER 95 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1smn h SER 95 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1smn h SER 95 CO 0.02 0.20 0.00 0.18 -1.14 0.00 0.00 176.83 176.09 1smn n LEU 96 N -3.20 0.62 0.00 5.07 4.77 -1.03 -2.27 117.00 120.97 1smn n LEU 96 Ca 0.02 -0.73 0.02 0.00 -0.03 0.00 0.00 56.01 55.28 1smn n LEU 96 Cb 0.54 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.72 1smn n LEU 96 CO 0.35 0.16 0.39 0.00 -1.33 0.00 0.00 177.39 176.96 1smn n ALA 97 N -0.23 1.51 0.80 -1.18 0.00 0.23 -1.91 120.51 119.73 1smn n ALA 97 Ca 0.00 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.55 1smn n ALA 97 Cb 0.03 -1.05 0.32 0.00 0.00 0.00 0.00 19.45 18.74 1smn n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1smn n GLY 98 N -0.88 -1.42 3.74 0.00 0.00 0.16 -4.77 105.19 102.02 1smn n GLY 98 Ca 0.02 -0.22 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 1smn n GLY 98 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1smn s VAL 99 N -3.07 3.03 0.40 1.61 -7.23 -0.80 -4.93 120.40 109.40 1smn s VAL 99 Ca 0.10 0.33 0.12 0.00 -1.81 0.00 0.00 61.98 60.72 1smn s VAL 99 Cb 0.16 -2.74 0.14 0.00 0.56 0.00 0.00 36.38 34.50 1smn s VAL 99 CO 0.66 -0.44 1.90 0.77 -0.31 0.00 0.00 175.10 177.69 1smn h SER 100 N -1.32 0.09 -1.32 4.85 4.64 -1.91 -2.69 113.55 115.89 1smn h SER 100 Ca -0.44 -0.02 -0.67 0.00 -0.47 0.00 0.00 61.79 60.19 1smn h SER 100 Cb 1.24 -0.02 -0.33 0.00 -0.31 0.00 0.00 62.40 62.98 1smn h SER 100 CO 0.50 0.33 0.36 -0.90 -0.87 0.00 0.00 176.83 176.25 1smn n ASP 101 N -4.23 6.67 0.22 4.97 5.68 -1.26 -4.77 116.55 123.83 1smn n ASP 101 Ca -0.02 -3.79 0.12 0.00 -0.50 0.00 0.00 54.79 50.61 1smn n ASP 101 Cb 0.31 -0.80 0.72 0.00 -1.14 0.00 0.00 41.12 40.20 1smn n ASP 101 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 1smn h TRP 102 N 2.41 0.00 -0.02 2.11 5.08 -1.78 -2.00 115.95 121.75 1smn h TRP 102 Ca 0.50 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.48 1smn h TRP 102 Cb 0.74 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.90 1smn h TRP 102 CO 1.16 0.00 0.02 0.93 -1.28 0.00 0.00 178.44 179.27 1smn h GLU 103 N 0.00 0.00 0.00 0.12 3.07 -1.89 -0.84 114.58 115.05 1smn h GLU 103 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1smn h GLU 103 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1smn h GLU 103 CO -0.00 0.00 0.00 0.66 -1.40 0.00 0.00 179.01 178.27 1smn h SER 104 N 0.00 0.00 0.79 1.42 4.64 -1.77 -0.71 113.55 117.92 1smn h SER 104 Ca 0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1smn h SER 104 Cb 0.05 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1smn h SER 104 CO -0.00 0.00 -0.08 -0.07 -0.87 0.00 0.00 176.83 175.81 1smn h LEU 105 N 0.00 0.00 -2.78 5.97 3.38 -1.35 -2.48 115.31 118.04 1smn h LEU 105 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1smn h LEU 105 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1smn h LEU 105 CO 0.00 0.08 0.00 0.59 0.09 0.00 0.00 178.44 179.20 1smn n ASN 106 N -3.26 3.80 -4.77 -0.43 3.02 -0.28 -4.82 115.26 108.53 1smn n ASN 106 Ca -0.00 -2.01 -0.39 0.00 -0.03 0.00 0.00 54.58 52.15 1smn n ASN 106 Cb 0.30 -0.45 -0.04 0.00 -0.61 0.00 0.00 39.78 38.99 1smn n ASN 106 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1smn s TYR 107 N -1.02 3.40 -0.74 3.10 2.02 -0.94 -2.52 117.35 120.65 1smn s TYR 107 Ca 0.45 1.66 0.17 0.00 -0.37 0.00 0.00 57.07 58.97 1smn s TYR 107 Cb 0.23 -3.24 0.72 0.00 -0.40 0.00 0.00 41.96 39.28 1smn s TYR 107 CO 0.30 -0.67 1.52 1.28 -1.57 0.00 0.00 175.55 176.40 1smn n LEU 108 N 0.59 0.29 0.30 -1.29 4.77 0.75 -0.99 117.00 121.41 1smn n LEU 108 Ca 0.02 0.58 0.19 0.00 -0.03 0.00 0.00 56.01 56.77 1smn n LEU 108 Cb 0.47 -0.56 0.85 0.00 -2.33 0.00 0.00 43.42 41.85 1smn n LEU 108 CO 0.50 -0.45 1.05 0.77 -1.33 0.00 0.00 177.39 177.93 1smn h SER 109 N 0.00 0.00 -0.69 -1.43 4.64 -1.87 -2.62 113.55 111.58 1smn h SER 109 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1smn h SER 109 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1smn h SER 109 CO 0.00 0.00 0.00 -3.20 -0.87 0.00 0.00 176.83 172.76 1smn n ASN 110 N -3.09 4.43 -4.27 4.97 5.15 -0.16 -3.99 115.26 118.30 1smn n ASN 110 Ca -0.00 -2.25 -0.20 0.00 -0.60 0.00 0.00 54.58 51.52 1smn n ASN 110 Cb 0.23 -0.55 -0.12 0.00 -0.53 0.00 0.00 39.78 38.82 1smn n ASN 110 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1smn s ILE 111 N -1.49 1.52 0.11 -1.44 -1.09 -0.99 -0.34 121.20 117.47 1smn s ILE 111 Ca 0.51 -1.69 -0.08 0.00 -2.23 0.00 0.00 60.65 57.16 1smn s ILE 111 Cb 0.30 -1.57 -0.01 0.00 -1.58 0.00 0.00 42.46 39.60 1smn s ILE 111 CO 0.29 -0.29 0.20 0.42 -1.23 0.00 0.00 174.94 174.32 1smn s THR 112 N -1.81 0.12 -0.73 2.92 -4.23 -0.81 -4.81 115.64 106.30 1smn s THR 112 Ca 0.09 -1.29 -0.26 0.00 -1.18 0.00 0.00 61.69 59.05 1smn s THR 112 Cb -0.07 -1.50 0.04 0.00 1.34 0.00 0.00 72.50 72.30 1smn s THR 112 CO 0.04 -0.57 1.24 -2.84 -0.54 0.00 0.00 174.62 171.95 1smn s PRO 113 N -3.90 3.19 -0.17 3.99 0.02 -1.26 -1.05 135.00 135.82 1smn s PRO 113 Ca 0.09 -0.30 -0.07 0.00 0.02 0.00 0.00 61.00 60.74 1smn s PRO 113 Cb 0.05 -4.18 -0.04 0.00 0.02 0.00 0.00 34.50 30.35 1smn s PRO 113 CO -0.08 -2.10 0.06 -1.14 -0.33 0.00 0.00 177.00 173.41 1smn s GLN 114 N 5.51 3.84 0.21 5.54 0.74 -0.68 -4.79 119.66 130.03 1smn s GLN 114 Ca 0.34 -0.34 -0.32 0.00 0.05 0.00 0.00 55.36 55.09 1smn s GLN 114 Cb -0.09 -3.16 -0.15 0.00 1.10 0.00 0.00 33.01 30.71 1smn s GLN 114 CO 0.15 0.34 1.17 1.63 -0.55 0.00 0.00 175.29 178.03 1smn n LYS 115 N 3.31 1.33 -0.34 1.67 4.76 -1.26 -0.02 118.16 127.60 1smn n LYS 115 Ca -0.17 0.47 0.05 0.00 -2.87 0.00 0.00 58.31 55.80 1smn n LYS 115 Cb 0.52 -1.97 0.23 0.00 -1.84 0.00 0.00 35.03 31.98 1smn n LYS 115 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1smn h SER 116 N 3.22 0.94 -0.85 4.39 0.02 -1.61 0.05 113.55 119.72 1smn h SER 116 Ca -0.43 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.52 1smn h SER 116 Cb 1.33 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.66 1smn h SER 116 CO 0.69 0.55 0.40 0.44 -1.14 0.00 0.00 176.83 177.78 1smn h ASP 117 N 1.04 1.11 0.14 3.07 3.32 -1.88 0.33 116.42 123.55 1smn h ASP 117 Ca 0.45 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.36 1smn h ASP 117 Cb 0.34 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1smn h ASP 117 CO -0.20 0.94 -0.07 0.25 -1.72 0.00 0.00 179.24 178.44 1smn h LEU 118 N 1.21 -0.16 -0.59 1.55 5.85 -1.57 -1.71 115.31 119.89 1smn h LEU 118 Ca 0.29 -0.38 0.09 0.00 0.84 0.00 0.00 57.88 58.72 1smn h LEU 118 Cb 0.12 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 1smn h LEU 118 CO -0.04 0.36 0.21 -1.13 -0.34 0.00 0.00 178.44 177.50 1smn h ASN 119 N -0.74 0.20 0.19 1.25 -1.24 -0.81 -1.51 115.58 112.91 1smn h ASN 119 Ca -0.02 0.08 0.00 0.00 0.71 0.00 0.00 56.30 57.07 1smn h ASN 119 Cb 0.53 0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.64 1smn h ASN 119 CO 0.03 0.12 -0.18 0.00 -1.29 0.00 0.00 177.43 176.11 1smn n GLN 120 N -5.01 1.01 0.00 6.67 6.02 0.11 -3.00 117.38 123.18 1smn n GLN 120 Ca 0.08 -0.57 0.00 0.00 -0.01 0.00 0.00 57.00 56.50 1smn n GLN 120 Cb 0.27 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1smn n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1smn n GLY 121 N 1.30 0.92 0.37 1.08 0.00 -0.62 -4.73 105.19 103.50 1smn n GLY 121 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 1smn n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1smn h ALA 122 N -0.25 1.59 -0.27 4.61 0.00 -1.72 -1.75 119.26 121.47 1smn h ALA 122 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1smn h ALA 122 Cb 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1smn h ALA 122 CO 0.00 0.16 0.12 2.35 0.00 0.00 0.00 179.25 181.89 1smn h TRP 123 N 0.93 0.39 -0.58 0.00 2.91 -1.68 -0.08 115.95 117.84 1smn h TRP 123 Ca 0.49 -0.02 -0.06 0.00 1.13 0.00 0.00 58.89 60.42 1smn h TRP 123 Cb 0.54 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.04 1smn h TRP 123 CO -0.00 0.38 0.13 0.00 -1.03 0.00 0.00 178.44 177.92 1smn h ALA 124 N 0.98 0.77 -0.77 2.65 0.00 -1.36 -1.15 119.26 120.37 1smn h ALA 124 Ca 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1smn h ALA 124 Cb 0.14 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1smn h ALA 124 CO -0.01 0.48 0.49 0.00 0.00 0.00 0.00 179.25 180.21 1smn h ARG 125 N 0.85 1.03 -0.45 0.00 -0.00 -1.13 0.07 114.38 114.74 1smn h ARG 125 Ca 0.18 -0.08 -0.09 0.00 -0.50 0.00 0.00 59.98 59.49 1smn h ARG 125 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 29.97 30.09 1smn h ARG 125 CO 0.00 0.71 -0.07 1.25 0.00 0.00 0.00 179.97 181.86 1smn h LEU 126 N 1.05 0.83 -0.60 3.04 5.85 -0.85 -1.84 115.31 122.78 1smn h LEU 126 Ca 0.28 -0.34 0.07 0.00 0.84 0.00 0.00 57.88 58.72 1smn h LEU 126 Cb -0.08 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.67 1smn h LEU 126 CO -0.06 0.98 0.29 -0.33 -0.34 0.00 0.00 178.44 178.99 1smn h GLU 127 N 0.67 0.52 -0.34 1.25 5.08 -0.71 0.83 114.58 121.88 1smn h GLU 127 Ca 0.12 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1smn h GLU 127 Cb 0.59 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1smn h GLU 127 CO 0.04 0.35 0.17 -0.44 -1.00 0.00 0.00 179.01 178.12 1smn h ASP 128 N 0.54 0.25 -0.09 1.42 3.32 -0.68 -1.79 116.42 119.39 1smn h ASP 128 Ca 0.28 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.24 1smn h ASP 128 Cb 0.24 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1smn h ASP 128 CO -0.21 0.19 -0.28 1.56 -1.72 0.00 0.00 179.24 178.77 1smn h GLN 129 N 0.35 0.54 -0.68 3.56 1.08 -0.87 -1.57 115.11 117.53 1smn h GLN 129 Ca 0.14 -0.22 -0.07 0.00 -1.45 0.00 0.00 58.65 57.05 1smn h GLN 129 Cb 0.05 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 1smn h GLN 129 CO -0.10 0.77 0.15 1.49 -0.95 0.00 0.00 178.83 180.19 1smn h GLU 130 N 0.47 1.10 -0.37 1.46 4.81 -0.64 -2.84 114.58 118.57 1smn h GLU 130 Ca 0.06 -0.27 -0.15 0.00 -0.13 0.00 0.00 59.36 58.87 1smn h GLU 130 Cb 0.73 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1smn h GLU 130 CO 0.06 0.98 -0.37 -0.09 -0.73 0.00 0.00 179.01 178.86 1smn h ARG 131 N 1.02 0.88 0.00 1.92 2.43 -1.08 -3.01 114.38 116.55 1smn h ARG 131 Ca 0.21 -0.45 -0.01 0.00 -0.81 0.00 0.00 59.98 58.92 1smn h ARG 131 Cb 0.39 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1smn h ARG 131 CO 0.01 1.10 -0.03 0.87 -1.51 0.00 0.00 179.97 180.40 1smn h LYS 132 N 0.72 0.00 -0.84 0.20 1.57 -1.06 -2.56 116.57 114.60 1smn h LYS 132 Ca 0.06 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.89 1smn h LYS 132 Cb 0.95 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.21 1smn h LYS 132 CO 0.09 0.03 0.55 -0.07 -0.57 0.00 0.00 179.45 179.48 1smn h LEU 133 N 0.00 0.86 -0.12 2.94 3.38 -1.36 -0.34 115.31 120.67 1smn h LEU 133 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1smn h LEU 133 Cb 0.24 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1smn h LEU 133 CO 0.00 0.57 0.00 0.00 0.09 0.00 0.00 178.44 179.11 1smn n ILE 134 N -4.47 1.23 0.44 1.22 0.13 -0.96 -1.30 119.36 115.65 1smn n ILE 134 Ca 0.12 0.33 0.12 0.00 -1.10 0.00 0.00 62.75 62.22 1smn n ILE 134 Cb 0.16 -1.17 0.24 0.00 -0.84 0.00 0.00 39.64 38.04 1smn n ILE 134 CO 0.00 0.00 0.00 0.44 2.80 0.00 0.00 176.55 179.79 1smn h ASP 135 N 0.00 0.00 -3.82 9.51 3.32 -1.22 -3.45 116.42 120.76 1smn h ASP 135 Ca 0.00 -0.04 -0.52 0.00 0.02 0.00 0.00 57.03 56.49 1smn h ASP 135 Cb 0.19 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.79 1smn h ASP 135 CO 0.00 0.02 0.59 -0.13 -1.72 0.00 0.00 179.24 178.00 1smn s ARG 136 N -3.17 4.45 0.24 3.56 0.52 -0.42 -4.92 118.95 119.21 1smn s ARG 136 Ca 0.07 2.08 -0.06 0.00 -0.52 0.00 0.00 55.73 57.31 1smn s ARG 136 Cb 0.10 -3.12 0.30 0.00 0.52 0.00 0.00 34.95 32.75 1smn s ARG 136 CO 0.66 -0.07 1.89 0.00 0.02 0.00 0.00 175.30 177.80 1smn h ALA 137 N 3.66 1.22 -0.07 2.13 0.00 -1.88 -2.36 119.26 121.97 1smn h ALA 137 Ca -0.48 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1smn h ALA 137 Cb 1.22 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1smn h ALA 137 CO 0.67 0.44 0.00 -0.40 0.00 0.00 0.00 179.25 179.96 1smn n ASP 138 N -4.52 1.53 -4.43 0.00 5.68 -1.26 -4.76 116.55 108.80 1smn n ASP 138 Ca 0.12 -1.56 -0.40 0.00 -0.50 0.00 0.00 54.79 52.45 1smn n ASP 138 Cb 0.10 -0.04 -0.11 0.00 -1.14 0.00 0.00 41.12 39.94 1smn n ASP 138 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1smn s ILE 139 N -1.93 4.79 -0.82 2.12 1.01 -0.89 -4.94 121.20 120.54 1smn s ILE 139 Ca 0.36 -0.61 0.17 0.00 0.00 0.00 0.00 60.65 60.57 1smn s ILE 139 Cb 0.20 -3.58 -0.19 0.00 0.01 0.00 0.00 42.46 38.90 1smn s ILE 139 CO 0.31 -0.13 0.74 -1.54 0.00 0.00 0.00 174.94 174.32 1smn n SER 140 N 5.03 0.82 -3.67 3.58 3.41 -1.26 -4.68 113.62 116.85 1smn n SER 140 Ca -0.12 -0.91 -0.15 0.00 -0.26 0.00 0.00 58.87 57.43 1smn n SER 140 Cb 0.48 1.00 -0.08 0.00 -0.26 0.00 0.00 64.21 65.35 1smn n SER 140 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1smn s SER 141 N -2.65 -0.36 -0.12 4.04 0.01 -1.26 -4.50 113.70 108.87 1smn s SER 141 Ca 0.07 0.33 -0.00 0.00 1.31 0.00 0.00 55.95 57.65 1smn s SER 141 Cb 0.13 0.41 0.02 0.00 0.21 0.00 0.00 66.02 66.79 1smn s SER 141 CO 0.72 -0.50 -0.09 -0.69 0.41 0.00 0.00 173.24 173.09 1smn s VAL 142 N -1.24 1.12 -0.24 3.43 1.01 -0.41 -1.25 120.40 122.81 1smn s VAL 142 Ca -0.12 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.44 1smn s VAL 142 Cb -0.03 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 1smn s VAL 142 CO 0.06 0.38 0.02 -0.31 0.00 0.00 0.00 175.10 175.26 1smn s TYR 143 N 1.61 3.04 0.07 5.22 2.02 -0.19 -0.24 117.35 128.87 1smn s TYR 143 Ca 0.04 -0.71 0.08 0.00 -0.37 0.00 0.00 57.07 56.11 1smn s TYR 143 Cb -0.13 -2.19 -0.03 0.00 -0.40 0.00 0.00 41.96 39.22 1smn s TYR 143 CO -0.08 -0.47 -0.22 0.99 -1.57 0.00 0.00 175.55 174.20 1smn s THR 144 N 1.54 1.81 -0.07 -0.71 2.01 -0.26 -1.53 115.64 118.43 1smn s THR 144 Ca 0.06 -1.38 0.02 0.00 0.31 0.00 0.00 61.69 60.71 1smn s THR 144 Cb -0.15 -1.59 0.01 0.00 0.01 0.00 0.00 72.50 70.78 1smn s THR 144 CO 0.01 0.14 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.26 1smn s VAL 145 N -0.92 1.22 0.07 3.82 1.01 -0.31 -0.80 120.40 124.49 1smn s VAL 145 Ca 0.08 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.55 1smn s VAL 145 Cb -0.09 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1smn s VAL 145 CO 0.03 0.37 -0.07 0.28 0.00 0.00 0.00 175.10 175.71 1smn s THR 146 N 0.60 0.64 0.05 3.92 -1.32 0.02 -0.85 115.64 118.70 1smn s THR 146 Ca -0.14 -1.57 -0.27 0.00 -1.21 0.00 0.00 61.69 58.50 1smn s THR 146 Cb -0.16 -1.23 0.09 0.00 -1.51 0.00 0.00 72.50 69.69 1smn s THR 146 CO 0.04 -0.66 1.21 -0.83 -2.21 0.00 0.00 174.62 172.17 1smn s GLY 147 N -2.42 -0.07 0.51 6.08 0.00 -0.90 -0.82 107.32 109.69 1smn s GLY 147 Ca 0.03 -0.04 0.08 0.00 0.00 0.00 0.00 44.72 44.79 1smn s GLY 147 CO -0.03 4.24 0.60 2.56 0.00 0.00 0.00 173.10 180.48 1smn s PRO 148 N -2.10 2.45 0.08 2.90 0.04 -1.26 -1.14 135.00 135.96 1smn s PRO 148 Ca 0.26 -1.61 0.03 0.00 0.04 0.00 0.00 61.00 59.72 1smn s PRO 148 Cb -0.01 -2.52 -0.03 0.00 0.04 0.00 0.00 34.50 31.98 1smn s PRO 148 CO 0.01 -0.58 -0.10 -0.51 0.04 0.00 0.00 177.00 175.86 1smn s LEU 149 N -4.44 2.35 -0.42 -3.56 1.43 -0.30 -4.88 118.68 108.87 1smn s LEU 149 Ca 0.53 -0.72 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1smn s LEU 149 Cb -0.06 -0.28 0.13 0.00 0.03 0.00 0.00 46.19 46.01 1smn s LEU 149 CO 0.32 -0.23 0.21 -0.31 0.23 0.00 0.00 176.35 176.58 1smn s TYR 150 N -2.02 2.06 -0.07 0.29 2.02 -1.26 -0.79 117.35 117.57 1smn s TYR 150 Ca 0.00 -2.39 0.07 0.00 -0.37 0.00 0.00 57.07 54.39 1smn s TYR 150 Cb -0.06 -1.94 -0.10 0.00 -0.40 0.00 0.00 41.96 39.46 1smn s TYR 150 CO 0.00 -0.80 0.04 0.39 -1.57 0.00 0.00 175.55 173.62 1smn n GLU 151 N 3.72 2.43 -3.97 -0.62 1.02 -1.26 -4.96 120.64 117.00 1smn n GLU 151 Ca 0.07 -0.01 -0.09 0.00 -0.02 0.00 0.00 57.16 57.11 1smn n GLU 151 Cb 0.36 -1.21 -0.10 0.00 -0.02 0.00 0.00 31.44 30.47 1smn n GLU 151 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1smn s ARG 152 N -2.24 0.58 0.10 3.49 1.70 -1.26 -5.10 118.95 116.22 1smn s ARG 152 Ca -0.04 -0.88 -0.31 0.00 -0.47 0.00 0.00 55.73 54.03 1smn s ARG 152 Cb 0.03 0.22 -0.10 0.00 -0.57 0.00 0.00 34.95 34.53 1smn s ARG 152 CO 0.33 -0.13 1.78 0.34 -1.08 0.00 0.00 175.30 176.54 1smn s ASP 153 N -2.32 6.48 0.00 -2.89 2.15 -1.26 -4.62 116.67 114.21 1smn s ASP 153 Ca -0.02 2.67 0.12 0.00 0.43 0.00 0.00 52.55 55.75 1smn s ASP 153 Cb 0.01 -2.56 0.26 0.00 -0.30 0.00 0.00 42.92 40.33 1smn s ASP 153 CO -0.06 -0.97 1.16 0.23 -0.17 0.00 0.00 175.17 175.35 1smn n MET 154 N 5.77 2.15 0.00 4.34 2.81 -1.26 -5.10 117.12 125.83 1smn n MET 154 Ca 0.17 -1.83 0.00 0.00 -1.81 0.00 0.00 57.70 54.23 1smn n MET 154 Cb 0.39 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.62 1smn n MET 154 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1smn n GLY 155 N 0.66 -1.78 3.10 3.03 0.00 -1.26 -4.99 105.19 103.95 1smn n GLY 155 Ca 0.11 -1.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.09 1smn n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1smn s LYS 156 N 0.00 0.65 0.13 1.61 -0.14 -1.26 -4.48 119.74 116.25 1smn s LYS 156 Ca 0.00 -0.98 -0.31 0.00 -1.36 0.00 0.00 55.97 53.32 1smn s LYS 156 Cb 0.00 -0.25 -0.08 0.00 -1.68 0.00 0.00 37.83 35.82 1smn s LYS 156 CO 0.00 0.02 1.41 -0.51 -0.76 0.00 0.00 175.35 175.51 1smn s LEU 157 N -2.16 4.37 0.40 3.17 1.43 -1.26 -4.91 118.68 119.73 1smn s LEU 157 Ca -0.01 2.39 0.27 0.00 -1.03 0.00 0.00 54.13 55.75 1smn s LEU 157 Cb -0.04 -3.59 0.93 0.00 0.03 0.00 0.00 46.19 43.52 1smn s LEU 157 CO -0.02 -0.67 1.79 1.55 0.23 0.00 0.00 176.35 179.24 1smn h PRO 158 N 6.62 0.00 -0.66 1.29 0.13 -1.86 -3.28 132.00 134.23 1smn h PRO 158 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1smn h PRO 158 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1smn h PRO 158 CO 0.86 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.04 1smn n GLY 159 N 0.52 2.44 3.07 1.56 0.00 -1.14 -4.93 105.19 106.71 1smn n GLY 159 Ca 0.03 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 1smn n GLY 159 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1smn s THR 160 N -2.13 0.12 -1.68 2.61 -1.32 -1.24 -4.42 115.64 107.59 1smn s THR 160 Ca 0.41 -1.01 0.16 0.00 -1.21 0.00 0.00 61.69 60.03 1smn s THR 160 Cb 0.29 -0.66 0.04 0.00 -1.51 0.00 0.00 72.50 70.66 1smn s THR 160 CO 0.15 -0.56 0.91 0.00 -2.21 0.00 0.00 174.62 172.91 1smn n GLN 161 N 1.10 1.57 -2.23 7.08 0.00 -1.26 -4.91 117.38 118.73 1smn n GLN 161 Ca -0.21 -1.04 -0.38 0.00 0.00 0.00 0.00 57.00 55.37 1smn n GLN 161 Cb 0.57 -1.29 -0.01 0.00 0.00 0.00 0.00 30.24 29.51 1smn n GLN 161 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1smn s LYS 162 N -1.71 3.87 0.03 2.61 1.02 -1.26 -4.98 119.74 119.32 1smn s LYS 162 Ca 0.15 1.86 -0.30 0.00 0.02 0.00 0.00 55.97 57.71 1smn s LYS 162 Cb 0.13 -2.55 -0.05 0.00 -0.52 0.00 0.00 37.83 34.85 1smn s LYS 162 CO 0.33 -0.48 1.15 0.00 -0.92 0.00 0.00 175.35 175.43 1smn s ALA 163 N -1.45 3.36 0.16 5.17 0.00 -1.26 -5.00 121.76 122.75 1smn s ALA 163 Ca 0.61 0.74 -0.17 0.00 0.00 0.00 0.00 51.96 53.13 1smn s ALA 163 Cb -0.31 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.41 1smn s ALA 163 CO 0.38 -0.45 0.48 -3.38 0.00 0.00 0.00 175.76 172.79 1smn s HIS 164 N 1.27 -0.17 -0.17 0.00 -0.00 -1.26 -4.72 115.29 110.23 1smn s HIS 164 Ca 0.57 -0.15 -0.01 0.00 -0.00 0.00 0.00 55.06 55.47 1smn s HIS 164 Cb -0.27 0.34 0.05 0.00 -0.00 0.00 0.00 32.58 32.70 1smn s HIS 164 CO 0.28 -0.82 -0.02 0.99 -0.00 0.00 0.00 174.74 175.16 1smn s THR 165 N -3.84 0.91 0.07 -5.38 2.01 -0.87 -4.97 115.64 103.57 1smn s THR 165 Ca 0.06 -0.58 -0.31 0.00 0.31 0.00 0.00 61.69 61.18 1smn s THR 165 Cb 0.00 -1.18 -0.07 0.00 0.01 0.00 0.00 72.50 71.27 1smn s THR 165 CO -0.07 0.03 1.31 -0.63 -0.69 0.00 0.00 174.62 174.57 1smn s ILE 166 N 1.71 3.68 0.68 1.82 1.01 -1.26 -4.86 121.20 123.98 1smn s ILE 166 Ca 0.00 1.18 -0.17 0.00 0.00 0.00 0.00 60.65 61.67 1smn s ILE 166 Cb -0.16 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.56 1smn s ILE 166 CO -0.07 0.08 1.27 -2.84 0.00 0.00 0.00 174.94 173.37 1smn s PRO 167 N 1.31 2.36 0.00 2.79 0.02 -1.26 -4.49 135.00 135.72 1smn s PRO 167 Ca 0.62 1.97 0.17 0.00 0.02 0.00 0.00 61.00 63.78 1smn s PRO 167 Cb -0.33 -1.83 -0.17 0.00 0.02 0.00 0.00 34.50 32.19 1smn s PRO 167 CO 0.29 -1.72 0.74 -1.13 -0.33 0.00 0.00 177.00 174.85 1smn n SER 168 N -2.22 0.90 -3.70 2.53 3.41 0.03 -4.90 113.62 109.66 1smn n SER 168 Ca 0.15 -0.95 -0.08 0.00 -0.26 0.00 0.00 58.87 57.74 1smn n SER 168 Cb 0.49 0.95 -0.02 0.00 -0.26 0.00 0.00 64.21 65.37 1smn n SER 168 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1smn s ALA 169 N -2.55 -1.45 0.02 7.33 0.00 -1.17 -0.28 121.76 123.66 1smn s ALA 169 Ca 0.07 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.12 1smn s ALA 169 Cb 0.13 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 24.02 1smn s ALA 169 CO 0.67 -0.94 -0.03 0.71 0.00 0.00 0.00 175.76 176.17 1smn s TYR 170 N -3.69 0.30 0.08 0.00 2.02 -0.04 -1.15 117.35 114.86 1smn s TYR 170 Ca 0.08 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.34 1smn s TYR 170 Cb -0.03 -0.20 -0.04 0.00 -0.40 0.00 0.00 41.96 41.29 1smn s TYR 170 CO -0.00 -0.15 -0.08 1.67 -1.57 0.00 0.00 175.55 175.42 1smn s TRP 171 N -1.27 0.85 -0.10 2.71 1.48 -0.29 -0.22 118.94 122.09 1smn s TRP 171 Ca -0.13 -0.74 -0.05 0.00 -1.06 0.00 0.00 56.10 54.13 1smn s TRP 171 Cb -0.09 -0.49 0.05 0.00 -1.16 0.00 0.00 33.47 31.78 1smn s TRP 171 CO -0.01 -0.10 0.22 0.21 -4.06 0.00 0.00 176.95 173.21 1smn s LYS 172 N -2.93 0.16 -0.13 3.25 2.20 -0.30 -2.13 119.74 119.87 1smn s LYS 172 Ca 0.04 0.55 0.01 0.00 -0.36 0.00 0.00 55.97 56.21 1smn s LYS 172 Cb -0.01 -0.13 -0.01 0.00 -1.51 0.00 0.00 37.83 36.18 1smn s LYS 172 CO -0.02 -0.20 -0.18 0.08 -0.36 0.00 0.00 175.35 174.67 1smn s VAL 173 N 1.55 2.57 0.01 4.02 1.01 -0.03 -0.73 120.40 128.81 1smn s VAL 173 Ca -0.06 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1smn s VAL 173 Cb -0.11 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.21 1smn s VAL 173 CO -0.08 0.54 -0.07 -0.63 0.00 0.00 0.00 175.10 174.85 1smn s ILE 174 N 0.49 0.55 0.08 2.22 1.01 0.55 -1.17 121.20 124.93 1smn s ILE 174 Ca -0.12 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 1smn s ILE 174 Cb -0.16 -0.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.79 1smn s ILE 174 CO 0.05 0.04 0.08 0.72 0.00 0.00 0.00 174.94 175.83 1smn s PHE 175 N -0.41 0.39 0.26 3.97 -0.12 -0.58 -0.74 117.98 120.74 1smn s PHE 175 Ca 0.00 -0.87 0.09 0.00 -0.05 0.00 0.00 56.93 56.11 1smn s PHE 175 Cb -0.04 -0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.06 1smn s PHE 175 CO -0.00 -0.47 -0.01 0.96 -0.05 0.00 0.00 175.22 175.65 1smn s ILE 176 N -3.91 3.45 0.00 -4.49 -4.36 -1.08 -1.02 121.20 109.79 1smn s ILE 176 Ca 0.08 -1.87 0.00 0.00 -0.26 0.00 0.00 60.65 58.60 1smn s ILE 176 Cb 0.06 -2.83 0.00 0.00 1.25 0.00 0.00 42.46 40.95 1smn s ILE 176 CO -0.09 -0.34 0.00 0.59 0.24 0.00 0.00 174.94 175.34 1smn n ASN 177 N -0.79 0.00 -0.08 4.36 3.02 -0.38 -4.02 115.26 117.37 1smn n ASN 177 Ca -0.07 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.31 1smn n ASN 177 Cb 0.59 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.69 1smn n ASN 177 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1smn n ASN 178 N 5.91 1.41 -3.61 6.41 4.13 -1.26 -4.72 115.26 123.54 1smn n ASN 178 Ca 0.00 0.16 -0.09 0.00 1.68 0.00 0.00 54.58 56.33 1smn n ASN 178 Cb 0.00 -0.45 -0.06 0.00 -1.54 0.00 0.00 39.78 37.73 1smn n ASN 178 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1smn s SER 179 N -6.34 -0.35 0.64 6.41 0.15 -1.26 -4.82 113.70 108.13 1smn s SER 179 Ca -0.23 0.53 0.42 0.00 0.70 0.00 0.00 55.95 57.37 1smn s SER 179 Cb 0.08 0.49 2.20 0.00 -1.71 0.00 0.00 66.02 67.08 1smn s SER 179 CO 0.30 -0.22 2.29 -0.65 1.20 0.00 0.00 173.24 176.16 1smn h PRO 180 N 3.20 0.00 -0.06 5.44 0.11 -1.87 0.23 132.00 139.05 1smn h PRO 180 Ca -0.22 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.91 1smn h PRO 180 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1smn h PRO 180 CO 0.22 0.00 0.05 0.00 -0.21 0.00 0.00 178.00 178.06 1smn h ALA 181 N 2.00 1.79 0.00 -0.75 0.00 -1.96 -3.32 119.26 117.01 1smn h ALA 181 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1smn h ALA 181 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1smn h ALA 181 CO 0.00 -0.08 -0.11 1.33 0.00 0.00 0.00 179.25 180.39 1smn n VAL 182 N -4.11 0.00 -4.26 0.00 0.24 -0.64 -5.11 118.33 104.46 1smn n VAL 182 Ca -0.02 -0.13 -0.27 0.00 -2.04 0.00 0.00 64.34 61.89 1smn n VAL 182 Cb 0.15 0.76 -0.09 0.00 -1.47 0.00 0.00 33.84 33.19 1smn n VAL 182 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1smn s ASN 183 N -0.47 4.43 0.55 -1.34 -0.87 0.70 -5.02 114.94 112.93 1smn s ASN 183 Ca 0.00 -0.51 -0.21 0.00 -1.57 0.00 0.00 52.86 50.58 1smn s ASN 183 Cb 0.00 -0.83 -0.05 0.00 -0.02 0.00 0.00 41.25 40.35 1smn s ASN 183 CO 0.00 0.10 1.18 1.41 -2.57 0.00 0.00 177.10 177.22 1smn n HIS 184 N 0.03 1.66 -4.14 2.20 8.25 -1.26 -4.42 115.22 117.53 1smn n HIS 184 Ca -0.11 0.45 -0.12 0.00 -0.26 0.00 0.00 57.72 57.68 1smn n HIS 184 Cb 0.55 -2.27 -0.08 0.00 1.12 0.00 0.00 29.99 29.31 1smn n HIS 184 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1smn s TYR 185 N -1.36 0.98 0.11 4.41 -0.85 -1.26 -2.64 117.35 116.74 1smn s TYR 185 Ca 0.72 -1.21 -0.20 0.00 -0.52 0.00 0.00 57.07 55.86 1smn s TYR 185 Cb -0.44 -0.31 0.05 0.00 0.38 0.00 0.00 41.96 41.65 1smn s TYR 185 CO 0.49 -0.82 0.50 0.00 -1.52 0.00 0.00 175.55 174.21 1smn s ALA 186 N -3.93 -1.27 -0.09 9.51 0.00 0.08 -2.04 121.76 124.02 1smn s ALA 186 Ca 0.34 0.35 -0.07 0.00 0.00 0.00 0.00 51.96 52.57 1smn s ALA 186 Cb 0.04 0.64 0.03 0.00 0.00 0.00 0.00 23.12 23.83 1smn s ALA 186 CO 0.14 -0.63 0.22 0.00 0.00 0.00 0.00 175.76 175.49 1smn s ALA 187 N -3.30 -0.53 0.08 0.00 0.00 -1.26 -0.33 121.76 116.42 1smn s ALA 187 Ca -0.01 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.73 1smn s ALA 187 Cb 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.65 1smn s ALA 187 CO -0.09 -0.13 -0.12 -0.06 0.00 0.00 0.00 175.76 175.36 1smn s PHE 188 N 0.49 1.14 -0.13 0.00 0.40 0.09 -0.78 117.98 119.20 1smn s PHE 188 Ca -0.03 -0.54 -0.05 0.00 -0.60 0.00 0.00 56.93 55.71 1smn s PHE 188 Cb -0.04 -0.63 0.06 0.00 0.51 0.00 0.00 43.02 42.92 1smn s PHE 188 CO -0.02 0.04 0.27 -1.17 0.70 0.00 0.00 175.22 175.03 1smn s LEU 189 N -2.05 -0.21 -0.08 -0.37 0.20 -0.78 -1.15 118.68 114.23 1smn s LEU 189 Ca 0.01 0.60 0.04 0.00 0.69 0.00 0.00 54.13 55.47 1smn s LEU 189 Cb -0.07 0.73 -0.01 0.00 -0.43 0.00 0.00 46.19 46.41 1smn s LEU 189 CO 0.02 -0.23 -0.21 -0.36 -0.29 0.00 0.00 176.35 175.28 1smn s PHE 190 N 2.25 2.58 0.49 5.38 0.40 0.69 -4.84 117.98 124.92 1smn s PHE 190 Ca -0.00 -0.75 -0.19 0.00 -0.60 0.00 0.00 56.93 55.39 1smn s PHE 190 Cb -0.12 -1.69 -0.09 0.00 0.51 0.00 0.00 43.02 41.64 1smn s PHE 190 CO -0.09 -0.24 0.99 0.34 0.70 0.00 0.00 175.22 176.92 1smn s ASP 191 N 0.04 6.61 0.44 1.36 -1.08 -1.26 -0.86 116.67 121.91 1smn s ASP 191 Ca -0.08 1.69 0.19 0.00 -0.52 0.00 0.00 52.55 53.83 1smn s ASP 191 Cb -0.15 -2.53 1.14 0.00 -1.46 0.00 0.00 42.92 39.92 1smn s ASP 191 CO 0.05 -0.59 1.88 1.56 0.52 0.00 0.00 175.17 178.59 1smn h GLN 192 N 1.32 0.33 -0.97 4.34 1.08 -0.99 -2.06 115.11 118.16 1smn h GLN 192 Ca -0.48 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 1smn h GLN 192 Cb 1.19 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 1smn h GLN 192 CO 0.60 0.22 0.00 0.09 -0.95 0.00 0.00 178.83 178.79 1smn n ASN 193 N -4.47 1.34 -4.69 1.46 5.03 -1.26 -4.58 115.26 108.10 1smn n ASN 193 Ca 0.17 -2.07 -0.42 0.00 0.87 0.00 0.00 54.58 53.13 1smn n ASN 193 Cb 0.68 -0.51 -0.03 0.00 -1.02 0.00 0.00 39.78 38.90 1smn n ASN 193 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1smn s THR 194 N -1.13 3.41 0.63 3.41 2.01 -0.78 -4.95 115.64 118.25 1smn s THR 194 Ca 0.04 0.85 -0.18 0.00 0.31 0.00 0.00 61.69 62.71 1smn s THR 194 Cb 0.03 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 1smn s THR 194 CO 0.01 0.01 1.09 -2.65 -0.69 0.00 0.00 174.62 172.38 1smn n PRO 195 N 5.28 0.92 -0.32 4.92 -0.02 -1.26 -3.90 135.00 140.63 1smn n PRO 195 Ca 0.14 0.37 0.11 0.00 -2.02 0.00 0.00 63.50 62.09 1smn n PRO 195 Cb 0.42 -2.31 0.32 0.00 -0.02 0.00 0.00 33.50 31.92 1smn n PRO 195 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1smn h LYS 196 N 0.40 0.78 -0.56 -0.52 1.63 -1.93 -2.50 116.57 113.87 1smn h LYS 196 Ca -0.49 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.26 1smn h LYS 196 Cb 1.35 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 1smn h LYS 196 CO 0.51 0.52 0.00 0.41 -3.45 0.00 0.00 179.45 177.44 1smn n GLY 197 N -1.39 1.67 3.76 5.01 0.00 -1.26 -4.20 105.19 108.77 1smn n GLY 197 Ca 0.19 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 45.22 1smn n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1smn s ALA 198 N -1.36 3.01 -0.30 4.61 0.00 -0.94 -4.97 121.76 121.80 1smn s ALA 198 Ca 0.37 1.40 -0.20 0.00 0.00 0.00 0.00 51.96 53.52 1smn s ALA 198 Cb 0.20 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 1smn s ALA 198 CO 0.24 -1.30 0.63 0.34 0.00 0.00 0.00 175.76 175.67 1smn s ASP 199 N -0.75 6.51 0.59 0.00 2.15 -1.26 -4.17 116.67 119.74 1smn s ASP 199 Ca 0.67 0.47 0.28 0.00 0.43 0.00 0.00 52.55 54.40 1smn s ASP 199 Cb -0.42 -2.33 1.62 0.00 -0.30 0.00 0.00 42.92 41.49 1smn s ASP 199 CO 0.52 -0.47 2.07 2.19 -0.17 0.00 0.00 175.17 179.31 1smn h PHE 200 N 8.15 0.00 0.00 -5.34 -5.15 -1.93 -0.51 116.94 112.15 1smn h PHE 200 Ca -0.27 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.50 1smn h PHE 200 Cb 1.12 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.29 1smn h PHE 200 CO 0.76 0.00 -0.04 0.00 -2.00 0.00 0.00 178.31 177.03 1smn n GLN 202 N -3.49 0.86 -0.60 0.00 6.02 -0.20 -3.81 117.38 116.16 1smn n GLN 202 Ca -0.02 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.01 1smn n GLN 202 Cb 0.15 -1.50 0.20 0.00 1.02 0.00 0.00 30.24 30.11 1smn n GLN 202 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1smn n PHE 203 N -1.00 0.25 -2.34 1.08 3.01 -0.42 -5.02 117.46 113.03 1smn n PHE 203 Ca 0.21 -1.47 -0.41 0.00 1.01 0.00 0.00 57.45 56.79 1smn n PHE 203 Cb 0.10 -0.30 -0.03 0.00 -0.01 0.00 0.00 39.48 39.24 1smn n PHE 203 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1smn s ARG 204 N -3.20 4.50 0.32 -1.08 0.52 -1.25 -1.86 118.95 116.89 1smn s ARG 204 Ca 0.39 1.94 0.07 0.00 -0.52 0.00 0.00 55.73 57.61 1smn s ARG 204 Cb 0.37 -3.19 -0.03 0.00 0.52 0.00 0.00 34.95 32.63 1smn s ARG 204 CO -0.04 -0.04 0.28 1.33 0.02 0.00 0.00 175.30 176.85 1smn n VAL 205 N 1.85 0.00 -3.33 3.52 0.24 0.04 -4.91 118.33 115.74 1smn n VAL 205 Ca 0.02 -2.27 -0.23 0.00 -2.04 0.00 0.00 64.34 59.82 1smn n VAL 205 Cb 0.44 1.15 -0.01 0.00 -1.47 0.00 0.00 33.84 33.95 1smn n VAL 205 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1smn s THR 206 N -3.25 4.90 0.24 3.34 -4.23 -1.26 -4.12 115.64 111.25 1smn s THR 206 Ca 0.37 -0.50 0.05 0.00 -1.18 0.00 0.00 61.69 60.44 1smn s THR 206 Cb 0.02 -3.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.03 1smn s THR 206 CO 0.26 -0.51 1.57 0.58 -0.54 0.00 0.00 174.62 175.99 1smn h VAL 207 N 0.71 1.39 -0.42 2.29 2.07 -1.82 -3.07 116.25 117.40 1smn h VAL 207 Ca -0.49 -1.97 0.04 0.00 0.82 0.00 0.00 66.70 65.10 1smn h VAL 207 Cb 1.23 2.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.95 1smn h VAL 207 CO 0.60 0.58 0.18 -0.78 0.02 0.00 0.00 177.57 178.17 1smn h ASP 208 N 0.16 0.22 -0.72 0.57 3.58 -1.34 -0.98 116.42 117.91 1smn h ASP 208 Ca -0.01 0.04 0.06 0.00 0.42 0.00 0.00 57.03 57.54 1smn h ASP 208 Cb 1.09 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.08 1smn h ASP 208 CO 0.09 0.17 0.42 -0.08 -2.88 0.00 0.00 179.24 176.95 1smn h GLU 209 N 0.36 0.74 -0.07 0.28 4.81 -1.80 -0.28 114.58 118.62 1smn h GLU 209 Ca 0.19 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1smn h GLU 209 Cb 0.14 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.35 1smn h GLU 209 CO -0.17 0.49 0.04 0.82 -0.73 0.00 0.00 179.01 179.47 1smn h ILE 210 N 0.77 1.06 -0.36 2.32 2.04 -1.40 -2.30 117.51 119.64 1smn h ILE 210 Ca 0.32 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 66.06 1smn h ILE 210 Cb 0.18 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 1smn h ILE 210 CO -0.18 0.05 0.10 -0.33 0.00 0.00 0.00 178.15 177.79 1smn h GLU 211 N 0.04 0.23 -0.49 2.37 5.08 -0.80 -0.13 114.58 120.88 1smn h GLU 211 Ca 0.02 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1smn h GLU 211 Cb 0.05 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1smn h GLU 211 CO -0.00 0.15 0.23 0.87 -1.00 0.00 0.00 179.01 179.26 1smn h LYS 212 N 0.23 0.68 0.00 2.33 1.79 -0.96 0.11 116.57 120.76 1smn h LYS 212 Ca 0.17 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1smn h LYS 212 Cb 0.17 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1smn h LYS 212 CO -0.20 0.53 -0.47 0.54 -1.08 0.00 0.00 179.45 178.77 1smn n ARG 213 N -4.38 0.12 -0.01 3.15 1.74 -0.80 -4.32 116.66 112.15 1smn n ARG 213 Ca 0.04 0.04 0.02 0.00 -0.77 0.00 0.00 57.85 57.18 1smn n ARG 213 Cb 0.12 -1.58 -0.06 0.00 -1.02 0.00 0.00 32.46 29.93 1smn n ARG 213 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1smn n THR 214 N -1.75 0.09 -0.83 0.55 -2.24 -0.13 -4.79 114.28 105.19 1smn n THR 214 Ca 0.05 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1smn n THR 214 Cb 0.38 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1smn n THR 214 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1smn n GLY 215 N 2.19 0.58 3.91 3.38 0.00 0.34 -5.05 105.19 110.54 1smn n GLY 215 Ca -0.03 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 1smn n GLY 215 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1smn s LEU 216 N 0.00 3.90 -0.24 0.99 1.43 -1.23 -4.64 118.68 118.88 1smn s LEU 216 Ca 0.00 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1smn s LEU 216 Cb 0.00 -2.52 0.06 0.00 0.03 0.00 0.00 46.19 43.75 1smn s LEU 216 CO 0.00 -0.25 -0.10 -0.63 0.23 0.00 0.00 176.35 175.60 1smn s ILE 217 N -2.16 1.95 0.41 -0.59 1.01 -0.52 -4.57 121.20 116.73 1smn s ILE 217 Ca 0.39 -1.43 -0.12 0.00 0.00 0.00 0.00 60.65 59.48 1smn s ILE 217 Cb -0.08 -2.08 -0.07 0.00 0.01 0.00 0.00 42.46 40.24 1smn s ILE 217 CO 0.28 0.00 0.80 -0.63 0.00 0.00 0.00 174.94 175.39 1smn s ILE 218 N 1.21 4.73 -1.39 2.92 1.01 -1.26 -1.64 121.20 126.77 1smn s ILE 218 Ca -0.07 0.77 -0.01 0.00 0.00 0.00 0.00 60.65 61.34 1smn s ILE 218 Cb -0.19 -3.71 0.01 0.00 0.01 0.00 0.00 42.46 38.58 1smn s ILE 218 CO -0.06 -0.50 0.51 0.79 0.00 0.00 0.00 174.94 175.68 1smn n TRP 219 N -1.20 -1.73 0.67 3.97 8.01 -1.24 -4.82 117.44 121.10 1smn n TRP 219 Ca 0.03 0.78 0.07 0.00 -1.31 0.00 0.00 57.50 57.07 1smn n TRP 219 Cb 0.54 -3.89 0.36 0.00 -2.01 0.00 0.00 31.31 26.30 1smn n TRP 219 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1smn n ALA 220 N -4.37 1.81 0.92 6.99 0.00 -1.15 -2.42 120.51 122.28 1smn n ALA 220 Ca -0.29 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.20 1smn n ALA 220 Cb 0.68 -1.23 0.23 0.00 0.00 0.00 0.00 19.45 19.13 1smn n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1smn n GLY 221 N -0.08 0.96 3.80 0.00 0.00 0.19 -4.96 105.19 105.10 1smn n GLY 221 Ca 0.07 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 1smn n GLY 221 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1smn s LEU 222 N -1.82 3.86 0.55 0.99 1.43 -1.02 -4.89 118.68 117.78 1smn s LEU 222 Ca 0.33 1.87 -0.21 0.00 -1.03 0.00 0.00 54.13 55.08 1smn s LEU 222 Cb 0.21 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.82 1smn s LEU 222 CO 0.31 -0.68 1.23 -2.65 0.23 0.00 0.00 176.35 174.78 1smn n PRO 223 N -0.91 1.45 -0.34 1.29 -0.02 -1.26 -4.78 135.00 130.44 1smn n PRO 223 Ca 0.09 0.54 0.03 0.00 -2.02 0.00 0.00 63.50 62.14 1smn n PRO 223 Cb 0.53 -2.42 0.18 0.00 -0.02 0.00 0.00 33.50 31.77 1smn n PRO 223 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1smn h ASP 224 N 1.20 0.91 -0.04 2.55 3.32 -1.98 -1.68 116.42 120.70 1smn h ASP 224 Ca -0.49 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 56.50 1smn h ASP 224 Cb 1.32 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 1smn h ASP 224 CO 0.55 0.55 -0.20 -2.24 -1.72 0.00 0.00 179.24 176.18 1smn h ASP 225 N 1.02 0.41 -0.43 6.45 2.03 -1.99 0.37 116.42 124.28 1smn h ASP 225 Ca 0.43 -0.12 -0.09 0.00 -0.73 0.00 0.00 57.03 56.51 1smn h ASP 225 Cb 0.27 -0.11 -0.01 0.00 -0.83 0.00 0.00 39.33 38.65 1smn h ASP 225 CO -0.21 0.63 -0.10 0.58 -1.03 0.00 0.00 179.24 179.11 1smn h VAL 226 N 0.38 1.27 -0.26 4.15 2.07 -1.69 -1.33 116.25 120.84 1smn h VAL 226 Ca 0.06 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 1smn h VAL 226 Cb 0.57 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1smn h VAL 226 CO 0.04 0.41 0.12 1.56 0.02 0.00 0.00 177.57 179.72 1smn h GLN 227 N 0.65 0.37 -0.36 1.57 4.20 -1.02 -0.42 115.11 120.10 1smn h GLN 227 Ca 0.11 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1smn h GLN 227 Cb 0.63 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 1smn h GLN 227 CO 0.04 0.37 0.23 0.00 -0.67 0.00 0.00 178.83 178.81 1smn h ALA 228 N 0.98 0.46 0.12 3.87 0.00 -0.73 -2.32 119.26 121.65 1smn h ALA 228 Ca 0.09 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 54.67 1smn h ALA 228 Cb 0.13 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.79 1smn h ALA 228 CO -0.01 -0.06 -1.22 0.66 0.00 0.00 0.00 179.25 178.62 1smn h SER 229 N 0.48 0.74 1.03 0.00 4.64 -1.09 -3.36 113.55 116.00 1smn h SER 229 Ca 0.13 -0.70 -0.16 0.00 -0.47 0.00 0.00 61.79 60.60 1smn h SER 229 Cb -0.02 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.81 1smn h SER 229 CO -0.03 1.52 -1.03 -0.07 -0.87 0.00 0.00 176.83 176.35 1smn h LEU 230 N 0.22 0.00 -1.26 5.97 3.38 -1.09 -3.33 115.31 119.20 1smn h LEU 230 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1smn h LEU 230 Cb 1.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.65 1smn h LEU 230 CO 0.23 0.62 0.00 0.11 0.09 0.00 0.00 178.44 179.49 1smn h LYS 231 N 0.00 0.00 -0.50 1.13 1.57 -1.56 -1.93 116.57 115.29 1smn h LYS 231 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1smn h LYS 231 Cb 1.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.86 1smn h LYS 231 CO 0.07 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.38 1smn n SER 232 N -2.58 3.34 -4.15 0.86 7.64 -1.25 -0.81 113.62 116.68 1smn n SER 232 Ca 0.01 -1.99 -0.33 0.00 1.01 0.00 0.00 58.87 57.57 1smn n SER 232 Cb 0.21 -0.33 -0.15 0.00 -1.01 0.00 0.00 64.21 62.92 1smn n SER 232 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1smn s LYS 233 N -1.02 2.82 0.41 1.43 2.47 -0.73 -4.97 119.74 120.15 1smn s LYS 233 Ca 0.34 -0.96 -0.27 0.00 -1.56 0.00 0.00 55.97 53.52 1smn s LYS 233 Cb 0.18 -2.80 -0.10 0.00 -1.46 0.00 0.00 37.83 33.65 1smn s LYS 233 CO 0.23 -0.34 1.45 -2.30 0.16 0.00 0.00 175.35 174.55 1smn n PRO 234 N 4.61 2.45 -2.13 4.03 -0.02 -1.26 -4.86 135.00 137.82 1smn n PRO 234 Ca -0.18 0.86 -0.28 0.00 -2.02 0.00 0.00 63.50 61.89 1smn n PRO 234 Cb 0.48 -2.62 0.14 0.00 -0.02 0.00 0.00 33.50 31.47 1smn n PRO 234 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1smn s GLY 235 N -0.29 1.74 0.00 -1.23 0.00 -1.25 -5.02 107.32 101.27 1smn s GLY 235 Ca 0.57 -1.24 0.15 0.00 0.00 0.00 0.00 44.72 44.21 1smn s GLY 235 CO 0.61 -0.59 0.91 3.33 0.00 0.00 0.00 173.10 177.35 1smn n VAL 236 N -3.38 0.00 -0.31 1.40 0.24 -1.15 -4.52 118.33 110.61 1smn n VAL 236 Ca 0.13 -0.42 0.18 0.00 -2.04 0.00 0.00 64.34 62.19 1smn n VAL 236 Cb 0.60 1.25 0.43 0.00 -1.47 0.00 0.00 33.84 34.66 1smn n VAL 236 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1smn h LEU 237 N 2.39 0.57 -2.09 1.34 5.85 -1.72 -0.61 115.31 121.03 1smn h LEU 237 Ca 0.00 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1smn h LEU 237 Cb 0.58 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 1smn h LEU 237 CO 0.00 0.18 0.25 -0.65 -0.34 0.00 0.00 178.44 177.88 1smn h PRO 238 N 0.54 0.00 0.00 5.25 0.11 -1.79 0.15 132.00 136.26 1smn h PRO 238 Ca 0.56 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.66 1smn h PRO 238 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1smn h PRO 238 CO -0.30 0.00 -0.03 0.93 -0.21 0.00 0.00 178.00 178.39 1smn h GLU 239 N 0.00 0.00 -0.01 1.05 3.07 -1.27 0.60 114.58 118.02 1smn h GLU 239 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 1smn h GLU 239 Cb 0.63 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1smn h GLU 239 CO -0.00 0.03 -0.03 1.28 -1.40 0.00 0.00 179.01 178.89 1smn n LEU 240 N -4.11 0.88 -0.73 1.33 4.77 0.04 -3.29 117.00 115.89 1smn n LEU 240 Ca -0.03 -0.27 0.07 0.00 -0.03 0.00 0.00 56.01 55.75 1smn n LEU 240 Cb 0.12 -0.03 0.20 0.00 -2.33 0.00 0.00 43.42 41.37 1smn n LEU 240 CO 0.31 0.15 0.66 0.23 -1.33 0.00 0.00 177.39 177.41 1smn n MET 241 N -0.37 2.90 -0.30 3.23 2.81 0.11 -4.95 117.12 120.54 1smn n MET 241 Ca 0.20 -2.38 0.00 0.00 -1.81 0.00 0.00 57.70 53.71 1smn n MET 241 Cb 0.27 -1.51 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 1smn n MET 241 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1smn n GLY 242 N 0.06 0.73 3.89 3.03 0.00 -1.11 -5.00 105.19 106.80 1smn n GLY 242 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1smn n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1smn s LYS 244 N -4.01 1.50 0.00 0.00 1.02 -1.26 -4.20 119.74 112.79 1smn s LYS 244 Ca 0.48 -1.30 0.00 0.00 0.02 0.00 0.00 55.97 55.17 1smn s LYS 244 Cb -0.10 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.26 1smn s LYS 244 CO 0.34 0.46 0.00 0.09 -0.92 0.00 0.00 175.35 175.33