#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bsc s VAL 2 N 0.00 -0.00 0.00 0.00 0.11 -1.26 -1.45 120.40 117.81 2bsc s VAL 2 Ca 0.00 0.01 -0.00 0.00 -2.93 0.00 0.00 61.98 59.06 2bsc s VAL 2 Cb 0.00 -0.40 -0.01 0.00 -1.53 0.00 0.00 36.38 34.44 2bsc s VAL 2 CO 0.00 0.00 -0.00 -0.44 -3.33 0.00 0.00 175.10 171.33 2bsc s SER 3 N 0.24 0.07 -0.17 3.54 0.01 -0.48 -4.91 113.70 112.01 2bsc s SER 3 Ca -0.01 -0.15 -0.24 0.00 1.31 0.00 0.00 55.95 56.86 2bsc s SER 3 Cb -0.03 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 2bsc s SER 3 CO -0.00 -0.10 0.77 0.12 0.41 0.00 0.00 173.24 174.44 2bsc s PHE 4 N -0.48 3.42 0.00 2.43 5.36 -1.26 -0.26 117.98 127.19 2bsc s PHE 4 Ca -0.05 1.18 0.00 0.00 -0.96 0.00 0.00 56.93 57.09 2bsc s PHE 4 Cb -0.03 -2.95 0.00 0.00 -0.34 0.00 0.00 43.02 39.70 2bsc s PHE 4 CO -0.00 -0.20 0.41 0.44 -1.46 0.00 0.00 175.22 174.41 2bsc n ILE 5 N 4.66 0.03 -1.02 3.12 -5.35 0.57 -4.92 119.36 116.45 2bsc n ILE 5 Ca 0.03 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.10 2bsc n ILE 5 Cb 0.49 1.19 0.00 0.00 -1.74 0.00 0.00 39.64 39.58 2bsc n ILE 5 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2bsc n GLY 6 N -0.02 1.71 3.42 3.28 0.00 -0.49 -4.85 105.19 108.24 2bsc n GLY 6 Ca 0.00 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 2bsc n GLY 6 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bsc s SER 7 N -1.00 3.52 0.12 1.61 0.01 -1.26 -5.05 113.70 111.65 2bsc s SER 7 Ca 0.00 -0.59 -0.08 0.00 1.31 0.00 0.00 55.95 56.59 2bsc s SER 7 Cb 0.00 -0.40 -0.10 0.00 0.21 0.00 0.00 66.02 65.73 2bsc s SER 7 CO 0.00 0.22 1.31 0.74 0.41 0.00 0.00 173.24 175.92 2bsc h THR 8 N 3.91 1.34 -3.40 1.44 2.02 -1.92 -3.44 112.91 112.86 2bsc h THR 8 Ca -0.49 -2.22 -0.65 0.00 0.77 0.00 0.00 66.41 63.82 2bsc h THR 8 Cb 1.16 2.23 -0.25 0.00 -1.74 0.00 0.00 68.15 69.55 2bsc h THR 8 CO 0.44 0.68 -0.69 -1.61 0.37 0.00 0.00 175.52 174.70 2bsc s GLU 9 N -3.48 3.53 -0.04 6.66 0.41 -1.26 0.73 118.70 125.25 2bsc s GLU 9 Ca -0.08 -0.57 0.03 0.00 -0.41 0.00 0.00 54.97 53.94 2bsc s GLU 9 Cb 0.09 -3.00 0.01 0.00 -1.78 0.00 0.00 34.13 29.44 2bsc s GLU 9 CO 0.88 -0.01 -0.12 -0.80 -0.49 0.00 0.00 175.26 174.72 2bsc s ASN 10 N 1.03 1.57 -0.06 -0.19 0.01 -0.42 -4.98 114.94 111.90 2bsc s ASN 10 Ca 0.01 -0.25 -0.16 0.00 -0.71 0.00 0.00 52.86 51.74 2bsc s ASN 10 Cb -0.15 -0.54 -0.05 0.00 0.41 0.00 0.00 41.25 40.93 2bsc s ASN 10 CO 0.01 0.07 0.43 -1.81 -1.51 0.00 0.00 177.10 174.29 2bsc s ASP 11 N 0.34 6.73 -0.27 -1.22 1.01 -1.26 -0.58 116.67 121.42 2bsc s ASP 11 Ca -0.07 0.86 -0.10 0.00 0.71 0.00 0.00 52.55 53.95 2bsc s ASP 11 Cb -0.12 -2.26 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 2bsc s ASP 11 CO 0.02 0.16 0.17 -0.69 0.21 0.00 0.00 175.17 175.04 2bsc s VAL 12 N -0.18 5.19 0.00 -1.27 1.01 0.80 -4.57 120.40 121.37 2bsc s VAL 12 Ca 0.24 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.35 2bsc s VAL 12 Cb -0.16 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2bsc s VAL 12 CO 0.11 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2bsc n GLY 13 N 4.88 -1.65 3.76 4.51 0.00 0.01 -1.59 105.19 115.11 2bsc n GLY 13 Ca -0.14 -1.52 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 2bsc n GLY 13 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bsc s PRO 14 N -3.12 4.44 0.16 1.61 0.04 -1.26 -4.64 135.00 132.23 2bsc s PRO 14 Ca 0.00 2.06 -0.31 0.00 0.04 0.00 0.00 61.00 62.79 2bsc s PRO 14 Cb 0.00 -3.14 -0.11 0.00 0.04 0.00 0.00 34.50 31.30 2bsc s PRO 14 CO 0.00 -0.10 1.76 0.45 0.04 0.00 0.00 177.00 179.15 2bsc s SER 15 N -0.37 6.42 -1.34 6.66 0.15 -1.26 -2.35 113.70 121.60 2bsc s SER 15 Ca 0.50 2.79 -0.06 0.00 0.70 0.00 0.00 55.95 59.87 2bsc s SER 15 Cb -0.37 -2.58 0.01 0.00 -1.71 0.00 0.00 66.02 61.37 2bsc s SER 15 CO 0.46 -0.97 0.86 -0.11 1.20 0.00 0.00 173.24 174.67 2bsc n LEU 16 N 4.80 -2.99 -4.82 3.45 -0.00 0.16 -4.98 117.00 112.61 2bsc n LEU 16 Ca 0.17 -0.39 -0.33 0.00 -0.00 0.00 0.00 56.01 55.46 2bsc n LEU 16 Cb 0.37 -2.82 -0.03 0.00 -0.00 0.00 0.00 43.42 40.94 2bsc n LEU 16 CO 0.64 0.43 0.69 -0.83 -0.00 0.00 0.00 177.39 178.33 2bsc s GLY 17 N -3.04 2.18 0.00 -3.96 0.00 -0.99 -4.77 107.32 96.74 2bsc s GLY 17 Ca 0.43 0.32 0.06 0.00 0.00 0.00 0.00 44.72 45.52 2bsc s GLY 17 CO 0.53 0.61 -0.16 -0.56 0.00 0.00 0.00 173.10 173.52 2bsc s SER 18 N -2.74 3.89 -0.01 1.64 0.01 -1.26 -1.10 113.70 114.13 2bsc s SER 18 Ca 0.62 -0.32 0.01 0.00 1.31 0.00 0.00 55.95 57.56 2bsc s SER 18 Cb -0.12 -0.71 0.01 0.00 0.21 0.00 0.00 66.02 65.40 2bsc s SER 18 CO 0.29 0.30 -0.03 -0.31 0.41 0.00 0.00 173.24 173.89 2bsc s TYR 19 N -0.84 0.42 -0.27 2.43 2.02 -0.31 -4.97 117.35 115.83 2bsc s TYR 19 Ca 0.13 -0.08 -0.07 0.00 -0.37 0.00 0.00 57.07 56.69 2bsc s TYR 19 Cb -0.11 -0.34 -0.01 0.00 -0.40 0.00 0.00 41.96 41.11 2bsc s TYR 19 CO 0.03 -0.06 0.06 -1.12 -1.57 0.00 0.00 175.55 172.90 2bsc s SER 20 N 0.27 5.03 -0.02 2.29 0.01 -1.26 -0.45 113.70 119.56 2bsc s SER 20 Ca -0.03 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.75 2bsc s SER 20 Cb -0.06 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 64.29 2bsc s SER 20 CO -0.00 -0.12 -0.07 -0.76 0.41 0.00 0.00 173.24 172.69 2bsc s LEU 28 N 1.54 1.85 0.70 2.44 1.43 -1.26 -4.95 118.68 120.43 2bsc s LEU 28 Ca 0.04 -0.14 -0.11 0.00 -1.03 0.00 0.00 54.13 52.89 2bsc s LEU 28 Cb -0.16 -0.42 0.01 0.00 0.03 0.00 0.00 46.19 45.65 2bsc s LEU 28 CO 0.02 0.06 1.10 -2.16 0.23 0.00 0.00 176.35 175.60 2bsc s PRO 29 N 0.08 2.86 -0.02 1.29 0.04 -1.26 -5.11 135.00 132.88 2bsc s PRO 29 Ca -0.01 0.46 0.01 0.00 0.04 0.00 0.00 61.00 61.50 2bsc s PRO 29 Cb -0.06 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.46 2bsc s PRO 29 CO -0.00 -1.03 -0.04 -0.59 0.04 0.00 0.00 177.00 175.38 2bsc s PHE 30 N -3.36 0.52 0.04 0.56 -0.12 -1.01 -4.96 117.98 109.66 2bsc s PHE 30 Ca 0.58 -0.10 -0.25 0.00 -0.05 0.00 0.00 56.93 57.11 2bsc s PHE 30 Cb -0.11 -0.41 -0.06 0.00 -0.63 0.00 0.00 43.02 41.81 2bsc s PHE 30 CO 0.52 -0.07 0.75 0.08 -0.05 0.00 0.00 175.22 176.45 2bsc s VAL 31 N 0.29 4.73 0.00 -2.49 1.01 -1.26 -1.58 120.40 121.10 2bsc s VAL 31 Ca -0.03 1.60 0.00 0.00 0.00 0.00 0.00 61.98 63.55 2bsc s VAL 31 Cb -0.07 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.21 2bsc s VAL 31 CO -0.00 0.37 0.00 -1.22 0.00 0.00 0.00 175.10 174.25 2bsc n TYR 32 N 2.75 0.00 0.00 5.22 4.02 -0.48 -5.01 117.16 123.67 2bsc n TYR 32 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 2bsc n TYR 32 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 2bsc n TYR 32 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2bsc n THR 34 N 0.00 0.00 0.00 -0.72 -2.24 -1.26 -4.78 114.28 105.27 2bsc n THR 34 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2bsc n THR 34 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2bsc n THR 34 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2bsc n ARG 35 N 0.00 0.00 -0.36 -0.78 0.00 -1.26 -1.41 116.66 112.84 2bsc n ARG 35 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 57.96 2bsc n ARG 35 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 32.46 32.76 2bsc n ARG 35 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2bsc n ASN 36 N 4.65 3.87 -0.23 6.15 3.02 -1.26 -4.56 115.26 126.89 2bsc n ASN 36 Ca 0.00 -2.05 -0.06 0.00 -0.03 0.00 0.00 54.58 52.44 2bsc n ASN 36 Cb 0.00 -0.46 0.04 0.00 -0.61 0.00 0.00 39.78 38.76 2bsc n ASN 36 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2bsc h LYS 37 N 3.88 0.90 -4.38 3.52 1.63 -1.59 -3.31 116.57 117.23 2bsc h LYS 37 Ca 0.00 -0.09 -0.76 0.00 -0.85 0.00 0.00 60.65 58.95 2bsc h LYS 37 Cb 1.00 -0.18 -0.21 0.00 -0.60 0.00 0.00 32.23 32.24 2bsc h LYS 37 CO 0.02 0.66 1.12 -0.89 -3.45 0.00 0.00 179.45 176.92 2bsc n ILE 38 N -4.55 4.36 -3.93 2.00 5.41 -1.26 -4.29 119.36 117.09 2bsc n ILE 38 Ca 0.05 -4.92 -0.11 0.00 1.00 0.00 0.00 62.75 58.77 2bsc n ILE 38 Cb 0.07 -2.49 -0.01 0.00 -0.71 0.00 0.00 39.64 36.50 2bsc n ILE 38 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2bsc s GLY 39 N 2.31 0.76 -0.04 7.39 0.00 -1.25 -1.29 107.32 115.20 2bsc s GLY 39 Ca 0.39 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 44.12 2bsc s GLY 39 CO -0.02 -0.57 -0.08 -0.47 0.00 0.00 0.00 173.10 171.96 2bsc s TYR 40 N -2.80 0.95 -0.02 1.90 5.04 0.39 -0.81 117.35 122.01 2bsc s TYR 40 Ca 0.21 -0.27 0.00 0.00 -2.44 0.00 0.00 57.07 54.57 2bsc s TYR 40 Cb -0.03 -0.73 0.02 0.00 0.35 0.00 0.00 41.96 41.56 2bsc s TYR 40 CO 0.14 -0.16 0.00 -1.14 -1.34 0.00 0.00 175.55 173.05 2bsc s GLN 41 N 0.54 0.13 -0.23 4.97 0.74 -1.26 -0.84 119.66 123.70 2bsc s GLN 41 Ca -0.09 0.07 -0.03 0.00 0.05 0.00 0.00 55.36 55.36 2bsc s GLN 41 Cb -0.12 -0.28 0.12 0.00 1.10 0.00 0.00 33.01 33.83 2bsc s GLN 41 CO 0.01 -0.09 0.34 1.21 -0.55 0.00 0.00 175.29 176.21 2bsc s ASN 42 N 0.68 0.51 0.27 6.67 3.84 -0.80 -5.02 114.94 121.09 2bsc s ASN 42 Ca -0.06 0.14 0.24 0.00 0.21 0.00 0.00 52.86 53.39 2bsc s ASN 42 Cb -0.09 0.93 0.98 0.00 -0.55 0.00 0.00 41.25 42.52 2bsc s ASN 42 CO -0.02 -0.30 1.73 0.00 -2.79 0.00 0.00 177.10 175.72 2bsc n ALA 43 N 5.35 1.74 -3.76 1.71 0.00 -1.26 -1.32 120.51 122.97 2bsc n ALA 43 Ca -0.04 0.08 -0.28 0.00 0.00 0.00 0.00 53.44 53.19 2bsc n ALA 43 Cb 0.50 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.42 2bsc n ALA 43 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2bsc s ASN 44 N -4.34 3.77 -0.13 0.00 0.01 -1.26 -2.33 114.94 110.66 2bsc s ASN 44 Ca 0.05 -3.26 0.12 0.00 -0.71 0.00 0.00 52.86 49.06 2bsc s ASN 44 Cb 0.10 -1.24 -0.17 0.00 0.41 0.00 0.00 41.25 40.35 2bsc s ASN 44 CO 0.42 -0.17 0.05 0.52 -1.51 0.00 0.00 177.10 176.41 2bsc n VAL 45 N 2.72 0.93 -4.06 1.60 0.31 -0.27 -3.98 118.33 115.58 2bsc n VAL 45 Ca 0.17 -0.58 -0.13 0.00 -0.01 0.00 0.00 64.34 63.79 2bsc n VAL 45 Cb 0.37 -0.64 -0.13 0.00 -0.91 0.00 0.00 33.84 32.54 2bsc n VAL 45 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 2bsc s TRP 46 N -2.33 0.49 -0.18 3.52 0.51 -0.86 -0.32 118.94 119.78 2bsc s TRP 46 Ca -0.07 -0.33 -0.07 0.00 -2.12 0.00 0.00 56.10 53.51 2bsc s TRP 46 Cb 0.04 -0.31 -0.04 0.00 -0.81 0.00 0.00 33.47 32.35 2bsc s TRP 46 CO 0.56 -0.07 0.06 -1.58 -0.51 0.00 0.00 176.95 175.41 2bsc s HIS 47 N -0.88 3.25 0.12 -1.98 5.65 0.64 -0.30 115.29 121.79 2bsc s HIS 47 Ca -0.06 0.07 0.06 0.00 0.25 0.00 0.00 55.06 55.39 2bsc s HIS 47 Cb -0.07 -2.06 -0.04 0.00 -1.18 0.00 0.00 32.58 29.24 2bsc s HIS 47 CO -0.00 0.17 -0.16 0.96 -0.65 0.00 0.00 174.74 175.07 2bsc s ILE 48 N 0.28 1.42 0.29 0.89 -5.25 -0.19 -1.38 121.20 117.26 2bsc s ILE 48 Ca 0.03 -1.65 -0.19 0.00 -0.99 0.00 0.00 60.65 57.85 2bsc s ILE 48 Cb -0.12 -1.50 0.02 0.00 2.95 0.00 0.00 42.46 43.81 2bsc s ILE 48 CO 0.00 -0.32 0.71 -0.94 -1.79 0.00 0.00 174.94 172.60 2bsc s SER 49 N -2.28 -0.20 -0.82 4.36 1.04 -0.52 -0.65 113.70 114.63 2bsc s SER 49 Ca 0.08 -0.72 -0.02 0.00 0.48 0.00 0.00 55.95 55.77 2bsc s SER 49 Cb -0.07 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.79 2bsc s SER 49 CO 0.04 -1.38 0.58 0.29 0.98 0.00 0.00 173.24 173.75 2bsc n LYS 50 N -0.46 -1.40 -0.94 4.02 5.02 -0.22 -1.33 118.16 122.84 2bsc n LYS 50 Ca -0.04 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 2bsc n LYS 50 Cb 0.59 -2.12 0.00 0.00 -0.02 0.00 0.00 35.03 33.48 2bsc n LYS 50 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bsc n GLY 51 N -1.63 0.55 3.72 0.72 0.00 0.29 -4.45 105.19 104.40 2bsc n GLY 51 Ca -0.30 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2bsc n GLY 51 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bsc s PHE 52 N -2.46 3.00 -0.16 1.61 5.36 -0.97 -4.63 117.98 119.72 2bsc s PHE 52 Ca 0.00 0.58 -0.03 0.00 -0.96 0.00 0.00 56.93 56.52 2bsc s PHE 52 Cb 0.00 -3.99 -0.02 0.00 -0.34 0.00 0.00 43.02 38.68 2bsc s PHE 52 CO 0.00 -3.63 -0.06 0.00 -1.46 0.00 0.00 175.22 170.07 2bsc s VAL 54 N 0.63 0.03 0.00 0.00 0.11 0.10 -1.90 120.40 119.37 2bsc s VAL 54 Ca -0.04 -0.28 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 2bsc s VAL 54 Cb -0.15 -0.49 0.00 0.00 -1.53 0.00 0.00 36.38 34.22 2bsc s VAL 54 CO 0.03 -0.16 0.00 0.61 -3.33 0.00 0.00 175.10 172.25 2bsc n GLY 55 N 2.09 5.07 2.92 6.54 0.00 0.23 -1.51 105.19 120.53 2bsc n GLY 55 Ca -0.18 -1.87 -0.11 0.00 0.00 0.00 0.00 46.02 43.87 2bsc n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bsc s LEU 56 N 0.00 2.02 0.11 0.99 1.43 -0.59 -0.40 118.68 122.23 2bsc s LEU 56 Ca 0.00 -0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.05 2bsc s LEU 56 Cb 0.00 0.09 -0.04 0.00 0.03 0.00 0.00 46.19 46.27 2bsc s LEU 56 CO 0.00 -0.11 -0.19 -1.81 0.23 0.00 0.00 176.35 174.48 2bsc s ASP 57 N -0.49 3.85 0.07 2.29 1.01 -0.23 -1.05 116.67 122.12 2bsc s ASP 57 Ca -0.05 -0.56 0.04 0.00 0.71 0.00 0.00 52.55 52.69 2bsc s ASP 57 Cb -0.03 -0.53 -0.03 0.00 1.01 0.00 0.00 42.92 43.33 2bsc s ASP 57 CO -0.00 0.18 -0.11 -0.83 0.21 0.00 0.00 175.17 174.62 2bsc s GLY 58 N -2.08 0.78 -0.08 0.21 0.00 0.18 -1.28 107.32 105.06 2bsc s GLY 58 Ca 0.17 -1.01 -0.05 0.00 0.00 0.00 0.00 44.72 43.83 2bsc s GLY 58 CO 0.09 -1.06 0.19 1.25 0.00 0.00 0.00 173.10 173.58 2bsc s LYS 59 N -2.06 0.17 -0.16 2.90 2.20 -0.22 -0.19 119.74 122.39 2bsc s LYS 59 Ca -0.01 0.40 -0.04 0.00 -0.36 0.00 0.00 55.97 55.96 2bsc s LYS 59 Cb -0.08 -0.08 -0.03 0.00 -1.51 0.00 0.00 37.83 36.14 2bsc s LYS 59 CO 0.01 -0.13 -0.04 0.08 -0.36 0.00 0.00 175.35 174.92 2bsc s VAL 60 N 0.90 3.87 -1.47 4.02 1.01 -1.26 -1.10 120.40 126.38 2bsc s VAL 60 Ca -0.07 -0.37 0.23 0.00 0.00 0.00 0.00 61.98 61.77 2bsc s VAL 60 Cb -0.08 -2.69 -0.07 0.00 0.00 0.00 0.00 36.38 33.54 2bsc s VAL 60 CO -0.05 0.49 1.10 0.47 0.00 0.00 0.00 175.10 177.11 2bsc n ASP 61 N 3.55 1.33 -4.77 3.32 8.00 -0.18 -4.24 116.55 123.55 2bsc n ASP 61 Ca -0.17 -1.09 -0.36 0.00 0.71 0.00 0.00 54.79 53.87 2bsc n ASP 61 Cb 0.52 0.63 0.00 0.00 -0.02 0.00 0.00 41.12 42.25 2bsc n ASP 61 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2bsc s LEU 62 N -2.75 3.82 0.44 0.64 1.43 -1.24 -4.98 118.68 116.04 2bsc s LEU 62 Ca 0.14 2.25 -0.24 0.00 -1.03 0.00 0.00 54.13 55.24 2bsc s LEU 62 Cb 0.17 -4.47 -0.08 0.00 0.03 0.00 0.00 46.19 41.84 2bsc s LEU 62 CO 0.70 -1.16 1.23 -2.16 0.23 0.00 0.00 176.35 175.19 2bsc s PRO 63 N -3.10 3.84 -0.16 1.29 0.04 -1.26 -4.80 135.00 130.85 2bsc s PRO 63 Ca 0.70 1.96 -0.21 0.00 0.04 0.00 0.00 61.00 63.50 2bsc s PRO 63 Cb -0.26 -2.58 -0.03 0.00 0.04 0.00 0.00 34.50 31.67 2bsc s PRO 63 CO 0.30 -0.54 0.61 0.08 0.04 0.00 0.00 177.00 177.50 2bsc s VAL 64 N -1.39 5.06 -1.20 -0.36 1.01 -1.26 -0.41 120.40 121.84 2bsc s VAL 64 Ca 0.60 1.18 0.10 0.00 0.00 0.00 0.00 61.98 63.87 2bsc s VAL 64 Cb -0.33 -3.94 0.12 0.00 0.00 0.00 0.00 36.38 32.23 2bsc s VAL 64 CO 0.42 0.18 0.89 1.33 0.00 0.00 0.00 175.10 177.92 2bsc n VAL 65 N 4.32 0.18 -3.64 2.92 0.24 0.29 -4.89 118.33 117.75 2bsc n VAL 65 Ca -0.02 -0.59 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 2bsc n VAL 65 Cb 0.50 1.09 0.00 0.00 -1.47 0.00 0.00 33.84 33.96 2bsc n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bsc n GLY 66 N 0.55 -0.87 3.38 7.63 0.00 -1.20 -4.97 105.19 109.70 2bsc n GLY 66 Ca 0.07 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 2bsc n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bsc s SER 67 N -4.00 -0.41 -0.04 1.61 1.04 -1.26 -0.81 113.70 109.82 2bsc s SER 67 Ca 0.00 0.05 -0.02 0.00 0.48 0.00 0.00 55.95 56.46 2bsc s SER 67 Cb 0.00 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.65 2bsc s SER 67 CO 0.00 -0.77 0.07 -0.76 0.98 0.00 0.00 173.24 172.75 2bsc s LEU 68 N -2.22 0.13 -1.57 2.42 1.43 0.78 -4.86 118.68 114.79 2bsc s LEU 68 Ca -0.03 0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 2bsc s LEU 68 Cb -0.00 -0.12 0.09 0.00 0.03 0.00 0.00 46.19 46.19 2bsc s LEU 68 CO -0.05 -0.25 0.73 0.47 0.23 0.00 0.00 176.35 177.48 2bsc n ASP 69 N 5.30 -2.76 0.00 2.29 8.00 -1.26 -1.89 116.55 126.23 2bsc n ASP 69 Ca -0.03 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.52 2bsc n ASP 69 Cb 0.50 -3.13 0.00 0.00 -0.02 0.00 0.00 41.12 38.47 2bsc n ASP 69 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bsc n GLY 70 N -1.63 0.89 3.28 0.44 0.00 -1.26 -5.06 105.19 101.85 2bsc n GLY 70 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 2bsc n GLY 70 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bsc s GLN 71 N -0.60 1.24 0.56 1.61 -2.07 -0.79 -4.89 119.66 114.71 2bsc s GLN 71 Ca 0.00 -1.09 -0.19 0.00 -1.82 0.00 0.00 55.36 52.26 2bsc s GLN 71 Cb 0.00 -1.46 -0.05 0.00 -1.09 0.00 0.00 33.01 30.41 2bsc s GLN 71 CO 0.00 0.35 1.14 -1.12 -1.32 0.00 0.00 175.29 174.34 2bsc s SER 72 N -1.64 5.60 -0.28 12.60 0.01 -1.04 -0.15 113.70 128.80 2bsc s SER 72 Ca 0.07 2.19 -0.08 0.00 1.31 0.00 0.00 55.95 59.43 2bsc s SER 72 Cb -0.10 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.54 2bsc s SER 72 CO 0.03 -1.30 0.11 -0.63 0.41 0.00 0.00 173.24 171.86 2bsc s ILE 73 N -1.80 4.46 -0.06 1.44 1.01 0.01 -4.49 121.20 121.76 2bsc s ILE 73 Ca 0.73 -0.30 -0.14 0.00 0.00 0.00 0.00 60.65 60.94 2bsc s ILE 73 Cb -0.24 -3.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.99 2bsc s ILE 73 CO 0.29 0.20 0.36 -0.31 0.00 0.00 0.00 174.94 175.48 2bsc s TYR 74 N 1.61 3.63 0.12 3.97 2.02 0.37 -0.55 117.35 128.52 2bsc s TYR 74 Ca 0.05 0.84 -0.23 0.00 -0.37 0.00 0.00 57.07 57.36 2bsc s TYR 74 Cb -0.16 -2.29 -0.07 0.00 -0.40 0.00 0.00 41.96 39.04 2bsc s TYR 74 CO 0.05 0.51 0.68 0.20 -1.57 0.00 0.00 175.55 175.43 2bsc s GLY 75 N -0.53 2.80 -0.03 0.71 0.00 0.45 0.21 107.32 110.93 2bsc s GLY 75 Ca 0.21 0.21 -0.05 0.00 0.00 0.00 0.00 44.72 45.10 2bsc s GLY 75 CO 0.10 0.70 -0.10 1.04 0.00 0.00 0.00 173.10 174.84 2bsc n LEU 76 N 1.73 0.96 0.00 0.66 4.77 -0.39 -4.41 117.00 120.33 2bsc n LEU 76 Ca -0.08 0.15 -0.21 0.00 -0.03 0.00 0.00 56.01 55.84 2bsc n LEU 76 Cb 0.50 -0.34 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2bsc n LEU 76 CO 0.44 -0.24 -0.11 0.35 -1.33 0.00 0.00 177.39 176.50 2bsc n THR 77 N -3.57 0.00 0.04 -5.08 -2.24 -0.48 -4.98 114.28 97.97 2bsc n THR 77 Ca -0.10 -2.42 0.02 0.00 -2.27 0.00 0.00 64.05 59.29 2bsc n THR 77 Cb 0.37 1.14 0.39 0.00 -2.10 0.00 0.00 70.33 70.13 2bsc n THR 77 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2bsc h GLU 78 N 0.00 0.43 0.00 -0.78 5.08 -1.99 -3.12 114.58 114.21 2bsc h GLU 78 Ca -0.25 -0.06 -0.23 0.00 -1.00 0.00 0.00 59.36 57.81 2bsc h GLU 78 Cb 1.20 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 2bsc h GLU 78 CO 0.38 0.41 -1.68 0.39 -1.00 0.00 0.00 179.01 177.50 2bsc n GLU 79 N -4.37 0.64 -4.97 2.33 1.02 -1.26 -3.78 120.64 110.25 2bsc n GLU 79 Ca 0.01 0.20 -0.27 0.00 -0.02 0.00 0.00 57.16 57.08 2bsc n GLU 79 Cb 0.17 -1.75 -0.16 0.00 -0.02 0.00 0.00 31.44 29.68 2bsc n GLU 79 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2bsc s VAL 80 N -2.78 1.60 0.37 2.62 1.01 -1.18 0.08 120.40 122.13 2bsc s VAL 80 Ca -0.05 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.13 2bsc s VAL 80 Cb 0.08 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 2bsc s VAL 80 CO 0.82 0.45 0.11 0.61 0.00 0.00 0.00 175.10 177.10 2bsc n GLY 81 N 2.92 3.39 3.08 4.51 0.00 0.78 -1.26 105.19 118.61 2bsc n GLY 81 Ca -0.17 -2.13 -0.11 0.00 0.00 0.00 0.00 46.02 43.61 2bsc n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bsc s LEU 82 N 0.00 1.65 -0.12 0.99 1.43 0.13 -0.98 118.68 121.78 2bsc s LEU 82 Ca 0.15 -0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 53.01 2bsc s LEU 82 Cb 0.01 0.56 -0.04 0.00 0.03 0.00 0.00 46.19 46.76 2bsc s LEU 82 CO 0.11 -0.32 0.05 -0.76 0.23 0.00 0.00 176.35 175.66 2bsc s LEU 83 N -1.22 3.85 -0.00 1.79 1.43 -0.66 -0.48 118.68 123.39 2bsc s LEU 83 Ca -0.13 0.22 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 2bsc s LEU 83 Cb -0.07 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 2bsc s LEU 83 CO 0.01 0.34 -0.13 -0.63 0.23 0.00 0.00 176.35 176.17 2bsc s ILE 84 N -0.62 1.01 -0.00 -0.59 1.01 -1.26 -1.76 121.20 118.99 2bsc s ILE 84 Ca 0.11 -0.58 0.05 0.00 0.00 0.00 0.00 60.65 60.23 2bsc s ILE 84 Cb -0.12 -0.85 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 2bsc s ILE 84 CO 0.02 0.25 -0.17 0.26 0.00 0.00 0.00 174.94 175.30 2bsc s TRP 85 N -0.35 1.55 0.02 3.97 0.51 0.32 -1.20 118.94 123.76 2bsc s TRP 85 Ca 0.04 -0.30 0.01 0.00 -2.12 0.00 0.00 56.10 53.73 2bsc s TRP 85 Cb -0.05 -0.98 -0.01 0.00 -0.81 0.00 0.00 33.47 31.61 2bsc s TRP 85 CO -0.00 -0.01 -0.04 -1.64 -0.51 0.00 0.00 176.95 174.74 2bsc s MET 86 N -0.52 0.33 0.00 4.98 -1.94 -0.77 -1.08 119.30 120.30 2bsc s MET 86 Ca 0.06 -0.46 0.00 0.00 -1.71 0.00 0.00 55.69 53.58 2bsc s MET 86 Cb -0.07 -0.11 0.00 0.00 2.01 0.00 0.00 34.83 36.66 2bsc s MET 86 CO -0.00 0.01 0.00 0.41 -0.01 0.00 0.00 175.02 175.43 2bsc n GLY 87 N 2.07 -0.62 3.52 -0.03 0.00 -0.74 0.31 105.19 109.71 2bsc n GLY 87 Ca -0.19 -0.83 -0.28 0.00 0.00 0.00 0.00 46.02 44.71 2bsc n GLY 87 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bsc s ASP 88 N -4.00 1.19 0.16 1.61 2.15 -1.26 -0.91 116.67 115.62 2bsc s ASP 88 Ca 0.00 1.45 -0.31 0.00 0.43 0.00 0.00 52.55 54.12 2bsc s ASP 88 Cb 0.00 -2.22 -0.06 0.00 -0.30 0.00 0.00 42.92 40.34 2bsc s ASP 88 CO 0.00 -4.06 1.54 0.74 -0.17 0.00 0.00 175.17 173.22 2bsc h THR 89 N -2.53 0.00 -2.85 1.71 2.02 -1.74 -3.14 112.91 106.38 2bsc h THR 89 Ca -0.61 0.00 -0.53 0.00 0.77 0.00 0.00 66.41 66.04 2bsc h THR 89 Cb 1.33 0.00 0.02 0.00 -1.74 0.00 0.00 68.15 67.76 2bsc h THR 89 CO 0.52 0.00 0.86 -0.54 0.37 0.00 0.00 175.52 176.73 2bsc s LYS 90 N -5.53 4.26 0.37 6.66 1.02 -1.26 -4.32 119.74 120.94 2bsc s LYS 90 Ca -0.12 2.16 0.15 0.00 0.02 0.00 0.00 55.97 58.18 2bsc s LYS 90 Cb 0.11 -3.44 1.02 0.00 -0.52 0.00 0.00 37.83 35.01 2bsc s LYS 90 CO 0.62 -0.59 1.77 1.88 -0.92 0.00 0.00 175.35 178.11 2bsc h TYR 91 N 7.56 0.77 0.00 3.18 0.99 -1.98 0.64 116.97 128.13 2bsc h TYR 91 Ca -0.41 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.35 2bsc h TYR 91 Cb 1.20 -0.22 0.00 0.00 1.00 0.00 0.00 36.73 38.70 2bsc h TYR 91 CO 0.72 0.08 0.00 -1.13 -0.00 0.00 0.00 178.16 177.83 2bsc n SER 92 N -4.69 0.00 -0.63 3.88 3.41 -1.26 -1.57 113.62 112.76 2bsc n SER 92 Ca 0.25 0.33 0.13 0.00 -0.26 0.00 0.00 58.87 59.32 2bsc n SER 92 Cb 0.81 -0.41 0.39 0.00 -0.26 0.00 0.00 64.21 64.74 2bsc n SER 92 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2bsc n ARG 93 N -1.41 1.87 -1.78 4.33 5.12 0.22 -4.97 116.66 120.03 2bsc n ARG 93 Ca 0.04 -1.27 -0.39 0.00 -1.93 0.00 0.00 57.85 54.30 2bsc n ARG 93 Cb 0.13 -1.46 0.03 0.00 -1.16 0.00 0.00 32.46 29.99 2bsc n ARG 93 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2bsc s GLY 94 N -1.90 2.91 -0.20 -0.13 0.00 -0.61 -4.33 107.32 103.07 2bsc s GLY 94 Ca 0.35 1.43 -0.06 0.00 0.00 0.00 0.00 44.72 46.45 2bsc s GLY 94 CO 0.31 2.02 0.02 -1.59 0.00 0.00 0.00 173.10 173.86 2bsc s THR 95 N -1.23 4.17 0.16 0.90 2.01 0.15 -4.85 115.64 116.95 2bsc s THR 95 Ca 0.65 -0.24 -0.31 0.00 0.31 0.00 0.00 61.69 62.09 2bsc s THR 95 Cb -0.43 -2.89 -0.10 0.00 0.01 0.00 0.00 72.50 69.09 2bsc s THR 95 CO 0.54 0.43 1.69 0.00 -0.69 0.00 0.00 174.62 176.58 2bsc s ALA 96 N 0.88 3.81 0.04 7.40 0.00 -1.26 -1.84 121.76 130.79 2bsc s ALA 96 Ca 0.02 1.43 -0.15 0.00 0.00 0.00 0.00 51.96 53.26 2bsc s ALA 96 Cb -0.14 -3.69 -0.06 0.00 0.00 0.00 0.00 23.12 19.23 2bsc s ALA 96 CO 0.02 -0.97 0.46 -1.64 0.00 0.00 0.00 175.76 173.63 2bsc s MET 97 N 1.71 3.96 0.01 0.00 -1.94 -0.34 -4.96 119.30 117.74 2bsc s MET 97 Ca 0.74 0.46 -0.01 0.00 -1.71 0.00 0.00 55.69 55.17 2bsc s MET 97 Cb -0.46 -3.16 -0.01 0.00 2.01 0.00 0.00 34.83 33.21 2bsc s MET 97 CO 0.33 0.64 -0.01 -1.12 -0.01 0.00 0.00 175.02 174.85 2bsc s SER 98 N -1.24 0.18 0.58 3.03 0.01 -1.26 -2.48 113.70 112.52 2bsc s SER 98 Ca 0.28 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.15 2bsc s SER 98 Cb -0.17 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2bsc s SER 98 CO 0.16 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.16 2bsc n GLY 99 N 1.82 -1.40 0.06 3.44 0.00 -1.26 -4.58 105.19 103.28 2bsc n GLY 99 Ca -0.22 -1.17 0.06 0.00 0.00 0.00 0.00 46.02 44.69 2bsc n GLY 99 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bsc n ASN 100 N -1.34 2.12 -4.90 1.61 5.03 -1.26 -4.45 115.26 112.06 2bsc n ASN 100 Ca 0.00 -2.69 -0.20 0.00 0.87 0.00 0.00 54.58 52.56 2bsc n ASN 100 Cb 0.00 -0.28 -0.02 0.00 -1.02 0.00 0.00 39.78 38.45 2bsc n ASN 100 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2bsc s SER 101 N -2.19 5.54 0.21 6.41 0.01 -1.26 -4.65 113.70 117.77 2bsc s SER 101 Ca 0.21 -0.38 -0.30 0.00 1.31 0.00 0.00 55.95 56.78 2bsc s SER 101 Cb 0.18 -1.07 -0.10 0.00 0.21 0.00 0.00 66.02 65.25 2bsc s SER 101 CO 0.02 -0.38 1.43 0.26 0.41 0.00 0.00 173.24 174.97 2bsc s TRP 102 N -2.26 3.10 0.06 2.43 0.52 -1.26 -4.52 118.94 117.00 2bsc s TRP 102 Ca 0.42 1.00 0.05 0.00 0.02 0.00 0.00 56.10 57.59 2bsc s TRP 102 Cb -0.07 -3.78 -0.03 0.00 -1.15 0.00 0.00 33.47 28.45 2bsc s TRP 102 CO 0.28 -2.58 -0.14 -1.21 0.02 0.00 0.00 176.95 173.32 2bsc s GLU 103 N 0.05 0.84 -0.31 4.98 0.41 0.74 -4.91 118.70 120.51 2bsc s GLU 103 Ca 0.61 -0.87 -0.29 0.00 -0.41 0.00 0.00 54.97 54.01 2bsc s GLU 103 Cb -0.40 -0.85 0.00 0.00 -1.78 0.00 0.00 34.13 31.10 2bsc s GLU 103 CO 0.39 0.20 1.33 1.21 -0.49 0.00 0.00 175.26 177.90 2bsc s ASN 104 N -1.51 6.62 0.00 -0.19 3.04 -1.26 0.51 114.94 122.14 2bsc s ASN 104 Ca -0.01 1.19 0.11 0.00 0.04 0.00 0.00 52.86 54.19 2bsc s ASN 104 Cb -0.09 -2.54 -0.01 0.00 -1.54 0.00 0.00 41.25 37.06 2bsc s ASN 104 CO 0.02 -1.13 0.64 1.33 -3.04 0.00 0.00 177.10 174.92 2bsc n VAL 105 N 6.31 0.00 -3.30 -5.21 0.24 -0.21 -4.90 118.33 111.26 2bsc n VAL 105 Ca 0.15 -0.37 -0.03 0.00 -2.04 0.00 0.00 64.34 62.05 2bsc n VAL 105 Cb 0.47 1.11 -0.05 0.00 -1.47 0.00 0.00 33.84 33.90 2bsc n VAL 105 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 2bsc s PHE 106 N -1.48 -1.19 0.42 6.34 5.36 -1.05 -4.25 117.98 122.14 2bsc s PHE 106 Ca 0.08 1.34 0.16 0.00 -0.96 0.00 0.00 56.93 57.56 2bsc s PHE 106 Cb 0.09 0.32 1.05 0.00 -0.34 0.00 0.00 43.02 44.13 2bsc s PHE 106 CO 0.29 -0.77 1.90 0.66 -1.46 0.00 0.00 175.22 175.84 2bsc h SER 107 N 8.09 0.41 -5.00 6.13 4.64 -1.90 -1.57 113.55 124.35 2bsc h SER 107 Ca -0.21 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2bsc h SER 107 Cb 1.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2bsc h SER 107 CO 0.25 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 177.02 2bsc n GLY 108 N -1.52 1.73 3.57 -0.77 0.00 -1.26 -4.58 105.19 102.36 2bsc n GLY 108 Ca 0.16 -2.08 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 2bsc n GLY 108 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2bsc s TRP 109 N -1.88 0.05 -0.08 1.61 1.48 -0.57 -4.94 118.94 114.60 2bsc s TRP 109 Ca 0.00 -0.41 0.04 0.00 -1.06 0.00 0.00 56.10 54.67 2bsc s TRP 109 Cb 0.00 0.34 0.00 0.00 -1.16 0.00 0.00 33.47 32.65 2bsc s TRP 109 CO 0.00 -0.96 -0.21 0.00 -4.06 0.00 0.00 176.95 171.72 2bsc s VAL 111 N 0.35 4.24 0.62 0.00 0.11 -0.61 -4.97 120.40 120.14 2bsc s VAL 111 Ca -0.15 1.06 -0.18 0.00 -2.93 0.00 0.00 61.98 59.78 2bsc s VAL 111 Cb -0.17 -3.59 -0.06 0.00 -1.53 0.00 0.00 36.38 31.04 2bsc s VAL 111 CO 0.07 -0.62 0.68 0.61 -3.33 0.00 0.00 175.10 172.50 2bsc n GLY 112 N -1.36 -1.10 0.28 6.54 0.00 -1.26 -2.47 105.19 105.82 2bsc n GLY 112 Ca 0.07 -0.21 0.14 0.00 0.00 0.00 0.00 46.02 46.02 2bsc n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bsc h ALA 113 N 0.16 1.41 0.00 4.61 0.00 -1.93 0.92 119.26 124.43 2bsc h ALA 113 Ca -0.47 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 2bsc h ALA 113 Cb 1.38 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.05 2bsc h ALA 113 CO 0.47 0.07 -0.61 -1.71 0.00 0.00 0.00 179.25 177.47 2bsc n ASN 114 N -3.74 1.51 -4.16 0.00 5.15 -1.26 -4.07 115.26 108.69 2bsc n ASN 114 Ca -0.02 -3.27 -0.15 0.00 -0.60 0.00 0.00 54.58 50.53 2bsc n ASN 114 Cb 0.15 -0.45 -0.10 0.00 -0.53 0.00 0.00 39.78 38.85 2bsc n ASN 114 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2bsc s THR 115 N -2.23 0.24 0.13 -0.44 -4.23 -1.07 -4.93 115.64 103.10 2bsc s THR 115 Ca 0.35 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.92 2bsc s THR 115 Cb 0.36 -2.55 -0.04 0.00 1.34 0.00 0.00 72.50 71.61 2bsc s THR 115 CO -0.09 0.00 -0.15 0.00 -0.54 0.00 0.00 174.62 173.85 2bsc s ALA 116 N -3.90 1.57 0.00 3.99 0.00 -1.26 -1.06 121.76 121.10 2bsc s ALA 116 Ca 0.38 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2bsc s ALA 116 Cb 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2bsc s ALA 116 CO 0.14 0.12 0.00 0.45 0.00 0.00 0.00 175.76 176.47 2bsc n SER 117 N 0.49 0.00 -4.23 0.00 2.88 0.18 -4.99 113.62 107.95 2bsc n SER 117 Ca -0.15 -0.33 -0.13 0.00 -1.33 0.00 0.00 58.87 56.93 2bsc n SER 117 Cb 0.57 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.93 2bsc n SER 117 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2bsc s THR 118 N -2.86 0.73 -0.11 2.46 -4.23 -1.26 -1.02 115.64 109.34 2bsc s THR 118 Ca 0.00 -1.98 0.03 0.00 -1.18 0.00 0.00 61.69 58.56 2bsc s THR 118 Cb 0.00 -2.01 0.01 0.00 1.34 0.00 0.00 72.50 71.84 2bsc s THR 118 CO 0.00 -0.58 -0.21 -1.58 -0.54 0.00 0.00 174.62 171.71 2bsc s GLN 119 N -3.88 2.77 0.00 3.99 2.00 0.59 -4.85 119.66 120.27 2bsc s GLN 119 Ca 0.21 -0.78 0.00 0.00 -2.00 0.00 0.00 55.36 52.79 2bsc s GLN 119 Cb 0.06 -2.18 0.00 0.00 0.80 0.00 0.00 33.01 31.69 2bsc s GLN 119 CO 0.02 0.07 0.00 0.41 -0.50 0.00 0.00 175.29 175.29 2bsc n GLY 120 N 3.80 5.49 3.69 2.59 0.00 -0.98 -1.12 105.19 118.67 2bsc n GLY 120 Ca -0.20 -2.10 -0.03 0.00 0.00 0.00 0.00 46.02 43.69 2bsc n GLY 120 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2bsc s LEU 121 N 0.00 -0.18 -0.03 0.99 0.05 -0.43 -4.08 118.68 114.99 2bsc s LEU 121 Ca 0.00 -0.29 -0.15 0.00 0.05 0.00 0.00 54.13 53.74 2bsc s LEU 121 Cb 0.00 1.98 0.03 0.00 -2.05 0.00 0.00 46.19 46.14 2bsc s LEU 121 CO 0.00 -0.74 0.33 -0.94 -0.55 0.00 0.00 176.35 174.46 2bsc s SER 122 N -2.87 -0.24 -0.03 1.48 1.04 -0.09 -1.91 113.70 111.10 2bsc s SER 122 Ca 0.12 0.20 0.02 0.00 0.48 0.00 0.00 55.95 56.76 2bsc s SER 122 Cb -0.00 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.51 2bsc s SER 122 CO -0.01 -0.41 -0.06 -0.69 0.98 0.00 0.00 173.24 173.05 2bsc s VAL 123 N -1.12 0.56 0.00 5.02 1.01 -0.02 -1.79 120.40 124.06 2bsc s VAL 123 Ca -0.12 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 2bsc s VAL 123 Cb -0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 2bsc s VAL 123 CO 0.04 0.20 0.04 -0.60 0.00 0.00 0.00 175.10 174.77 2bsc s ARG 124 N 0.38 0.25 0.04 2.72 3.52 -0.24 -0.46 118.95 125.16 2bsc s ARG 124 Ca -0.05 -0.31 -0.01 0.00 -0.13 0.00 0.00 55.73 55.23 2bsc s ARG 124 Cb -0.09 0.10 -0.03 0.00 -1.56 0.00 0.00 34.95 33.37 2bsc s ARG 124 CO 0.00 -0.05 -0.03 0.14 -0.81 0.00 0.00 175.30 174.56 2bsc s VAL 125 N -0.90 0.19 -0.04 7.11 -7.23 -0.41 -0.52 120.40 118.60 2bsc s VAL 125 Ca -0.10 -1.54 0.01 0.00 -1.81 0.00 0.00 61.98 58.54 2bsc s VAL 125 Cb -0.06 -1.15 0.02 0.00 0.56 0.00 0.00 36.38 35.75 2bsc s VAL 125 CO -0.00 -0.85 -0.05 0.42 -0.31 0.00 0.00 175.10 174.30 2bsc s THR 126 N -3.21 0.58 0.58 5.32 -4.23 -0.72 -4.45 115.64 109.51 2bsc s THR 126 Ca 0.00 -0.17 -0.20 0.00 -1.18 0.00 0.00 61.69 60.15 2bsc s THR 126 Cb 0.03 -0.59 -0.04 0.00 1.34 0.00 0.00 72.50 73.24 2bsc s THR 126 CO -0.07 0.23 1.27 -2.84 -0.54 0.00 0.00 174.62 172.67 2bsc s PRO 127 N 0.80 3.00 -0.06 3.99 0.02 -1.26 -1.65 135.00 139.83 2bsc s PRO 127 Ca -0.11 2.01 -0.01 0.00 0.02 0.00 0.00 61.00 62.90 2bsc s PRO 127 Cb -0.14 -2.06 0.03 0.00 0.02 0.00 0.00 34.50 32.35 2bsc s PRO 127 CO 0.01 -1.23 0.01 0.08 -0.33 0.00 0.00 177.00 175.53 2bsc s VAL 128 N -1.45 0.28 -0.22 3.83 1.01 -0.15 -1.38 120.40 122.32 2bsc s VAL 128 Ca 0.76 0.17 -0.25 0.00 0.00 0.00 0.00 61.98 62.66 2bsc s VAL 128 Cb -0.35 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 2bsc s VAL 128 CO 0.39 0.24 0.84 -0.63 0.00 0.00 0.00 175.10 175.94 2bsc s ILE 129 N 1.92 4.84 -0.20 2.22 -1.09 -0.62 -0.15 121.20 128.12 2bsc s ILE 129 Ca 0.04 1.61 -0.00 0.00 -2.23 0.00 0.00 60.65 60.06 2bsc s ILE 129 Cb -0.12 -4.13 -0.21 0.00 -1.58 0.00 0.00 42.46 36.42 2bsc s ILE 129 CO -0.04 -0.05 0.03 0.18 -1.23 0.00 0.00 174.94 173.82 2bsc n LEU 130 N 5.81 2.66 -3.97 2.97 4.77 0.11 -2.41 117.00 126.94 2bsc n LEU 130 Ca 0.06 0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.90 2bsc n LEU 130 Cb 0.48 -0.89 -0.14 0.00 -2.33 0.00 0.00 43.42 40.54 2bsc n LEU 130 CO 0.48 0.87 -0.40 -0.54 -1.33 0.00 0.00 177.39 176.47 2bsc s LYS 131 N -2.54 0.39 -0.01 3.23 -0.14 -1.17 -4.75 119.74 114.76 2bsc s LYS 131 Ca -0.28 -0.29 0.01 0.00 -1.36 0.00 0.00 55.97 54.05 2bsc s LYS 131 Cb 0.08 -0.32 -0.04 0.00 -1.68 0.00 0.00 37.83 35.87 2bsc s LYS 131 CO 0.68 0.08 -0.01 0.50 -0.76 0.00 0.00 175.35 175.85 2bsc s ARG 132 N -0.44 2.79 0.03 1.68 3.52 -1.26 -4.59 118.95 120.68 2bsc s ARG 132 Ca -0.01 -0.59 -0.01 0.00 -0.13 0.00 0.00 55.73 54.98 2bsc s ARG 132 Cb -0.04 -2.67 -0.00 0.00 -1.56 0.00 0.00 34.95 30.68 2bsc s ARG 132 CO -0.00 0.63 -0.03 0.27 -0.81 0.00 0.00 175.30 175.37 2bsc n ASN 133 N 1.53 0.61 0.00 -2.12 2.04 -1.26 -5.14 115.26 110.92 2bsc n ASN 133 Ca -0.15 0.08 0.00 0.00 -0.44 0.00 0.00 54.58 54.07 2bsc n ASN 133 Cb 0.53 -0.23 0.00 0.00 -2.53 0.00 0.00 39.78 37.54 2bsc n ASN 133 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 2bsc n ARG 137 N -3.06 0.00 -4.02 -3.83 1.74 -1.26 -5.13 116.66 101.09 2bsc n ARG 137 Ca -0.01 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.85 2bsc n ARG 137 Cb 0.04 0.00 -0.17 0.00 -1.02 0.00 0.00 32.46 31.31 2bsc n ARG 137 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2bsc s TYR 138 N 0.00 0.80 -0.08 -1.55 1.51 0.27 -4.94 117.35 113.36 2bsc s TYR 138 Ca 0.00 -0.25 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 2bsc s TYR 138 Cb 0.00 -0.77 -0.02 0.00 -0.11 0.00 0.00 41.96 41.06 2bsc s TYR 138 CO 0.00 -0.27 -0.14 -1.12 -1.11 0.00 0.00 175.55 172.92 2bsc s SER 139 N 1.33 4.03 0.02 2.29 0.01 -1.26 -0.17 113.70 119.96 2bsc s SER 139 Ca -0.04 -0.24 0.08 0.00 1.31 0.00 0.00 55.95 57.05 2bsc s SER 139 Cb -0.13 -1.13 -0.02 0.00 0.21 0.00 0.00 66.02 64.95 2bsc s SER 139 CO -0.02 0.28 -0.23 -0.69 0.41 0.00 0.00 173.24 172.99 2bsc s VAL 140 N -0.35 1.84 0.60 3.43 1.01 -0.80 -5.02 120.40 121.12 2bsc s VAL 140 Ca 0.03 -1.18 0.05 0.00 0.00 0.00 0.00 61.98 60.89 2bsc s VAL 140 Cb -0.13 -1.57 0.09 0.00 0.00 0.00 0.00 36.38 34.77 2bsc s VAL 140 CO 0.02 0.35 0.83 -1.10 0.00 0.00 0.00 175.10 175.20 2bsc s GLN 141 N -0.99 2.17 0.10 2.72 -1.52 -1.26 -2.41 119.66 118.47 2bsc s GLN 141 Ca 0.09 -1.33 -0.31 0.00 -1.95 0.00 0.00 55.36 51.86 2bsc s GLN 141 Cb -0.09 -2.54 -0.10 0.00 -0.22 0.00 0.00 33.01 30.06 2bsc s GLN 141 CO 0.01 -0.98 1.88 1.17 -0.25 0.00 0.00 175.29 177.12 2bsc n LYS 142 N -2.41 2.83 -4.28 2.91 4.81 -1.26 -4.51 118.16 116.25 2bsc n LYS 142 Ca 0.14 1.03 -0.18 0.00 -0.87 0.00 0.00 58.31 58.43 2bsc n LYS 142 Cb 0.61 -2.94 -0.15 0.00 0.02 0.00 0.00 35.03 32.57 2bsc n LYS 142 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2bsc s THR 143 N 3.18 0.60 0.11 3.15 2.01 -0.85 -4.94 115.64 118.90 2bsc s THR 143 Ca 0.84 -0.29 -0.31 0.00 0.31 0.00 0.00 61.69 62.23 2bsc s THR 143 Cb -0.47 -0.52 -0.08 0.00 0.01 0.00 0.00 72.50 71.44 2bsc s THR 143 CO 0.38 0.18 1.39 -0.55 -0.69 0.00 0.00 174.62 175.33 2bsc s SER 144 N 0.02 6.83 -0.22 3.53 0.15 -1.26 0.48 113.70 123.22 2bsc s SER 144 Ca 0.00 2.32 -0.16 0.00 0.70 0.00 0.00 55.95 58.81 2bsc s SER 144 Cb -0.05 -2.59 -0.11 0.00 -1.71 0.00 0.00 66.02 61.57 2bsc s SER 144 CO -0.00 -0.65 -0.24 -0.38 1.20 0.00 0.00 173.24 173.17 2bsc n ILE 145 N 3.96 1.51 0.00 6.45 5.41 -0.03 -4.69 119.36 131.97 2bsc n ILE 145 Ca 0.11 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2bsc n ILE 145 Cb 0.42 -2.10 0.00 0.00 -0.71 0.00 0.00 39.64 37.26 2bsc n ILE 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2bsc n GLY 146 N 1.38 -0.62 3.53 7.39 0.00 -1.20 -1.01 105.19 114.66 2bsc n GLY 146 Ca -0.34 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.06 2bsc n GLY 146 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bsc s SER 147 N -4.00 -0.05 -0.01 1.61 0.01 -0.26 -1.28 113.70 109.72 2bsc s SER 147 Ca 0.00 -1.00 0.01 0.00 1.31 0.00 0.00 55.95 56.27 2bsc s SER 147 Cb 0.00 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.79 2bsc s SER 147 CO 0.00 -1.09 -0.04 -0.63 0.41 0.00 0.00 173.24 171.88 2bsc s ILE 148 N -4.04 0.39 -0.01 1.44 1.01 -0.72 -1.06 121.20 118.22 2bsc s ILE 148 Ca 0.25 -0.16 0.05 0.00 0.00 0.00 0.00 60.65 60.79 2bsc s ILE 148 Cb 0.01 -0.37 -0.01 0.00 0.01 0.00 0.00 42.46 42.09 2bsc s ILE 148 CO 0.10 0.14 -0.15 0.00 0.00 0.00 0.00 174.94 175.02 2bsc s ARG 149 N 0.21 1.29 0.47 2.79 1.70 -0.40 -1.52 118.95 123.49 2bsc s ARG 149 Ca -0.02 -0.55 -0.23 0.00 -0.47 0.00 0.00 55.73 54.46 2bsc s ARG 149 Cb -0.06 -1.23 -0.07 0.00 -0.57 0.00 0.00 34.95 33.02 2bsc s ARG 149 CO -0.00 0.32 1.18 0.00 -1.08 0.00 0.00 175.30 175.72 2bsc s MET 150 N -0.32 3.67 -0.44 3.89 0.23 -0.32 -1.07 119.30 124.95 2bsc s MET 150 Ca 0.05 1.81 0.03 0.00 -1.03 0.00 0.00 55.69 56.55 2bsc s MET 150 Cb -0.06 -2.37 0.12 0.00 -1.53 0.00 0.00 34.83 30.99 2bsc s MET 150 CO -0.00 -0.64 0.20 0.50 -2.03 0.00 0.00 175.02 173.05 2bsc s ARG 151 N -2.75 1.49 0.69 3.16 3.52 0.46 -4.82 118.95 120.71 2bsc s ARG 151 Ca 0.65 -2.10 -0.14 0.00 -0.13 0.00 0.00 55.73 54.01 2bsc s ARG 151 Cb -0.29 -2.78 0.02 0.00 -1.56 0.00 0.00 34.95 30.33 2bsc s ARG 151 CO 0.36 -1.09 1.11 -2.14 -0.81 0.00 0.00 175.30 172.73 2bsc s PRO 152 N 0.36 2.61 0.37 5.12 0.02 -1.26 -0.60 135.00 141.62 2bsc s PRO 152 Ca 0.15 1.37 -0.05 0.00 0.02 0.00 0.00 61.00 62.49 2bsc s PRO 152 Cb -0.23 -1.93 0.02 0.00 0.02 0.00 0.00 34.50 32.38 2bsc s PRO 152 CO -0.04 -1.40 0.58 2.48 -0.33 0.00 0.00 177.00 178.29 2bsc n TYR 153 N -2.70 -1.70 -1.90 6.54 0.18 -0.80 -4.88 117.16 111.90 2bsc n TYR 153 Ca 0.10 -2.31 -0.19 0.00 1.88 0.00 0.00 57.90 57.38 2bsc n TYR 153 Cb 0.52 0.66 -0.05 0.00 -0.38 0.00 0.00 39.34 40.09 2bsc n TYR 153 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 2bsc n ASN 154 N -1.59 -5.32 0.00 9.48 5.15 -1.26 -1.72 115.26 120.01 2bsc n ASN 154 Ca -0.02 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.22 2bsc n ASN 154 Cb 0.61 -4.42 0.00 0.00 -0.53 0.00 0.00 39.78 35.44 2bsc n ASN 154 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bsc n GLY 155 N -0.83 0.81 3.76 8.20 0.00 -1.26 -5.01 105.19 110.86 2bsc n GLY 155 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2bsc n GLY 155 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bsc s SER 156 N -2.74 5.08 -0.03 1.61 0.01 -0.70 -5.03 113.70 111.91 2bsc s SER 156 Ca 0.00 2.21 0.08 0.00 1.31 0.00 0.00 55.95 59.55 2bsc s SER 156 Cb 0.00 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 2bsc s SER 156 CO 0.00 -1.66 -0.26 -0.55 0.41 0.00 0.00 173.24 171.18 2bsc s SER 157 N -2.03 3.08 0.32 2.44 0.15 -1.26 -4.38 113.70 112.01 2bsc s SER 157 Ca 0.72 -0.47 0.25 0.00 0.70 0.00 0.00 55.95 57.15 2bsc s SER 157 Cb -0.26 -0.41 1.12 0.00 -1.71 0.00 0.00 66.02 64.77 2bsc s SER 157 CO 0.37 0.31 1.74 0.00 1.20 0.00 0.00 173.24 176.86 2bsc h ALA 158 N 5.55 1.00 0.00 5.45 0.00 -1.95 -3.46 119.26 125.85 2bsc h ALA 158 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2bsc h ALA 158 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2bsc h ALA 158 CO 0.47 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.13 2bsc n GLY 159 N -0.44 2.04 3.00 0.00 0.00 -1.26 -2.30 105.19 106.23 2bsc n GLY 159 Ca 0.01 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2bsc n GLY 159 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bsc n SER 160 N 0.27 6.40 -3.85 1.61 3.41 -1.26 -4.96 113.62 115.23 2bsc n SER 160 Ca 0.00 -3.41 -0.12 0.00 -0.26 0.00 0.00 58.87 55.08 2bsc n SER 160 Cb 0.00 -1.27 -0.10 0.00 -0.26 0.00 0.00 64.21 62.58 2bsc n SER 160 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2bsc s VAL 161 N -2.78 0.07 -0.03 -3.33 1.01 -0.97 -4.94 120.40 109.43 2bsc s VAL 161 Ca 0.31 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 2bsc s VAL 161 Cb 0.05 -0.43 -0.06 0.00 0.00 0.00 0.00 36.38 35.94 2bsc s VAL 161 CO 0.10 -0.32 1.56 -1.58 0.00 0.00 0.00 175.10 174.86 2bsc s GLN 162 N -1.19 4.21 0.02 2.72 0.74 -1.26 -4.88 119.66 120.02 2bsc s GLN 162 Ca -0.13 2.11 0.19 0.00 0.05 0.00 0.00 55.36 57.59 2bsc s GLN 162 Cb -0.07 -3.79 -0.19 0.00 1.10 0.00 0.00 33.01 30.07 2bsc s GLN 162 CO 0.02 -0.74 0.64 0.25 -0.55 0.00 0.00 175.29 174.90 2bsc n THR 163 N 5.12 0.79 -4.85 -0.34 -2.24 -1.26 -4.79 114.28 106.71 2bsc n THR 163 Ca 0.16 -0.64 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 2bsc n THR 163 Cb 0.43 -0.41 -0.13 0.00 -2.10 0.00 0.00 70.33 68.11 2bsc n THR 163 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2bsc s THR 164 N -3.10 2.74 0.06 4.28 2.01 -1.26 -1.17 115.64 119.21 2bsc s THR 164 Ca -0.05 -1.03 0.04 0.00 0.31 0.00 0.00 61.69 60.96 2bsc s THR 164 Cb 0.10 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 2bsc s THR 164 CO 0.84 0.46 -0.13 0.68 -0.69 0.00 0.00 174.62 175.78 2bsc s VAL 165 N -0.81 0.97 0.25 3.82 -7.23 -0.57 -4.90 120.40 111.93 2bsc s VAL 165 Ca 0.13 -1.26 0.08 0.00 -1.81 0.00 0.00 61.98 59.12 2bsc s VAL 165 Cb -0.10 -0.97 -0.04 0.00 0.56 0.00 0.00 36.38 35.83 2bsc s VAL 165 CO 0.03 -0.27 0.08 0.20 -0.31 0.00 0.00 175.10 174.83 2bsc s ASN 166 N -1.72 5.00 -0.02 4.85 0.01 0.22 -1.76 114.94 121.53 2bsc s ASN 166 Ca -0.04 -0.44 0.03 0.00 -0.71 0.00 0.00 52.86 51.70 2bsc s ASN 166 Cb -0.10 -1.11 -0.00 0.00 0.41 0.00 0.00 41.25 40.45 2bsc s ASN 166 CO 0.02 -0.01 -0.12 -0.36 -1.51 0.00 0.00 177.10 175.13 2bsc s PHE 167 N -2.18 1.09 -0.01 2.20 0.08 -0.41 -1.29 117.98 117.45 2bsc s PHE 167 Ca 0.32 -0.24 0.05 0.00 0.12 0.00 0.00 56.93 57.18 2bsc s PHE 167 Cb -0.07 -0.73 -0.01 0.00 -0.57 0.00 0.00 43.02 41.64 2bsc s PHE 167 CO 0.22 -0.06 -0.16 -1.12 -0.10 0.00 0.00 175.22 174.01 2bsc s SER 168 N -0.11 1.85 -0.09 1.36 0.01 0.26 -0.85 113.70 116.13 2bsc s SER 168 Ca 0.01 -0.29 -0.30 0.00 1.31 0.00 0.00 55.95 56.69 2bsc s SER 168 Cb -0.06 -0.23 -0.01 0.00 0.21 0.00 0.00 66.02 65.92 2bsc s SER 168 CO 0.00 0.19 1.00 -0.22 0.41 0.00 0.00 173.24 174.62 2bsc s LEU 169 N -0.33 4.26 0.56 2.44 2.96 0.18 -0.14 118.68 128.61 2bsc s LEU 169 Ca 0.05 1.54 -0.18 0.00 -0.22 0.00 0.00 54.13 55.33 2bsc s LEU 169 Cb -0.06 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 2bsc s LEU 169 CO -0.00 -0.42 1.07 0.20 -1.32 0.00 0.00 176.35 175.88 2bsc s ASN 170 N 1.09 5.83 0.45 3.68 0.01 -0.62 -2.01 114.94 123.37 2bsc s ASN 170 Ca 0.49 1.95 -0.25 0.00 -0.71 0.00 0.00 52.86 54.33 2bsc s ASN 170 Cb -0.19 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 38.84 2bsc s ASN 170 CO 0.19 -1.14 1.38 -2.65 -1.51 0.00 0.00 177.10 173.37 2bsc n PRO 171 N -1.64 2.11 -4.00 -0.60 -0.02 -1.26 -4.77 135.00 124.82 2bsc n PRO 171 Ca 0.10 0.75 -0.10 0.00 -2.02 0.00 0.00 63.50 62.23 2bsc n PRO 171 Cb 0.52 -2.55 -0.07 0.00 -0.02 0.00 0.00 33.50 31.38 2bsc n PRO 171 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2bsc s PHE 172 N -1.20 0.49 -0.04 6.00 -0.12 -1.01 0.38 117.98 122.48 2bsc s PHE 172 Ca 0.62 -0.84 0.03 0.00 -0.05 0.00 0.00 56.93 56.70 2bsc s PHE 172 Cb -0.46 -0.06 0.00 0.00 -0.63 0.00 0.00 43.02 41.87 2bsc s PHE 172 CO 0.57 -0.78 -0.13 0.99 -0.05 0.00 0.00 175.22 175.82 2bsc s THR 173 N -4.01 1.11 -0.13 -4.49 2.01 -0.26 -1.91 115.64 107.97 2bsc s THR 173 Ca 0.22 -0.54 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 2bsc s THR 173 Cb 0.03 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.54 2bsc s THR 173 CO 0.04 0.33 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.50 2bsc s LEU 174 N 0.16 3.24 -0.15 4.42 1.43 0.77 -1.16 118.68 127.38 2bsc s LEU 174 Ca -0.04 -0.09 -0.14 0.00 -1.03 0.00 0.00 54.13 52.82 2bsc s LEU 174 Cb -0.10 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2bsc s LEU 174 CO 0.01 0.22 0.31 0.20 0.23 0.00 0.00 176.35 177.32 2bsc s ASN 175 N 0.05 6.46 0.00 2.29 0.01 0.40 -0.57 114.94 123.58 2bsc s ASN 175 Ca -0.00 0.54 0.00 0.00 -0.71 0.00 0.00 52.86 52.68 2bsc s ASN 175 Cb -0.13 -2.19 0.00 0.00 0.41 0.00 0.00 41.25 39.34 2bsc s ASN 175 CO 0.03 0.10 0.00 -0.67 -1.51 0.00 0.00 177.10 175.04