#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2whs s VAL -6 N 0.00 0.04 0.27 1.96 -7.23 -1.26 -5.16 120.40 109.02 2whs s VAL -6 Ca 0.00 -0.34 -0.29 0.00 -1.81 0.00 0.00 61.98 59.54 2whs s VAL -6 Cb 0.00 -0.39 -0.09 0.00 0.56 0.00 0.00 36.38 36.46 2whs s VAL -6 CO 0.00 -0.19 1.17 -2.16 -0.31 0.00 0.00 175.10 173.62 2whs s PRO -5 N -0.67 4.54 -0.41 4.82 0.04 -1.26 -5.01 135.00 137.05 2whs s PRO -5 Ca -0.08 1.92 0.03 0.00 0.04 0.00 0.00 61.00 62.91 2whs s PRO -5 Cb -0.04 -3.17 0.16 0.00 0.04 0.00 0.00 34.50 31.49 2whs s PRO -5 CO 0.01 0.05 0.31 0.50 0.04 0.00 0.00 177.00 177.92 2whs s ARG -4 N -1.25 0.92 0.00 4.56 3.52 -1.26 -4.98 118.95 120.46 2whs s ARG -4 Ca 0.47 -1.99 0.00 0.00 -0.13 0.00 0.00 55.73 54.08 2whs s ARG -4 Cb -0.34 -1.53 0.00 0.00 -1.56 0.00 0.00 34.95 31.52 2whs s ARG -4 CO 0.43 -1.33 0.00 0.41 -0.81 0.00 0.00 175.30 173.99 2whs n GLY -3 N 3.10 1.05 3.32 8.12 0.00 -1.26 -5.15 105.19 114.37 2whs n GLY -3 Ca 0.24 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.01 2whs n GLY -3 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2whs s SER -2 N 0.00 2.71 -0.49 1.61 0.01 -1.26 -5.10 113.70 111.18 2whs s SER -2 Ca 0.00 -0.77 -0.24 0.00 1.31 0.00 0.00 55.95 56.25 2whs s SER -2 Cb 0.00 -0.16 0.03 0.00 0.21 0.00 0.00 66.02 66.10 2whs s SER -2 CO 0.00 0.04 0.88 -2.28 0.41 0.00 0.00 173.24 172.28 2whs s HIS -1 N -1.51 2.90 -0.01 2.43 2.46 -1.26 -5.04 115.29 115.26 2whs s HIS -1 Ca 0.11 0.15 -0.21 0.00 0.47 0.00 0.00 55.06 55.58 2whs s HIS -1 Cb -0.08 -3.89 -0.05 0.00 -0.13 0.00 0.00 32.58 28.42 2whs s HIS -1 CO 0.06 -1.15 0.63 -1.64 -2.47 0.00 0.00 174.74 170.17 2whs s MET 0 N 3.64 4.36 -0.02 2.88 -1.94 -1.26 -5.07 119.30 121.88 2whs s MET 0 Ca 0.32 0.79 -0.05 0.00 -1.71 0.00 0.00 55.69 55.03 2whs s MET 0 Cb -0.12 -3.37 0.01 0.00 2.01 0.00 0.00 34.83 33.36 2whs s MET 0 CO 0.22 0.30 0.13 0.54 -0.01 0.00 0.00 175.02 176.20 2whs s VAL 1 N 0.01 0.04 0.31 -6.03 0.11 -1.26 -5.15 120.40 108.44 2whs s VAL 1 Ca 0.33 -0.36 -0.19 0.00 -2.93 0.00 0.00 61.98 58.83 2whs s VAL 1 Cb -0.18 -0.30 -0.09 0.00 -1.53 0.00 0.00 36.38 34.27 2whs s VAL 1 CO 0.18 -0.20 0.80 -0.94 -3.33 0.00 0.00 175.10 171.61 2whs s SER 2 N -0.65 6.96 0.25 3.54 1.04 -1.26 -4.97 113.70 118.61 2whs s SER 2 Ca -0.07 1.46 -0.04 0.00 0.48 0.00 0.00 55.95 57.78 2whs s SER 2 Cb -0.04 -2.44 0.39 0.00 0.10 0.00 0.00 66.02 64.02 2whs s SER 2 CO 0.01 -0.15 1.85 0.58 0.98 0.00 0.00 173.24 176.51 2whs h VAL 3 N 2.26 1.01 -3.64 5.02 2.07 -1.98 -3.36 116.25 117.63 2whs h VAL 3 Ca -0.48 -0.34 -0.68 0.00 0.82 0.00 0.00 66.70 66.02 2whs h VAL 3 Cb 1.18 -0.06 -0.30 0.00 -1.52 0.00 0.00 31.29 30.59 2whs h VAL 3 CO 0.64 0.18 -0.66 -0.63 0.02 0.00 0.00 177.57 177.12 2whs s ILE 4 N -6.04 3.44 0.80 4.57 1.01 -1.26 -4.89 121.20 118.83 2whs s ILE 4 Ca -0.12 -1.05 -0.10 0.00 0.00 0.00 0.00 60.65 59.38 2whs s ILE 4 Cb 0.19 -2.86 0.11 0.00 0.01 0.00 0.00 42.46 39.91 2whs s ILE 4 CO 0.80 -0.01 1.13 0.00 0.00 0.00 0.00 174.94 176.86 2whs s ALA 5 N 1.38 2.85 -0.07 9.38 0.00 -1.26 -4.96 121.76 129.08 2whs s ALA 5 Ca -0.01 -1.00 0.31 0.00 0.00 0.00 0.00 51.96 51.26 2whs s ALA 5 Cb -0.18 -2.68 1.17 0.00 0.00 0.00 0.00 23.12 21.42 2whs s ALA 5 CO 0.00 -1.69 1.89 0.87 0.00 0.00 0.00 175.76 176.83 2whs h LYS 6 N -0.97 0.00 -3.84 0.00 1.57 -1.95 -3.41 116.57 107.98 2whs h LYS 6 Ca -0.44 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 57.93 2whs h LYS 6 Cb 1.30 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 33.25 2whs h LYS 6 CO 0.54 0.00 -0.77 -1.14 -0.57 0.00 0.00 179.45 177.52 2whs s GLN 7 N -3.55 0.65 0.14 3.15 2.00 -1.26 -4.05 119.66 116.75 2whs s GLN 7 Ca 0.03 0.02 0.04 0.00 -2.00 0.00 0.00 55.36 53.44 2whs s GLN 7 Cb 0.09 -0.84 -0.04 0.00 0.80 0.00 0.00 33.01 33.01 2whs s GLN 7 CO 0.54 -0.19 -0.10 -1.64 -0.50 0.00 0.00 175.29 173.41 2whs s MET 8 N 1.40 1.02 0.49 1.67 -1.94 -0.74 -5.02 119.30 116.18 2whs s MET 8 Ca -0.04 -1.42 0.04 0.00 -1.71 0.00 0.00 55.69 52.55 2whs s MET 8 Cb -0.13 -0.57 -0.02 0.00 2.01 0.00 0.00 34.83 36.12 2whs s MET 8 CO -0.03 0.06 0.09 0.95 -0.01 0.00 0.00 175.02 176.09 2whs s THR 9 N -3.32 1.53 0.09 2.05 -4.23 -0.13 -1.77 115.64 109.86 2whs s THR 9 Ca 0.16 -1.88 -0.17 0.00 -1.18 0.00 0.00 61.69 58.62 2whs s THR 9 Cb 0.03 -2.41 0.04 0.00 1.34 0.00 0.00 72.50 71.49 2whs s THR 9 CO -0.00 0.00 0.40 -0.72 -0.54 0.00 0.00 174.62 173.76 2whs s TYR 10 N -2.80 -0.23 -0.09 3.99 -0.85 -0.13 -1.15 117.35 116.10 2whs s TYR 10 Ca 0.20 0.03 0.04 0.00 -0.52 0.00 0.00 57.07 56.82 2whs s TYR 10 Cb 0.03 0.24 0.00 0.00 0.38 0.00 0.00 41.96 42.61 2whs s TYR 10 CO 0.11 -0.65 -0.22 0.21 -1.52 0.00 0.00 175.55 173.48 2whs s LYS 11 N -3.24 2.83 0.00 -3.49 2.47 -0.07 -1.26 119.74 116.98 2whs s LYS 11 Ca -0.01 -0.81 0.06 0.00 -1.56 0.00 0.00 55.97 53.65 2whs s LYS 11 Cb 0.01 -2.16 -0.03 0.00 -1.46 0.00 0.00 37.83 34.19 2whs s LYS 11 CO -0.08 0.16 -0.17 0.54 0.16 0.00 0.00 175.35 175.96 2whs s VAL 12 N 0.38 2.86 -0.15 4.02 0.11 -0.14 -0.84 120.40 126.63 2whs s VAL 12 Ca -0.18 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 57.88 2whs s VAL 12 Cb -0.18 -2.16 0.03 0.00 -1.53 0.00 0.00 36.38 32.55 2whs s VAL 12 CO 0.08 0.46 -0.10 -0.31 -3.33 0.00 0.00 175.10 171.90 2whs s TYR 13 N -0.83 1.91 -0.03 1.54 1.51 -0.23 -1.46 117.35 119.76 2whs s TYR 13 Ca 0.13 -1.12 0.07 0.00 -1.01 0.00 0.00 57.07 55.14 2whs s TYR 13 Cb -0.11 -1.44 -0.02 0.00 -0.11 0.00 0.00 41.96 40.29 2whs s TYR 13 CO 0.03 -0.63 -0.22 1.41 -1.11 0.00 0.00 175.55 175.03 2whs s MET 14 N 1.57 2.24 0.05 -0.62 1.75 0.62 -0.74 119.30 124.17 2whs s MET 14 Ca 0.03 -0.86 -0.00 0.00 -1.25 0.00 0.00 55.69 53.61 2whs s MET 14 Cb -0.14 -2.15 -0.04 0.00 2.84 0.00 0.00 34.83 35.35 2whs s MET 14 CO -0.09 0.58 -0.04 -1.54 -0.65 0.00 0.00 175.02 173.28 2whs s SER 15 N -0.64 0.58 0.00 1.11 1.04 -0.65 -0.65 113.70 114.49 2whs s SER 15 Ca 0.10 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.61 2whs s SER 15 Cb -0.10 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2whs s SER 15 CO -0.00 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.30 2whs n GLY 16 N 0.33 -1.51 2.96 7.32 0.00 -0.82 -1.71 105.19 111.77 2whs n GLY 16 Ca -0.15 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.61 2whs n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2whs s THR 17 N -2.42 0.85 -0.19 2.61 2.01 -0.84 -0.89 115.64 116.76 2whs s THR 17 Ca 0.00 -0.31 0.01 0.00 0.31 0.00 0.00 61.69 61.70 2whs s THR 17 Cb 0.00 -0.81 0.04 0.00 0.01 0.00 0.00 72.50 71.74 2whs s THR 17 CO 0.00 0.29 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.41 2whs s VAL 18 N 0.76 1.72 -1.45 3.82 1.01 -0.48 -1.26 120.40 124.52 2whs s VAL 18 Ca -0.13 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 60.82 2whs s VAL 18 Cb -0.15 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.56 2whs s VAL 18 CO 0.02 0.28 0.79 0.59 0.00 0.00 0.00 175.10 176.77 2whs n ASN 19 N 4.68 -2.74 0.00 3.32 4.13 0.58 -1.60 115.26 123.62 2whs n ASN 19 Ca -0.16 -0.85 0.00 0.00 1.68 0.00 0.00 54.58 55.25 2whs n ASN 19 Cb 0.47 -3.73 0.00 0.00 -1.54 0.00 0.00 39.78 34.98 2whs n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2whs n GLY 20 N -1.67 0.70 3.57 7.41 0.00 -1.26 -5.00 105.19 108.94 2whs n GLY 20 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2whs n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2whs s HIS 21 N -3.07 3.17 0.23 1.61 5.04 -0.63 -5.04 115.29 116.61 2whs s HIS 21 Ca 0.00 0.34 -0.27 0.00 -1.54 0.00 0.00 55.06 53.59 2whs s HIS 21 Cb 0.00 -3.04 -0.09 0.00 0.04 0.00 0.00 32.58 29.49 2whs s HIS 21 CO 0.00 -0.57 0.87 -0.47 -2.34 0.00 0.00 174.74 172.23 2whs s TYR 22 N 2.59 3.87 0.20 3.88 5.04 -1.26 -1.38 117.35 130.29 2whs s TYR 22 Ca 0.23 1.75 -0.16 0.00 -2.44 0.00 0.00 57.07 56.45 2whs s TYR 22 Cb -0.15 -2.87 0.02 0.00 0.35 0.00 0.00 41.96 39.32 2whs s TYR 22 CO 0.14 0.41 0.49 -0.59 -1.34 0.00 0.00 175.55 174.66 2whs s PHE 23 N -1.30 -0.02 0.01 4.97 -0.12 -0.07 -4.31 117.98 117.15 2whs s PHE 23 Ca 0.42 -0.33 0.01 0.00 -0.05 0.00 0.00 56.93 56.98 2whs s PHE 23 Cb -0.23 0.33 -0.01 0.00 -0.63 0.00 0.00 43.02 42.48 2whs s PHE 23 CO 0.27 -0.90 -0.05 -1.21 -0.05 0.00 0.00 175.22 173.28 2whs s GLU 24 N -3.90 0.36 0.01 1.99 2.02 -0.86 -1.94 118.70 116.39 2whs s GLU 24 Ca 0.11 -0.38 0.05 0.00 0.02 0.00 0.00 54.97 54.78 2whs s GLU 24 Cb -0.01 -0.23 -0.02 0.00 0.10 0.00 0.00 34.13 33.98 2whs s GLU 24 CO -0.01 0.05 -0.16 0.08 0.02 0.00 0.00 175.26 175.24 2whs s VAL 25 N -0.65 1.25 0.11 2.63 1.01 0.17 -0.33 120.40 124.60 2whs s VAL 25 Ca -0.04 -0.86 0.10 0.00 0.00 0.00 0.00 61.98 61.18 2whs s VAL 25 Cb -0.05 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 2whs s VAL 25 CO -0.00 0.21 -0.25 -1.61 0.00 0.00 0.00 175.10 173.45 2whs s GLU 26 N -0.76 1.33 -0.09 2.72 2.02 -0.68 -0.28 118.70 122.97 2whs s GLU 26 Ca 0.05 -1.26 -0.11 0.00 0.02 0.00 0.00 54.97 53.67 2whs s GLU 26 Cb -0.07 -1.72 0.03 0.00 0.10 0.00 0.00 34.13 32.46 2whs s GLU 26 CO 0.00 0.41 0.29 0.20 0.02 0.00 0.00 175.26 176.18 2whs s GLY 27 N -1.93 -0.19 -0.19 -1.39 0.00 -0.54 -1.22 107.32 101.86 2whs s GLY 27 Ca 0.11 0.68 -0.02 0.00 0.00 0.00 0.00 44.72 45.50 2whs s GLY 27 CO 0.05 0.55 -0.11 0.99 0.00 0.00 0.00 173.10 174.58 2whs s ASP 28 N -0.23 3.85 0.37 1.64 1.01 -0.19 -0.97 116.67 122.17 2whs s ASP 28 Ca -0.04 -0.47 0.05 0.00 0.71 0.00 0.00 52.55 52.80 2whs s ASP 28 Cb -0.03 -1.63 -0.06 0.00 1.01 0.00 0.00 42.92 42.21 2whs s ASP 28 CO 0.01 0.02 0.04 -0.83 0.21 0.00 0.00 175.17 174.62 2whs s GLY 29 N 1.23 2.33 0.04 0.21 0.00 -0.39 -1.00 107.32 109.75 2whs s GLY 29 Ca 0.03 -2.01 -0.26 0.00 0.00 0.00 0.00 44.72 42.48 2whs s GLY 29 CO -0.05 -1.95 0.60 -1.59 0.00 0.00 0.00 173.10 170.11 2whs s LYS 30 N -3.81 1.11 0.00 2.90 -2.85 -0.29 -0.95 119.74 115.84 2whs s LYS 30 Ca 0.33 -0.12 0.00 0.00 -1.00 0.00 0.00 55.97 55.19 2whs s LYS 30 Cb 0.08 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.37 2whs s LYS 30 CO 0.16 -0.41 0.00 0.41 0.10 0.00 0.00 175.35 175.61 2whs n GLY 31 N 0.37 0.60 2.97 0.59 0.00 -0.73 -0.95 105.19 108.04 2whs n GLY 31 Ca -0.18 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 2whs n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2whs s LYS 32 N -1.41 1.44 0.51 1.61 1.02 -0.12 -1.79 119.74 120.99 2whs s LYS 32 Ca 0.00 -1.88 0.17 0.00 0.02 0.00 0.00 55.97 54.29 2whs s LYS 32 Cb 0.00 -3.04 1.25 0.00 -0.52 0.00 0.00 37.83 35.52 2whs s LYS 32 CO 0.00 -0.97 2.11 -1.35 -0.92 0.00 0.00 175.35 174.22 2whs h PRO 33 N 7.50 0.00 -0.00 -1.68 0.11 -1.78 -1.57 132.00 134.58 2whs h PRO 33 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2whs h PRO 33 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2whs h PRO 33 CO 0.53 0.06 -0.15 0.66 -0.21 0.00 0.00 178.00 178.89 2whs n TYR 34 N -4.37 0.00 0.47 0.65 4.01 -1.26 -3.73 117.16 112.93 2whs n TYR 34 Ca -0.03 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.79 2whs n TYR 34 Cb 0.14 -0.35 -0.11 0.00 -0.31 0.00 0.00 39.34 38.71 2whs n TYR 34 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2whs n GLU 35 N -1.37 1.08 -1.72 -0.72 -0.58 -0.66 -4.66 120.64 112.01 2whs n GLU 35 Ca 0.09 -0.06 -0.02 0.00 -0.42 0.00 0.00 57.16 56.74 2whs n GLU 35 Cb 0.32 -1.34 -0.00 0.00 -0.57 0.00 0.00 31.44 29.85 2whs n GLU 35 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2whs n GLY 36 N 1.45 0.37 3.31 0.62 0.00 -0.79 -4.59 105.19 105.55 2whs n GLY 36 Ca 0.01 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 2whs n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2whs s GLU 37 N -3.47 3.03 0.11 1.61 2.02 -1.17 -1.28 118.70 119.55 2whs s GLU 37 Ca 0.00 -0.79 -0.10 0.00 0.02 0.00 0.00 54.97 54.10 2whs s GLU 37 Cb 0.00 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.83 2whs s GLU 37 CO 0.00 0.27 0.24 1.14 0.02 0.00 0.00 175.26 176.94 2whs s GLN 38 N 0.14 0.93 0.04 1.61 -2.07 -0.84 -0.95 119.66 118.52 2whs s GLN 38 Ca -0.10 -0.94 0.00 0.00 -1.82 0.00 0.00 55.36 52.50 2whs s GLN 38 Cb -0.16 0.37 -0.03 0.00 -1.09 0.00 0.00 33.01 32.10 2whs s GLN 38 CO 0.06 -0.32 -0.04 -0.08 -1.32 0.00 0.00 175.29 173.59 2whs s THR 39 N -3.86 0.27 -0.11 3.63 -1.32 -0.13 -1.56 115.64 112.55 2whs s THR 39 Ca 0.06 -1.37 -0.11 0.00 -1.21 0.00 0.00 61.69 59.06 2whs s THR 39 Cb 0.04 -0.92 0.03 0.00 -1.51 0.00 0.00 72.50 70.14 2whs s THR 39 CO -0.10 -0.71 0.31 0.54 -2.21 0.00 0.00 174.62 172.45 2whs s VAL 40 N -2.58 0.00 -0.20 5.08 0.11 -0.55 -1.14 120.40 121.12 2whs s VAL 40 Ca -0.04 -0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 58.98 2whs s VAL 40 Cb -0.02 -0.43 -0.01 0.00 -1.53 0.00 0.00 36.38 34.39 2whs s VAL 40 CO -0.05 -0.00 -0.06 -0.54 -3.33 0.00 0.00 175.10 171.13 2whs s LYS 41 N 0.15 3.41 0.10 1.54 1.02 -0.17 -1.75 119.74 124.05 2whs s LYS 41 Ca -0.00 -0.62 0.06 0.00 0.02 0.00 0.00 55.97 55.43 2whs s LYS 41 Cb -0.02 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 2whs s LYS 41 CO 0.00 -0.08 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.77 2whs s LEU 42 N 1.17 3.17 -0.07 3.17 2.01 0.11 -1.02 118.68 127.22 2whs s LEU 42 Ca 0.02 -0.33 0.01 0.00 0.01 0.00 0.00 54.13 53.84 2whs s LEU 42 Cb -0.14 -1.94 0.02 0.00 0.01 0.00 0.00 46.19 44.13 2whs s LEU 42 CO -0.01 0.17 -0.08 -0.89 1.01 0.00 0.00 176.35 176.55 2whs s THR 43 N -1.26 0.87 -0.21 5.49 2.01 -0.36 -1.60 115.64 120.58 2whs s THR 43 Ca 0.23 -0.28 -0.29 0.00 0.31 0.00 0.00 61.69 61.66 2whs s THR 43 Cb -0.11 -0.86 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2whs s THR 43 CO 0.15 0.31 1.56 -0.69 -0.69 0.00 0.00 174.62 175.27 2whs s VAL 44 N 1.10 3.77 -0.20 3.82 1.01 0.70 -1.69 120.40 128.91 2whs s VAL 44 Ca -0.07 0.88 0.11 0.00 0.00 0.00 0.00 61.98 62.89 2whs s VAL 44 Cb -0.14 -3.76 -0.22 0.00 0.00 0.00 0.00 36.38 32.26 2whs s VAL 44 CO -0.01 -0.29 0.05 0.35 0.00 0.00 0.00 175.10 175.20 2whs n THR 45 N 6.26 1.47 -4.20 3.92 -2.24 0.55 -4.83 114.28 115.21 2whs n THR 45 Ca 0.18 -0.74 -0.19 0.00 -2.27 0.00 0.00 64.05 61.02 2whs n THR 45 Cb 0.45 -0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 67.64 2whs n THR 45 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2whs s LYS 46 N -2.51 0.89 -1.50 -0.78 1.02 -1.08 -4.89 119.74 110.89 2whs s LYS 46 Ca -0.19 -1.01 0.00 0.00 0.02 0.00 0.00 55.97 54.80 2whs s LYS 46 Cb 0.07 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 36.44 2whs s LYS 46 CO 0.75 0.21 0.00 0.41 -0.92 0.00 0.00 175.35 175.80 2whs n GLY 47 N 1.21 0.16 3.97 -3.33 0.00 -1.26 -2.03 105.19 103.91 2whs n GLY 47 Ca -0.21 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.40 2whs n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2whs s GLY 48 N -2.39 1.29 0.42 -0.02 0.00 -1.26 -4.04 107.32 101.32 2whs s GLY 48 Ca 0.00 -1.21 -0.25 0.00 0.00 0.00 0.00 44.72 43.26 2whs s GLY 48 CO 0.00 -1.19 1.26 2.56 0.00 0.00 0.00 173.10 175.73 2whs s PRO 49 N -4.08 3.91 0.35 2.90 0.04 -1.26 -5.11 135.00 131.75 2whs s PRO 49 Ca 0.37 2.05 -0.28 0.00 0.04 0.00 0.00 61.00 63.18 2whs s PRO 49 Cb -0.09 -2.67 -0.09 0.00 0.04 0.00 0.00 34.50 31.68 2whs s PRO 49 CO 0.31 -0.50 1.21 -0.51 0.04 0.00 0.00 177.00 177.54 2whs s LEU 50 N -2.57 4.37 -0.05 -3.56 1.43 -1.26 -4.94 118.68 112.10 2whs s LEU 50 Ca 0.58 2.46 0.07 0.00 -1.03 0.00 0.00 54.13 56.21 2whs s LEU 50 Cb -0.36 -3.79 0.27 0.00 0.03 0.00 0.00 46.19 42.35 2whs s LEU 50 CO 0.45 -0.50 1.07 -0.81 0.23 0.00 0.00 176.35 176.79 2whs n PRO 51 N 0.61 2.06 -4.10 1.29 -0.04 -1.26 -4.91 135.00 128.65 2whs n PRO 51 Ca 0.01 -1.06 -0.10 0.00 -0.04 0.00 0.00 63.50 62.31 2whs n PRO 51 Cb 0.44 -1.52 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 2whs n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2whs s PHE 52 N -1.64 0.74 0.13 0.54 -0.12 -1.26 -4.66 117.98 111.71 2whs s PHE 52 Ca 0.19 -1.10 -0.31 0.00 -0.05 0.00 0.00 56.93 55.65 2whs s PHE 52 Cb 0.12 -0.36 -0.10 0.00 -0.63 0.00 0.00 43.02 42.05 2whs s PHE 52 CO 0.09 -0.58 1.73 0.00 -0.05 0.00 0.00 175.22 176.41 2whs s ALA 53 N -4.03 3.78 0.39 1.99 0.00 -0.39 -4.89 121.76 118.61 2whs s ALA 53 Ca 0.23 1.41 0.19 0.00 0.00 0.00 0.00 51.96 53.79 2whs s ALA 53 Cb 0.06 -3.72 1.13 0.00 0.00 0.00 0.00 23.12 20.60 2whs s ALA 53 CO 0.02 -1.08 1.74 2.35 0.00 0.00 0.00 175.76 178.79 2whs h TRP 54 N 7.94 0.68 0.00 0.00 2.91 -1.96 -2.92 115.95 122.60 2whs h TRP 54 Ca -0.44 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.60 2whs h TRP 54 Cb 1.21 -0.19 0.00 0.00 -0.51 0.00 0.00 29.16 29.67 2whs h TRP 54 CO 0.74 0.01 0.00 -0.44 -1.03 0.00 0.00 178.44 177.72 2whs h ASP 55 N 0.36 0.00 1.40 2.65 3.32 -1.94 0.17 116.42 122.38 2whs h ASP 55 Ca 0.64 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.69 2whs h ASP 55 Cb 1.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.20 2whs h ASP 55 CO -0.34 0.00 0.00 0.16 -1.72 0.00 0.00 179.24 177.34 2whs h ILE 56 N 0.00 0.00 0.00 0.35 3.07 -1.91 -3.28 117.51 115.74 2whs h ILE 56 Ca 0.00 -0.52 -0.23 0.00 1.55 0.00 0.00 64.86 65.67 2whs h ILE 56 Cb 0.09 1.47 -0.04 0.00 -0.27 0.00 0.00 36.82 38.07 2whs h ILE 56 CO 0.00 0.00 -1.71 0.18 -1.05 0.00 0.00 178.15 175.57 2whs n LEU 57 N -2.43 0.66 -0.28 0.16 4.77 0.59 -4.58 117.00 115.89 2whs n LEU 57 Ca 0.04 0.30 -0.01 0.00 -0.03 0.00 0.00 56.01 56.31 2whs n LEU 57 Cb 0.40 0.17 0.17 0.00 -2.33 0.00 0.00 43.42 41.84 2whs n LEU 57 CO 0.29 0.27 1.22 0.77 -1.33 0.00 0.00 177.39 178.61 2whs h SER 58 N 0.00 0.99 0.23 -1.43 4.64 -1.59 -0.68 113.55 115.70 2whs h SER 58 Ca -0.26 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2whs h SER 58 Cb 1.78 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 2whs h SER 58 CO 0.05 0.75 0.00 -2.65 -0.87 0.00 0.00 176.83 174.11 2whs n PRO 59 N -4.38 0.62 0.01 4.77 -0.02 -1.26 -2.75 135.00 131.99 2whs n PRO 59 Ca 0.09 0.02 0.11 0.00 -2.02 0.00 0.00 63.50 61.70 2whs n PRO 59 Cb 0.05 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.09 2whs n PRO 59 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2whs n GLN 60 N -1.13 0.13 -1.07 -0.52 1.13 -0.27 -4.80 117.38 110.85 2whs n GLN 60 Ca 0.16 -0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 55.00 2whs n GLN 60 Cb 0.14 -1.54 0.03 0.00 0.11 0.00 0.00 30.24 28.98 2whs n GLN 60 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2whs n LEU 61 N -1.72 6.72 0.00 1.08 4.77 -1.11 -4.97 117.00 121.78 2whs n LEU 61 Ca 0.03 -3.62 0.00 0.00 -0.03 0.00 0.00 56.01 52.40 2whs n LEU 61 Cb 0.38 -1.07 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 2whs n LEU 61 CO 0.39 1.35 0.00 -0.24 -1.33 0.00 0.00 177.39 177.56 2whs n SER 65 N 0.17 0.00 0.23 -1.43 2.88 -1.26 -5.01 113.62 109.19 2whs n SER 65 Ca 0.39 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 58.01 2whs n SER 65 Cb 0.58 0.00 0.54 0.00 -0.75 0.00 0.00 64.21 64.58 2whs n SER 65 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2whs h ILE 66 N 0.00 0.87 0.00 2.46 1.08 -2.00 -2.71 117.51 117.22 2whs h ILE 66 Ca 0.00 -0.88 0.00 0.00 -0.39 0.00 0.00 64.86 63.59 2whs h ILE 66 Cb 0.00 1.52 0.00 0.00 -3.07 0.00 0.00 36.82 35.27 2whs h ILE 66 CO 0.00 0.22 0.00 -2.65 -0.69 0.00 0.00 178.15 175.03 2whs n PRO 67 N -3.84 0.04 -1.19 2.37 -0.02 -1.26 -2.51 135.00 128.59 2whs n PRO 67 Ca -0.02 0.54 -0.23 0.00 -2.02 0.00 0.00 63.50 61.76 2whs n PRO 67 Cb 0.32 -1.62 0.01 0.00 -0.02 0.00 0.00 33.50 32.19 2whs n PRO 67 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2whs n PHE 68 N -1.70 1.84 -4.72 6.00 3.01 -1.02 -4.70 117.46 116.16 2whs n PHE 68 Ca -0.00 -2.11 -0.33 0.00 1.01 0.00 0.00 57.45 56.01 2whs n PHE 68 Cb 0.01 -1.17 -0.14 0.00 -0.01 0.00 0.00 39.48 38.17 2whs n PHE 68 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2whs s THR 69 N -2.73 3.24 -0.22 4.37 2.01 -1.04 -3.99 115.64 117.28 2whs s THR 69 Ca 0.46 -0.60 -0.29 0.00 0.31 0.00 0.00 61.69 61.56 2whs s THR 69 Cb 0.33 -2.36 0.00 0.00 0.01 0.00 0.00 72.50 70.49 2whs s THR 69 CO -0.10 0.53 1.10 -0.75 -0.69 0.00 0.00 174.62 174.72 2whs s LYS 70 N 0.15 4.24 -0.10 4.92 2.20 -0.18 -4.66 119.74 126.31 2whs s LYS 70 Ca -0.06 1.41 -0.03 0.00 -0.36 0.00 0.00 55.97 56.94 2whs s LYS 70 Cb -0.15 -3.68 -0.03 0.00 -1.51 0.00 0.00 37.83 32.46 2whs s LYS 70 CO 0.04 -0.67 0.01 0.71 -0.36 0.00 0.00 175.35 175.08 2whs s TYR 71 N 3.32 3.18 0.66 4.03 1.51 -1.26 -0.91 117.35 127.89 2whs s TYR 71 Ca 0.47 0.17 -0.14 0.00 -1.01 0.00 0.00 57.07 56.56 2whs s TYR 71 Cb -0.16 -1.83 -0.00 0.00 -0.11 0.00 0.00 41.96 39.85 2whs s TYR 71 CO 0.09 0.42 1.08 -1.25 -1.11 0.00 0.00 175.55 174.78 2whs s PRO 72 N -0.70 2.91 0.40 -1.71 0.04 -1.26 -4.92 135.00 129.75 2whs s PRO 72 Ca 0.11 1.22 0.28 0.00 0.04 0.00 0.00 61.00 62.66 2whs s PRO 72 Cb -0.12 -1.98 1.33 0.00 0.04 0.00 0.00 34.50 33.77 2whs s PRO 72 CO 0.02 -1.14 1.85 0.93 0.04 0.00 0.00 177.00 178.70 2whs h GLU 73 N -0.14 0.00 -0.01 4.56 5.08 -2.02 -2.13 114.58 119.93 2whs h GLU 73 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2whs h GLU 73 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2whs h GLU 73 CO 0.55 0.00 -0.38 -0.40 -1.00 0.00 0.00 179.01 177.78 2whs n ASP 74 N -2.54 1.05 -4.31 1.42 5.75 -1.26 -4.72 116.55 111.94 2whs n ASP 74 Ca 0.00 -0.85 -0.36 0.00 -0.01 0.00 0.00 54.79 53.57 2whs n ASP 74 Cb 0.17 0.25 -0.13 0.00 -1.03 0.00 0.00 41.12 40.38 2whs n ASP 74 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2whs s ILE 75 N -2.63 3.68 0.26 2.12 1.01 -0.80 -4.97 121.20 119.88 2whs s ILE 75 Ca 0.20 -0.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.78 2whs s ILE 75 Cb 0.19 -2.89 -0.14 0.00 0.01 0.00 0.00 42.46 39.63 2whs s ILE 75 CO 0.58 0.12 1.23 -2.65 0.00 0.00 0.00 174.94 174.22 2whs n PRO 76 N 4.81 1.71 -3.19 2.79 -0.02 -1.26 -4.66 135.00 135.18 2whs n PRO 76 Ca -0.15 0.60 -0.45 0.00 -2.02 0.00 0.00 63.50 61.48 2whs n PRO 76 Cb 0.48 -2.13 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2whs n PRO 76 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2whs s ASP 77 N -0.13 6.41 0.28 2.55 -1.08 -1.26 -4.55 116.67 118.89 2whs s ASP 77 Ca 0.64 -1.94 0.02 0.00 -0.52 0.00 0.00 52.55 50.74 2whs s ASP 77 Cb -0.68 -2.27 0.63 0.00 -1.46 0.00 0.00 42.92 39.14 2whs s ASP 77 CO 0.56 -0.90 1.74 0.22 0.52 0.00 0.00 175.17 177.30 2whs h TYR 78 N 8.68 0.76 0.02 -5.34 3.20 -1.91 -1.62 116.97 120.77 2whs h TYR 78 Ca -0.12 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.78 2whs h TYR 78 Cb 1.07 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.14 2whs h TYR 78 CO 0.92 0.10 -0.01 0.74 -1.64 0.00 0.00 178.16 178.26 2whs h PHE 79 N 0.55 -0.03 -0.46 -3.82 0.04 -1.93 -2.95 116.94 108.35 2whs h PHE 79 Ca 0.51 -0.00 -0.11 0.00 2.80 0.00 0.00 57.97 61.17 2whs h PHE 79 Cb 0.84 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.98 2whs h PHE 79 CO -0.10 0.58 -0.15 0.87 -0.60 0.00 0.00 178.31 178.92 2whs h LYS 80 N -0.66 0.86 0.00 1.51 1.57 -1.88 -2.90 116.57 115.07 2whs h LYS 80 Ca -0.00 -0.32 -0.02 0.00 -1.87 0.00 0.00 60.65 58.43 2whs h LYS 80 Cb 0.62 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 2whs h LYS 80 CO 0.00 0.96 -0.11 1.96 -0.57 0.00 0.00 179.45 181.69 2whs h GLN 81 N 0.77 0.00 0.00 3.15 4.20 -1.32 -3.02 115.11 118.89 2whs h GLN 81 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2whs h GLN 81 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 2whs h GLN 81 CO 0.05 0.11 0.00 -1.13 -0.67 0.00 0.00 178.83 177.19 2whs n SER 82 N -3.69 0.56 -4.91 1.46 3.41 -1.10 -4.80 113.62 104.55 2whs n SER 82 Ca -0.02 0.61 -0.27 0.00 -0.26 0.00 0.00 58.87 58.93 2whs n SER 82 Cb 0.22 -0.74 -0.01 0.00 -0.26 0.00 0.00 64.21 63.42 2whs n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2whs s PHE 83 N -3.20 3.52 -0.67 7.33 0.40 -1.14 0.12 117.98 124.34 2whs s PHE 83 Ca 0.07 0.73 0.23 0.00 -0.60 0.00 0.00 56.93 57.36 2whs s PHE 83 Cb 0.11 -2.21 0.90 0.00 0.51 0.00 0.00 43.02 42.33 2whs s PHE 83 CO 0.43 -0.08 1.70 -0.35 0.70 0.00 0.00 175.22 177.62 2whs n PRO 84 N -1.72 0.16 -0.05 0.24 -0.04 -1.26 -4.82 135.00 127.51 2whs n PRO 84 Ca -0.01 0.31 -0.10 0.00 -0.04 0.00 0.00 63.50 63.66 2whs n PRO 84 Cb 0.55 -1.77 -0.04 0.00 -0.04 0.00 0.00 33.50 32.20 2whs n PRO 84 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2whs h GLU 85 N 0.00 0.27 0.00 0.54 3.07 -1.92 -3.37 114.58 113.16 2whs h GLU 85 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2whs h GLU 85 Cb 0.44 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 2whs h GLU 85 CO 0.00 0.27 0.00 0.41 -1.40 0.00 0.00 179.01 178.29 2whs n GLY 86 N -0.91 -1.49 3.53 -3.84 0.00 0.12 -4.77 105.19 97.83 2whs n GLY 86 Ca -0.04 -1.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.02 2whs n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2whs s TYR 87 N 0.00 -0.41 0.31 1.61 -0.85 -1.18 0.62 117.35 117.45 2whs s TYR 87 Ca 0.00 0.13 0.10 0.00 -0.52 0.00 0.00 57.07 56.78 2whs s TYR 87 Cb 0.00 0.57 -0.05 0.00 0.38 0.00 0.00 41.96 42.86 2whs s TYR 87 CO 0.00 -0.94 -0.06 0.95 -1.52 0.00 0.00 175.55 173.97 2whs s THR 88 N -3.80 2.70 0.05 -3.49 -4.23 -0.18 -0.29 115.64 106.40 2whs s THR 88 Ca 0.04 -2.11 -0.07 0.00 -1.18 0.00 0.00 61.69 58.37 2whs s THR 88 Cb -0.02 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 71.16 2whs s THR 88 CO -0.07 -0.29 0.14 -1.66 -0.54 0.00 0.00 174.62 172.19 2whs s TRP 89 N -2.49 0.18 0.01 3.99 1.48 -0.82 -0.77 118.94 120.53 2whs s TRP 89 Ca 0.33 -0.51 0.08 0.00 -1.06 0.00 0.00 56.10 54.94 2whs s TRP 89 Cb -0.02 -0.11 -0.02 0.00 -1.16 0.00 0.00 33.47 32.15 2whs s TRP 89 CO 0.18 -0.43 -0.24 -1.21 -4.06 0.00 0.00 176.95 171.19 2whs s GLU 90 N -3.02 1.81 0.00 3.25 0.41 -0.73 -1.01 118.70 119.42 2whs s GLU 90 Ca -0.01 -0.97 0.00 0.00 -0.41 0.00 0.00 54.97 53.58 2whs s GLU 90 Cb 0.01 -1.87 -0.00 0.00 -1.78 0.00 0.00 34.13 30.49 2whs s GLU 90 CO -0.06 0.50 -0.01 0.50 -0.49 0.00 0.00 175.26 175.70 2whs s ARG 91 N -0.91 0.05 -0.14 1.61 3.52 0.74 -0.90 118.95 122.92 2whs s ARG 91 Ca 0.10 -0.06 -0.05 0.00 -0.13 0.00 0.00 55.73 55.59 2whs s ARG 91 Cb -0.09 -0.03 -0.04 0.00 -1.56 0.00 0.00 34.95 33.23 2whs s ARG 91 CO 0.01 0.01 0.04 -1.12 -0.81 0.00 0.00 175.30 173.42 2whs s SER 92 N -0.11 5.50 -0.29 -2.12 0.01 1.00 -0.11 113.70 117.58 2whs s SER 92 Ca -0.01 0.12 -0.04 0.00 1.31 0.00 0.00 55.95 57.33 2whs s SER 92 Cb -0.01 -1.80 0.03 0.00 0.21 0.00 0.00 66.02 64.44 2whs s SER 92 CO -0.00 0.27 0.03 -0.04 0.41 0.00 0.00 173.24 173.90 2whs s MET 93 N -0.19 2.82 -0.37 12.44 -1.94 0.26 -0.59 119.30 131.74 2whs s MET 93 Ca 0.07 -1.02 -0.05 0.00 -1.71 0.00 0.00 55.69 52.98 2whs s MET 93 Cb -0.12 -3.24 0.07 0.00 2.01 0.00 0.00 34.83 33.55 2whs s MET 93 CO 0.02 -0.50 0.14 -0.80 -0.01 0.00 0.00 175.02 173.87 2whs s ASN 94 N 1.39 5.25 0.40 3.03 0.01 0.08 -1.06 114.94 124.03 2whs s ASN 94 Ca -0.00 -1.55 -0.07 0.00 -0.71 0.00 0.00 52.86 50.53 2whs s ASN 94 Cb -0.18 -1.84 -0.05 0.00 0.41 0.00 0.00 41.25 39.59 2whs s ASN 94 CO -0.00 -0.42 0.71 -0.36 -1.51 0.00 0.00 177.10 175.52 2whs s PHE 95 N 1.28 3.51 0.44 2.20 0.08 -0.33 -1.03 117.98 124.12 2whs s PHE 95 Ca 0.02 0.83 0.18 0.00 0.12 0.00 0.00 56.93 58.08 2whs s PHE 95 Cb -0.21 -2.28 1.12 0.00 -0.57 0.00 0.00 43.02 41.07 2whs s PHE 95 CO -0.01 -0.09 2.01 1.05 -0.10 0.00 0.00 175.22 178.08 2whs h GLU 96 N 0.96 0.00 -0.84 0.44 4.11 -1.27 -2.38 114.58 115.59 2whs h GLU 96 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 2whs h GLU 96 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2whs h GLU 96 CO 0.63 0.17 0.00 -0.40 0.07 0.00 0.00 179.01 179.48 2whs n ASP 97 N -4.14 2.85 0.00 3.06 5.75 -1.26 -4.89 116.55 117.91 2whs n ASP 97 Ca -0.02 -2.36 0.00 0.00 -0.01 0.00 0.00 54.79 52.39 2whs n ASP 97 Cb 0.24 -0.57 0.00 0.00 -1.03 0.00 0.00 41.12 39.76 2whs n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2whs n GLY 98 N 0.25 1.96 3.76 6.12 0.00 -0.90 -4.80 105.19 111.58 2whs n GLY 98 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 2whs n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whs s ALA 99 N -2.56 3.02 -0.06 4.61 0.00 -1.25 -4.84 121.76 120.68 2whs s ALA 99 Ca 0.00 1.27 0.01 0.00 0.00 0.00 0.00 51.96 53.24 2whs s ALA 99 Cb 0.00 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.62 2whs s ALA 99 CO 0.00 -1.10 -0.05 0.08 0.00 0.00 0.00 175.76 174.69 2whs s VAL 100 N -1.32 0.63 -0.04 0.00 1.01 -1.03 -1.19 120.40 118.46 2whs s VAL 100 Ca 0.65 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.50 2whs s VAL 100 Cb -0.38 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 2whs s VAL 100 CO 0.47 0.26 -0.07 0.00 0.00 0.00 0.00 175.10 175.76 2whs s THR 102 N -0.89 2.00 -0.02 0.00 -4.23 -0.16 -0.57 115.64 111.78 2whs s THR 102 Ca 0.14 -1.11 0.03 0.00 -1.18 0.00 0.00 61.69 59.58 2whs s THR 102 Cb -0.11 -1.67 -0.00 0.00 1.34 0.00 0.00 72.50 72.06 2whs s THR 102 CO 0.04 0.54 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.87 2whs s VAL 103 N -0.61 0.87 0.13 2.29 1.01 0.84 -1.08 120.40 123.85 2whs s VAL 103 Ca 0.10 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 61.72 2whs s VAL 103 Cb -0.10 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2whs s VAL 103 CO -0.01 0.25 -0.20 -0.94 0.00 0.00 0.00 175.10 174.21 2whs s SER 104 N -0.08 2.68 0.02 3.32 1.04 0.05 -0.19 113.70 120.54 2whs s SER 104 Ca 0.01 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 55.68 2whs s SER 104 Cb -0.06 -0.16 -0.01 0.00 0.10 0.00 0.00 66.02 65.89 2whs s SER 104 CO 0.00 0.03 -0.04 0.21 0.98 0.00 0.00 173.24 174.42 2whs s ASN 105 N -2.27 0.40 -0.08 7.02 2.47 -0.18 -0.89 114.94 121.41 2whs s ASN 105 Ca 0.11 -0.35 0.02 0.00 0.42 0.00 0.00 52.86 53.07 2whs s ASN 105 Cb -0.08 0.04 0.01 0.00 -1.45 0.00 0.00 41.25 39.77 2whs s ASN 105 CO 0.06 -0.16 -0.15 -0.62 -3.72 0.00 0.00 177.10 172.51 2whs s ASP 106 N -1.00 2.09 -0.04 -4.21 -1.08 -0.34 -1.94 116.67 110.14 2whs s ASP 106 Ca -0.09 -0.36 0.06 0.00 -0.52 0.00 0.00 52.55 51.64 2whs s ASP 106 Cb -0.07 -0.96 -0.01 0.00 -1.46 0.00 0.00 42.92 40.42 2whs s ASP 106 CO -0.00 0.05 -0.21 -0.44 0.52 0.00 0.00 175.17 175.09 2whs s SER 107 N 0.65 2.51 0.31 -0.34 0.01 0.60 -1.40 113.70 116.04 2whs s SER 107 Ca -0.14 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 56.72 2whs s SER 107 Cb -0.16 -0.53 -0.00 0.00 0.21 0.00 0.00 66.02 65.54 2whs s SER 107 CO 0.04 0.22 0.38 -1.54 0.41 0.00 0.00 173.24 172.75 2whs n SER 108 N 2.86 -1.05 -4.03 2.44 3.41 -0.44 -3.08 113.62 113.73 2whs n SER 108 Ca -0.17 -2.75 -0.11 0.00 -0.26 0.00 0.00 58.87 55.58 2whs n SER 108 Cb 0.53 2.04 -0.11 0.00 -0.26 0.00 0.00 64.21 66.40 2whs n SER 108 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2whs s ILE 109 N -2.89 0.36 -0.34 -1.33 2.07 -1.26 -0.82 121.20 116.99 2whs s ILE 109 Ca 0.28 -1.07 -0.01 0.00 -1.41 0.00 0.00 60.65 58.45 2whs s ILE 109 Cb -0.00 -0.53 0.12 0.00 0.13 0.00 0.00 42.46 42.17 2whs s ILE 109 CO 0.20 -0.47 0.16 -1.58 -1.91 0.00 0.00 174.94 171.35 2whs s GLN 110 N -1.70 0.63 7.74 3.50 2.00 0.52 -4.93 119.66 127.42 2whs s GLN 110 Ca -0.11 -1.17 0.00 0.00 -2.00 0.00 0.00 55.36 52.08 2whs s GLN 110 Cb -0.09 -1.63 0.00 0.00 0.80 0.00 0.00 33.01 32.09 2whs s GLN 110 CO -0.01 -1.09 0.00 0.41 -0.50 0.00 0.00 175.29 174.10 2whs n GLY 111 N 4.49 3.28 1.87 2.59 0.00 -1.26 -1.90 105.19 114.25 2whs n GLY 111 Ca 0.03 -0.14 -0.07 0.00 0.00 0.00 0.00 46.02 45.85 2whs n GLY 111 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2whs n ASN 112 N 7.53 4.38 -3.86 1.61 5.03 -1.26 -4.83 115.26 123.85 2whs n ASN 112 Ca 0.00 -3.08 -0.25 0.00 0.87 0.00 0.00 54.58 52.12 2whs n ASN 112 Cb 0.00 -0.72 -0.17 0.00 -1.02 0.00 0.00 39.78 37.87 2whs n ASN 112 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2whs s PHE 114 N 1.73 3.30 -0.12 0.00 0.08 -0.30 -0.36 117.98 122.32 2whs s PHE 114 Ca 0.04 1.48 0.01 0.00 0.12 0.00 0.00 56.93 58.58 2whs s PHE 114 Cb -0.13 -2.86 0.02 0.00 -0.57 0.00 0.00 43.02 39.48 2whs s PHE 114 CO -0.07 -0.61 -0.13 0.42 -0.10 0.00 0.00 175.22 174.73 2whs s ILE 115 N -2.56 1.42 -0.10 0.64 1.01 0.00 -0.89 121.20 120.72 2whs s ILE 115 Ca 0.60 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2whs s ILE 115 Cb -0.12 -1.34 -0.02 0.00 0.01 0.00 0.00 42.46 41.00 2whs s ILE 115 CO 0.33 0.43 -0.14 -0.31 0.00 0.00 0.00 174.94 175.25 2whs s TYR 116 N 1.32 2.76 -0.29 3.97 2.02 -0.02 -1.33 117.35 125.77 2whs s TYR 116 Ca 0.00 -0.47 0.03 0.00 -0.37 0.00 0.00 57.07 56.26 2whs s TYR 116 Cb -0.14 -1.76 0.07 0.00 -0.40 0.00 0.00 41.96 39.74 2whs s TYR 116 CO -0.06 -0.07 -0.04 1.21 -1.57 0.00 0.00 175.55 175.02 2whs s ASN 117 N -0.06 4.61 -0.09 2.29 2.47 -0.49 -1.06 114.94 122.60 2whs s ASN 117 Ca -0.03 -1.65 0.01 0.00 0.42 0.00 0.00 52.86 51.62 2whs s ASN 117 Cb -0.14 -1.60 -0.02 0.00 -1.45 0.00 0.00 41.25 38.04 2whs s ASN 117 CO 0.04 -0.27 -0.11 -0.69 -3.72 0.00 0.00 177.10 172.35 2whs s VAL 118 N 1.05 3.28 -0.02 -5.21 1.01 0.08 -1.20 120.40 119.40 2whs s VAL 118 Ca -0.02 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.41 2whs s VAL 118 Cb -0.20 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2whs s VAL 118 CO -0.06 0.56 -0.21 -0.54 0.00 0.00 0.00 175.10 174.86 2whs s LYS 119 N -0.27 1.68 -0.03 2.72 1.02 -0.07 -1.63 119.74 123.15 2whs s LYS 119 Ca 0.02 -0.74 0.01 0.00 0.02 0.00 0.00 55.97 55.28 2whs s LYS 119 Cb -0.13 -1.62 0.02 0.00 -0.52 0.00 0.00 37.83 35.58 2whs s LYS 119 CO 0.03 0.44 -0.04 -1.50 -0.92 0.00 0.00 175.35 173.36 2whs s ILE 120 N -0.48 0.46 -0.13 2.17 2.07 -0.69 -0.77 121.20 123.82 2whs s ILE 120 Ca 0.08 -0.10 0.01 0.00 -1.41 0.00 0.00 60.65 59.22 2whs s ILE 120 Cb -0.08 -0.48 0.02 0.00 0.13 0.00 0.00 42.46 42.05 2whs s ILE 120 CO -0.01 0.19 -0.13 -0.94 -1.91 0.00 0.00 174.94 172.14 2whs s SER 121 N 0.76 2.52 -0.29 4.50 1.04 -0.24 -1.99 113.70 119.99 2whs s SER 121 Ca -0.10 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 55.87 2whs s SER 121 Cb -0.13 -1.09 0.04 0.00 0.10 0.00 0.00 66.02 64.94 2whs s SER 121 CO -0.00 -0.04 0.00 -0.83 0.98 0.00 0.00 173.24 173.35 2whs s GLY 122 N 1.36 1.74 0.04 7.32 0.00 -0.39 -0.98 107.32 116.40 2whs s GLY 122 Ca 0.01 -1.68 0.03 0.00 0.00 0.00 0.00 44.72 43.08 2whs s GLY 122 CO -0.07 0.66 0.02 -1.83 0.00 0.00 0.00 173.10 171.88 2whs s GLU 123 N 1.30 2.75 -1.11 2.90 -1.05 -0.67 -0.31 118.70 122.51 2whs s GLU 123 Ca -0.03 -0.68 -0.02 0.00 -0.15 0.00 0.00 54.97 54.08 2whs s GLU 123 Cb -0.19 -2.66 0.00 0.00 -0.44 0.00 0.00 34.13 30.85 2whs s GLU 123 CO -0.01 0.59 0.31 0.09 0.95 0.00 0.00 175.26 177.19 2whs n ASN 124 N 0.97 -4.61 -4.72 0.83 3.02 -1.26 -2.47 115.26 107.02 2whs n ASN 124 Ca -0.12 -0.15 -0.42 0.00 -0.03 0.00 0.00 54.58 53.86 2whs n ASN 124 Cb 0.52 -3.55 -0.03 0.00 -0.61 0.00 0.00 39.78 36.11 2whs n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2whs s PHE 125 N -2.91 3.33 0.04 3.10 0.08 -1.26 -3.90 117.98 116.46 2whs s PHE 125 Ca 0.15 1.19 -0.33 0.00 0.12 0.00 0.00 56.93 58.06 2whs s PHE 125 Cb -0.07 -3.55 -0.12 0.00 -0.57 0.00 0.00 43.02 38.71 2whs s PHE 125 CO 0.19 -1.77 1.79 -2.30 -0.10 0.00 0.00 175.22 173.03 2whs n PRO 126 N 3.38 2.36 0.03 0.24 -0.02 -1.26 -4.85 135.00 134.88 2whs n PRO 126 Ca 0.08 0.86 0.21 0.00 -2.02 0.00 0.00 63.50 62.64 2whs n PRO 126 Cb 0.44 -2.70 0.73 0.00 -0.02 0.00 0.00 33.50 31.95 2whs n PRO 126 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2whs h PRO 127 N 8.22 0.00 -0.54 0.52 0.11 -1.97 0.63 132.00 138.97 2whs h PRO 127 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2whs h PRO 127 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2whs h PRO 127 CO 0.93 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.81 2whs n ASN 128 N -3.97 3.74 -4.09 -2.05 3.02 -1.26 -4.41 115.26 106.23 2whs n ASN 128 Ca 0.09 -2.16 -0.30 0.00 -0.03 0.00 0.00 54.58 52.19 2whs n ASN 128 Cb 0.66 -0.42 0.19 0.00 -0.61 0.00 0.00 39.78 39.60 2whs n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2whs s GLY 129 N -1.05 1.74 0.38 7.41 0.00 0.21 -4.85 107.32 111.17 2whs s GLY 129 Ca 0.39 -1.14 0.11 0.00 0.00 0.00 0.00 44.72 44.09 2whs s GLY 129 CO 0.23 -0.35 1.88 -0.56 0.00 0.00 0.00 173.10 174.30 2whs h PRO 130 N -1.81 0.10 0.38 2.90 0.13 -1.95 -1.98 132.00 129.77 2whs h PRO 130 Ca -0.45 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2whs h PRO 130 Cb 1.25 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2whs h PRO 130 CO 0.38 0.36 -0.18 0.28 -0.23 0.00 0.00 178.00 178.61 2whs h VAL 131 N 0.09 0.27 0.00 1.56 2.07 -1.94 0.32 116.25 118.62 2whs h VAL 131 Ca 0.01 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 2whs h VAL 131 Cb 0.51 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 2whs h VAL 131 CO 0.04 0.06 -0.05 0.24 0.02 0.00 0.00 177.57 177.87 2whs h MET 132 N -1.05 0.00 -0.44 1.57 2.86 -1.78 -0.74 114.93 115.35 2whs h MET 132 Ca -0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2whs h MET 132 Cb 0.49 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.15 2whs h MET 132 CO 0.08 0.05 0.00 1.04 1.06 0.00 0.00 176.91 179.15 2whs n GLN 133 N -3.43 2.43 -3.78 1.72 1.13 -0.75 -4.62 117.38 110.08 2whs n GLN 133 Ca -0.02 -2.18 -0.24 0.00 -1.94 0.00 0.00 57.00 52.62 2whs n GLN 133 Cb 0.19 -1.50 0.01 0.00 0.11 0.00 0.00 30.24 29.05 2whs n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2whs n LYS 134 N 1.35 -3.94 0.00 -1.09 5.02 -0.55 -4.91 118.16 114.04 2whs n LYS 134 Ca 0.20 0.53 0.11 0.00 -2.02 0.00 0.00 58.31 57.13 2whs n LYS 134 Cb 0.56 -4.86 0.05 0.00 -0.02 0.00 0.00 35.03 30.77 2whs n LYS 134 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2whs n LYS 135 N -4.29 1.29 -2.61 1.97 4.76 0.11 -4.99 118.16 114.38 2whs n LYS 135 Ca -0.28 -1.04 -0.31 0.00 -2.87 0.00 0.00 58.31 53.81 2whs n LYS 135 Cb 0.67 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 32.36 2whs n LYS 135 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2whs s THR 136 N -2.43 4.71 -0.24 -0.18 -4.23 -1.25 -0.28 115.64 111.75 2whs s THR 136 Ca 0.20 0.79 0.21 0.00 -1.18 0.00 0.00 61.69 61.71 2whs s THR 136 Cb 0.18 -3.75 0.50 0.00 1.34 0.00 0.00 72.50 70.77 2whs s THR 136 CO 0.54 -0.65 1.13 0.00 -0.54 0.00 0.00 174.62 175.09 2whs n GLN 137 N -1.59 1.78 0.00 3.99 6.02 0.19 -4.80 117.38 122.96 2whs n GLN 137 Ca 0.04 -3.44 0.00 0.00 -0.01 0.00 0.00 57.00 53.59 2whs n GLN 137 Cb 0.54 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.26 2whs n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2whs n GLY 138 N -0.52 2.56 3.82 1.08 0.00 -1.26 -4.66 105.19 106.21 2whs n GLY 138 Ca 0.11 -1.87 -0.36 0.00 0.00 0.00 0.00 46.02 43.90 2whs n GLY 138 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2whs s TRP 139 N -2.68 3.68 0.57 1.61 0.52 -1.26 -0.76 118.94 120.61 2whs s TRP 139 Ca 0.00 1.28 -0.18 0.00 0.02 0.00 0.00 56.10 57.23 2whs s TRP 139 Cb 0.00 -2.53 -0.04 0.00 -1.15 0.00 0.00 33.47 29.74 2whs s TRP 139 CO 0.00 0.42 1.08 -1.21 0.02 0.00 0.00 176.95 177.26 2whs s GLU 140 N -1.78 3.32 0.46 4.98 0.41 -0.11 -4.76 118.70 121.21 2whs s GLU 140 Ca 0.39 1.39 -0.22 0.00 -0.41 0.00 0.00 54.97 56.11 2whs s GLU 140 Cb -0.17 -2.02 -0.10 0.00 -1.78 0.00 0.00 34.13 30.06 2whs s GLU 140 CO 0.20 -0.84 0.79 -2.30 -0.49 0.00 0.00 175.26 172.63 2whs n PRO 141 N -1.69 0.93 -4.13 0.39 -0.02 -1.26 -4.69 135.00 124.53 2whs n PRO 141 Ca 0.10 0.34 -0.11 0.00 -2.02 0.00 0.00 63.50 61.81 2whs n PRO 141 Cb 0.52 -1.83 -0.08 0.00 -0.02 0.00 0.00 33.50 32.09 2whs n PRO 141 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2whs s SER 142 N -0.92 0.12 -0.18 2.55 1.04 -0.89 -4.93 113.70 110.48 2whs s SER 142 Ca 0.65 -1.24 -0.01 0.00 0.48 0.00 0.00 55.95 55.83 2whs s SER 142 Cb -0.55 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.08 2whs s SER 142 CO 0.56 -0.96 -0.02 -0.89 0.98 0.00 0.00 173.24 172.91 2whs s THR 143 N -4.07 0.97 0.16 2.02 2.01 -1.26 -1.35 115.64 114.12 2whs s THR 143 Ca 0.33 -0.66 -0.18 0.00 0.31 0.00 0.00 61.69 61.49 2whs s THR 143 Cb 0.04 -1.26 -0.07 0.00 0.01 0.00 0.00 72.50 71.22 2whs s THR 143 CO 0.12 0.01 0.64 -0.70 -0.69 0.00 0.00 174.62 173.99 2whs s GLU 144 N 1.68 4.18 -0.15 4.92 2.12 0.17 -4.59 118.70 127.03 2whs s GLU 144 Ca -0.01 0.75 -0.03 0.00 0.36 0.00 0.00 54.97 56.04 2whs s GLU 144 Cb -0.16 -3.01 -0.02 0.00 0.26 0.00 0.00 34.13 31.19 2whs s GLU 144 CO -0.07 0.49 -0.05 1.03 -0.54 0.00 0.00 175.26 176.11 2whs s ARG 145 N -1.70 3.60 -0.01 4.30 1.81 -0.15 -1.23 118.95 125.58 2whs s ARG 145 Ca 0.38 -0.56 0.06 0.00 -1.72 0.00 0.00 55.73 53.89 2whs s ARG 145 Cb -0.17 -2.87 -0.02 0.00 -0.45 0.00 0.00 34.95 31.44 2whs s ARG 145 CO 0.20 0.21 -0.18 -0.51 -0.68 0.00 0.00 175.30 174.35 2whs s LEU 146 N 0.42 2.05 0.08 2.53 1.02 -0.52 -1.13 118.68 123.13 2whs s LEU 146 Ca -0.05 -0.35 -0.04 0.00 0.02 0.00 0.00 54.13 53.71 2whs s LEU 146 Cb -0.15 -0.92 -0.03 0.00 0.02 0.00 0.00 46.19 45.12 2whs s LEU 146 CO 0.03 0.21 0.07 0.72 0.02 0.00 0.00 176.35 177.40 2whs s PHE 147 N -0.48 0.44 0.04 0.29 -0.12 -0.46 -1.85 117.98 115.84 2whs s PHE 147 Ca 0.07 -0.92 -0.17 0.00 -0.05 0.00 0.00 56.93 55.86 2whs s PHE 147 Cb -0.07 -0.28 -0.06 0.00 -0.63 0.00 0.00 43.02 41.98 2whs s PHE 147 CO -0.00 -0.47 0.49 0.00 -0.05 0.00 0.00 175.22 175.19 2whs s ALA 148 N -3.92 3.64 -0.17 1.99 0.00 -1.26 -0.58 121.76 121.45 2whs s ALA 148 Ca 0.09 -0.08 -0.08 0.00 0.00 0.00 0.00 51.96 51.89 2whs s ALA 148 Cb 0.07 -2.52 0.07 0.00 0.00 0.00 0.00 23.12 20.74 2whs s ALA 148 CO -0.08 0.44 0.39 0.50 0.00 0.00 0.00 175.76 177.00 2whs s ARG 149 N -1.10 0.33 -1.55 0.00 3.52 0.11 -4.93 118.95 115.33 2whs s ARG 149 Ca 0.27 0.85 -0.09 0.00 -0.13 0.00 0.00 55.73 56.63 2whs s ARG 149 Cb -0.18 0.09 0.07 0.00 -1.56 0.00 0.00 34.95 33.37 2whs s ARG 149 CO 0.16 -0.20 0.57 -0.25 -0.81 0.00 0.00 175.30 174.77 2whs n ASP 150 N 4.74 -1.69 0.00 -2.12 8.00 -1.26 -0.72 116.55 123.49 2whs n ASP 150 Ca -0.17 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.31 2whs n ASP 150 Cb 0.53 -2.84 0.00 0.00 -0.02 0.00 0.00 41.12 38.78 2whs n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2whs n GLY 151 N -1.76 0.72 3.65 0.44 0.00 -1.26 -5.00 105.19 101.99 2whs n GLY 151 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 2whs n GLY 151 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2whs s MET 152 N -0.26 2.34 -0.18 1.61 -1.94 0.10 -4.58 119.30 116.38 2whs s MET 152 Ca 0.00 -1.33 -0.06 0.00 -1.71 0.00 0.00 55.69 52.59 2whs s MET 152 Cb 0.00 -2.22 -0.03 0.00 2.01 0.00 0.00 34.83 34.58 2whs s MET 152 CO 0.00 0.39 0.03 -1.17 -0.01 0.00 0.00 175.02 174.26 2whs s LEU 153 N -3.49 3.59 -0.19 -0.03 2.96 -0.71 -0.71 118.68 120.10 2whs s LEU 153 Ca 0.30 -0.02 -0.05 0.00 -0.22 0.00 0.00 54.13 54.15 2whs s LEU 153 Cb -0.07 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 2whs s LEU 153 CO 0.20 0.15 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.74 2whs s ILE 154 N 0.50 3.90 0.08 6.68 -1.09 0.25 0.13 121.20 131.64 2whs s ILE 154 Ca 0.01 -0.34 0.06 0.00 -2.23 0.00 0.00 60.65 58.15 2whs s ILE 154 Cb -0.13 -2.75 -0.04 0.00 -1.58 0.00 0.00 42.46 37.96 2whs s ILE 154 CO 0.01 0.44 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.25 2whs s GLY 155 N 0.92 1.79 -0.02 6.18 0.00 0.35 -1.36 107.32 115.18 2whs s GLY 155 Ca 0.01 -1.18 0.00 0.00 0.00 0.00 0.00 44.72 43.55 2whs s GLY 155 CO 0.02 -1.13 0.01 -1.31 0.00 0.00 0.00 173.10 170.69 2whs s ASN 156 N -2.01 0.18 -0.09 1.64 0.01 -0.28 -1.62 114.94 112.76 2whs s ASN 156 Ca 0.21 0.00 -0.06 0.00 -0.71 0.00 0.00 52.86 52.30 2whs s ASN 156 Cb -0.11 -0.10 0.03 0.00 0.41 0.00 0.00 41.25 41.48 2whs s ASN 156 CO 0.12 -0.08 0.22 -0.62 -1.51 0.00 0.00 177.10 175.23 2whs s ASP 157 N 0.77 -0.23 -0.35 -1.22 -1.08 -0.83 -0.98 116.67 112.75 2whs s ASP 157 Ca -0.07 0.46 -0.04 0.00 -0.52 0.00 0.00 52.55 52.37 2whs s ASP 157 Cb -0.10 0.39 0.06 0.00 -1.46 0.00 0.00 42.92 41.82 2whs s ASP 157 CO -0.02 -0.12 0.11 -0.31 0.52 0.00 0.00 175.17 175.34 2whs s TYR 158 N 0.74 3.34 0.36 -5.34 2.02 -1.26 -0.05 117.35 117.16 2whs s TYR 158 Ca -0.05 -1.81 0.08 0.00 -0.37 0.00 0.00 57.07 54.92 2whs s TYR 158 Cb -0.07 -2.50 -0.03 0.00 -0.40 0.00 0.00 41.96 38.97 2whs s TYR 158 CO -0.04 -0.82 0.28 -1.64 -1.57 0.00 0.00 175.55 171.75 2whs s MET 159 N 1.30 2.59 -0.11 -0.62 -1.94 0.67 -4.85 119.30 116.33 2whs s MET 159 Ca -0.00 -1.43 -0.05 0.00 -1.71 0.00 0.00 55.69 52.50 2whs s MET 159 Cb -0.21 -2.37 0.05 0.00 2.01 0.00 0.00 34.83 34.31 2whs s MET 159 CO -0.00 0.02 0.24 0.00 -0.01 0.00 0.00 175.02 175.27 2whs s ALA 160 N -2.38 -0.53 -0.09 3.03 0.00 -1.26 -2.28 121.76 118.24 2whs s ALA 160 Ca 0.42 0.94 -0.23 0.00 0.00 0.00 0.00 51.96 53.09 2whs s ALA 160 Cb -0.04 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 2whs s ALA 160 CO 0.26 -0.38 0.70 -0.51 0.00 0.00 0.00 175.76 175.82 2whs s LEU 161 N 1.75 4.28 0.31 0.00 1.43 0.63 -0.94 118.68 126.15 2whs s LEU 161 Ca -0.05 1.14 -0.29 0.00 -1.03 0.00 0.00 54.13 53.90 2whs s LEU 161 Cb -0.11 -3.06 -0.10 0.00 0.03 0.00 0.00 46.19 42.94 2whs s LEU 161 CO -0.08 -0.15 1.31 -0.54 0.23 0.00 0.00 176.35 177.12 2whs s LYS 162 N 1.04 4.36 0.00 1.70 1.02 0.06 -0.63 119.74 127.29 2whs s LYS 162 Ca 0.36 2.19 0.04 0.00 0.02 0.00 0.00 55.97 58.59 2whs s LYS 162 Cb -0.17 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 34.01 2whs s LYS 162 CO 0.16 -0.20 -0.10 -0.51 -0.92 0.00 0.00 175.35 173.78 2whs s LEU 163 N -1.45 2.99 0.00 3.17 1.43 -0.93 0.54 118.68 124.42 2whs s LEU 163 Ca 0.51 -0.21 -0.38 0.00 -1.03 0.00 0.00 54.13 53.01 2whs s LEU 163 Cb -0.39 -1.71 -0.17 0.00 0.03 0.00 0.00 46.19 43.95 2whs s LEU 163 CO 0.50 0.29 1.41 1.21 0.23 0.00 0.00 176.35 179.98 2whs n GLU 164 N 1.65 1.07 -2.46 1.70 2.13 0.62 -1.60 120.64 123.76 2whs n GLU 164 Ca -0.16 0.39 -0.12 0.00 0.66 0.00 0.00 57.16 57.93 2whs n GLU 164 Cb 0.52 -2.03 0.01 0.00 0.27 0.00 0.00 31.44 30.21 2whs n GLU 164 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2whs n GLY 165 N 2.81 -0.05 0.00 8.31 0.00 -1.26 -4.88 105.19 110.12 2whs n GLY 165 Ca 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2whs n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whs n GLY 166 N -1.10 -1.21 0.00 -0.02 0.00 -0.63 -5.12 105.19 97.11 2whs n GLY 166 Ca -0.10 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2whs n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whs n GLY 167 N -1.09 0.12 3.09 -0.02 0.00 -1.26 -4.55 105.19 101.48 2whs n GLY 167 Ca 0.00 -1.77 -0.12 0.00 0.00 0.00 0.00 46.02 44.13 2whs n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2whs s HIS 168 N -2.34 0.70 -0.15 1.61 0.09 -1.26 -2.19 115.29 111.74 2whs s HIS 168 Ca 0.00 -0.66 0.02 0.00 -0.00 0.00 0.00 55.06 54.42 2whs s HIS 168 Cb 0.00 -0.42 0.01 0.00 -0.00 0.00 0.00 32.58 32.17 2whs s HIS 168 CO 0.00 -0.13 -0.21 -0.47 -0.00 0.00 0.00 174.74 173.94 2whs s TYR 169 N -2.20 2.70 0.18 1.40 5.04 0.19 -4.94 117.35 119.72 2whs s TYR 169 Ca -0.03 -1.36 0.06 0.00 -2.44 0.00 0.00 57.07 53.30 2whs s TYR 169 Cb -0.04 -1.84 -0.04 0.00 0.35 0.00 0.00 41.96 40.38 2whs s TYR 169 CO -0.02 -0.63 0.08 -0.51 -1.34 0.00 0.00 175.55 173.14 2whs s LEU 170 N 0.90 3.60 -0.19 6.97 1.43 -1.26 -0.27 118.68 129.86 2whs s LEU 170 Ca -0.05 -0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 2whs s LEU 170 Cb -0.15 -2.22 0.06 0.00 0.03 0.00 0.00 46.19 43.91 2whs s LEU 170 CO -0.04 0.07 0.47 0.00 0.23 0.00 0.00 176.35 177.08 2whs s GLU 172 N 1.03 4.25 -0.17 0.00 2.12 -0.20 -0.24 118.70 125.50 2whs s GLU 172 Ca -0.06 0.52 -0.09 0.00 0.36 0.00 0.00 54.97 55.70 2whs s GLU 172 Cb -0.06 -3.53 -0.05 0.00 0.26 0.00 0.00 34.13 30.75 2whs s GLU 172 CO -0.09 -0.10 0.14 -0.06 -0.54 0.00 0.00 175.26 174.61 2whs s PHE 173 N 1.45 3.48 -0.09 5.30 0.40 0.93 -0.74 117.98 128.70 2whs s PHE 173 Ca 0.27 0.41 0.01 0.00 -0.60 0.00 0.00 56.93 57.02 2whs s PHE 173 Cb -0.16 -2.09 0.02 0.00 0.51 0.00 0.00 43.02 41.30 2whs s PHE 173 CO 0.11 0.44 -0.10 0.21 0.70 0.00 0.00 175.22 176.57 2whs s LYS 174 N -0.10 1.67 0.06 0.44 2.47 0.24 -1.97 119.74 122.55 2whs s LYS 174 Ca 0.11 -0.35 0.06 0.00 -1.56 0.00 0.00 55.97 54.22 2whs s LYS 174 Cb -0.11 -1.54 -0.03 0.00 -1.46 0.00 0.00 37.83 34.69 2whs s LYS 174 CO 0.00 -0.13 -0.16 -1.12 0.16 0.00 0.00 175.35 174.11 2whs s SER 175 N 1.20 1.88 -0.12 1.43 0.01 -0.64 -0.00 113.70 117.46 2whs s SER 175 Ca -0.04 -0.56 -0.00 0.00 1.31 0.00 0.00 55.95 56.66 2whs s SER 175 Cb -0.14 -0.10 0.02 0.00 0.21 0.00 0.00 66.02 66.01 2whs s SER 175 CO -0.03 0.01 -0.09 -0.89 0.41 0.00 0.00 173.24 172.66 2whs s THR 176 N -1.05 1.10 -0.11 1.44 2.01 -0.07 -0.50 115.64 118.46 2whs s THR 176 Ca 0.02 -0.34 -0.02 0.00 0.31 0.00 0.00 61.69 61.66 2whs s THR 176 Cb -0.09 -1.10 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 2whs s THR 176 CO 0.02 0.38 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.00 2whs s TYR 177 N 1.65 3.07 -0.23 4.92 2.02 0.12 -1.77 117.35 127.13 2whs s TYR 177 Ca 0.04 0.01 -0.03 0.00 -0.37 0.00 0.00 57.07 56.72 2whs s TYR 177 Cb -0.13 -1.83 0.08 0.00 -0.40 0.00 0.00 41.96 39.68 2whs s TYR 177 CO -0.08 0.28 0.09 0.21 -1.57 0.00 0.00 175.55 174.48 2whs s LYS 178 N -0.45 0.37 0.67 -0.62 2.20 0.06 -1.73 119.74 120.23 2whs s LYS 178 Ca 0.08 -0.46 -0.17 0.00 -0.36 0.00 0.00 55.97 55.06 2whs s LYS 178 Cb -0.12 -1.75 0.00 0.00 -1.51 0.00 0.00 37.83 34.46 2whs s LYS 178 CO 0.02 -0.81 1.21 0.00 -0.36 0.00 0.00 175.35 175.41 2whs s ALA 179 N 1.97 2.33 -2.21 3.13 0.00 -1.26 -1.01 121.76 124.69 2whs s ALA 179 Ca 0.04 0.92 0.27 0.00 0.00 0.00 0.00 51.96 53.19 2whs s ALA 179 Cb -0.17 -3.46 1.30 0.00 0.00 0.00 0.00 23.12 20.79 2whs s ALA 179 CO -0.19 -1.54 1.87 1.63 0.00 0.00 0.00 175.76 177.52 2whs n LYS 180 N -2.22 1.34 -3.89 0.00 5.02 0.20 -4.83 118.16 113.79 2whs n LYS 180 Ca 0.13 -0.50 -0.09 0.00 -2.02 0.00 0.00 58.31 55.83 2whs n LYS 180 Cb 0.50 -1.44 -0.07 0.00 -0.02 0.00 0.00 35.03 34.00 2whs n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2whs s LYS 181 N -1.96 0.92 0.37 1.97 -2.85 -1.26 -5.01 119.74 111.91 2whs s LYS 181 Ca 0.39 -1.02 -0.28 0.00 -1.00 0.00 0.00 55.97 54.06 2whs s LYS 181 Cb 0.19 0.35 -0.10 0.00 -2.06 0.00 0.00 37.83 36.21 2whs s LYS 181 CO 0.31 -0.30 1.39 -2.14 0.10 0.00 0.00 175.35 174.71 2whs s PRO 182 N -3.89 4.17 0.16 1.78 0.02 -1.26 -4.97 135.00 131.00 2whs s PRO 182 Ca 0.08 2.37 0.01 0.00 0.02 0.00 0.00 61.00 63.48 2whs s PRO 182 Cb 0.05 -2.97 -0.04 0.00 0.02 0.00 0.00 34.50 31.55 2whs s PRO 182 CO -0.08 -0.40 0.01 0.14 -0.33 0.00 0.00 177.00 176.34 2whs s VAL 183 N -1.15 0.54 0.02 3.83 -7.23 -1.26 -5.03 120.40 110.12 2whs s VAL 183 Ca 0.52 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 2whs s VAL 183 Cb -0.43 -2.09 -0.07 0.00 0.56 0.00 0.00 36.38 34.36 2whs s VAL 183 CO 0.57 -0.49 1.67 -0.13 -0.31 0.00 0.00 175.10 176.41 2whs s ARG 184 N -3.94 4.19 0.03 4.82 0.52 -1.26 -4.98 118.95 118.32 2whs s ARG 184 Ca 0.23 2.29 -0.24 0.00 -0.52 0.00 0.00 55.73 57.49 2whs s ARG 184 Cb 0.06 -3.78 -0.05 0.00 0.52 0.00 0.00 34.95 31.71 2whs s ARG 184 CO 0.03 -0.78 0.75 -1.64 0.02 0.00 0.00 175.30 173.67 2whs s MET 185 N 3.25 4.47 0.64 3.54 -1.94 -1.26 -4.71 119.30 123.30 2whs s MET 185 Ca 0.75 1.02 -0.08 0.00 -1.71 0.00 0.00 55.69 55.67 2whs s MET 185 Cb -0.38 -3.37 0.02 0.00 2.01 0.00 0.00 34.83 33.11 2whs s MET 185 CO 0.32 0.26 0.98 -1.25 -0.01 0.00 0.00 175.02 175.31 2whs s PRO 186 N 0.06 2.80 0.95 2.03 0.04 -1.26 -4.84 135.00 134.77 2whs s PRO 186 Ca 0.38 0.11 -0.14 0.00 0.04 0.00 0.00 61.00 61.39 2whs s PRO 186 Cb -0.20 -2.18 0.21 0.00 0.04 0.00 0.00 34.50 32.37 2whs s PRO 186 CO 0.22 -0.88 1.29 0.20 0.04 0.00 0.00 177.00 177.87 2whs s GLY 187 N -4.35 1.80 0.30 0.56 0.00 -1.26 -4.51 107.32 99.86 2whs s GLY 187 Ca 0.56 -1.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.60 2whs s GLY 187 CO 0.47 -0.60 1.54 1.09 0.00 0.00 0.00 173.10 175.59 2whs s ARG 188 N -5.81 4.16 0.00 2.90 1.70 -1.26 -4.83 118.95 115.81 2whs s ARG 188 Ca 0.75 2.51 0.00 0.00 -0.47 0.00 0.00 55.73 58.51 2whs s ARG 188 Cb -0.03 -3.03 0.00 0.00 -0.57 0.00 0.00 34.95 31.32 2whs s ARG 188 CO 0.52 -0.56 0.00 -2.39 -1.08 0.00 0.00 175.30 171.79 2whs n HIS 189 N 1.90 -0.42 -4.05 5.89 1.44 -0.77 -4.42 115.22 114.79 2whs n HIS 189 Ca 0.06 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.69 2whs n HIS 189 Cb 0.38 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.40 2whs n HIS 189 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 2whs s GLU 190 N -1.41 0.79 -0.12 -1.40 2.02 -0.70 -1.44 118.70 116.45 2whs s GLU 190 Ca 0.00 -1.23 -0.02 0.00 0.02 0.00 0.00 54.97 53.74 2whs s GLU 190 Cb 0.00 0.26 0.04 0.00 0.10 0.00 0.00 34.13 34.53 2whs s GLU 190 CO 0.00 -0.21 0.00 0.42 0.02 0.00 0.00 175.26 175.49 2whs s ILE 191 N -3.95 0.55 0.09 -1.63 1.01 -0.37 -0.29 121.20 116.61 2whs s ILE 191 Ca 0.12 -0.21 -0.28 0.00 0.00 0.00 0.00 60.65 60.29 2whs s ILE 191 Cb 0.07 -0.81 -0.06 0.00 0.01 0.00 0.00 42.46 41.67 2whs s ILE 191 CO -0.06 0.10 0.87 -1.81 0.00 0.00 0.00 174.94 174.05 2whs s ASP 192 N 1.88 7.38 0.02 3.58 1.11 -0.53 -0.66 116.67 129.46 2whs s ASP 192 Ca 0.03 1.65 0.02 0.00 0.18 0.00 0.00 52.55 54.43 2whs s ASP 192 Cb -0.14 -2.54 -0.01 0.00 1.07 0.00 0.00 42.92 41.30 2whs s ASP 192 CO -0.07 -0.01 -0.07 -0.13 1.18 0.00 0.00 175.17 176.07 2whs s ARG 193 N -0.11 0.49 -0.08 8.23 0.52 -0.46 -0.68 118.95 126.86 2whs s ARG 193 Ca 0.43 -0.50 0.02 0.00 -0.52 0.00 0.00 55.73 55.16 2whs s ARG 193 Cb -0.22 -0.36 0.01 0.00 0.52 0.00 0.00 34.95 34.90 2whs s ARG 193 CO 0.27 0.08 -0.13 0.21 0.02 0.00 0.00 175.30 175.75 2whs s LYS 194 N -0.90 1.91 -0.16 3.54 2.20 -0.32 -2.09 119.74 123.92 2whs s LYS 194 Ca -0.04 -0.47 -0.00 0.00 -0.36 0.00 0.00 55.97 55.10 2whs s LYS 194 Cb -0.06 -1.60 0.03 0.00 -1.51 0.00 0.00 37.83 34.69 2whs s LYS 194 CO 0.00 -0.00 -0.08 -1.17 -0.36 0.00 0.00 175.35 173.74 2whs s LEU 195 N 0.79 1.65 -0.02 5.43 2.96 -1.26 -0.71 118.68 127.52 2whs s LEU 195 Ca -0.12 -0.59 0.07 0.00 -0.22 0.00 0.00 54.13 53.27 2whs s LEU 195 Cb -0.16 -1.00 -0.02 0.00 0.50 0.00 0.00 46.19 45.52 2whs s LEU 195 CO 0.02 -0.14 -0.23 -1.81 -1.32 0.00 0.00 176.35 172.87 2whs s ASP 196 N 1.58 2.67 -0.36 3.68 1.01 -0.31 -4.48 116.67 120.47 2whs s ASP 196 Ca 0.02 -0.42 -0.28 0.00 0.71 0.00 0.00 52.55 52.59 2whs s ASP 196 Cb -0.14 -0.30 0.02 0.00 1.01 0.00 0.00 42.92 43.51 2whs s ASP 196 CO -0.08 0.28 1.03 -0.69 0.21 0.00 0.00 175.17 175.91 2whs s VAL 197 N -0.54 4.50 -0.61 -1.27 1.01 -1.26 -0.89 120.40 121.34 2whs s VAL 197 Ca 0.09 1.47 0.23 0.00 0.00 0.00 0.00 61.98 63.77 2whs s VAL 197 Cb -0.09 -4.41 -0.15 0.00 0.00 0.00 0.00 36.38 31.73 2whs s VAL 197 CO -0.01 -0.56 0.95 0.35 0.00 0.00 0.00 175.10 175.83 2whs n THR 198 N 6.03 0.13 -3.61 3.92 -2.24 0.58 -4.96 114.28 114.12 2whs n THR 198 Ca 0.10 -0.23 -0.08 0.00 -2.27 0.00 0.00 64.05 61.57 2whs n THR 198 Cb 0.48 0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 68.95 2whs n THR 198 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2whs s SER 199 N -3.85 -0.27 0.16 3.42 0.15 -1.07 -4.98 113.70 107.26 2whs s SER 199 Ca 0.03 0.35 -0.18 0.00 0.70 0.00 0.00 55.95 56.85 2whs s SER 199 Cb 0.15 0.30 0.04 0.00 -1.71 0.00 0.00 66.02 64.79 2whs s SER 199 CO 0.82 -0.21 0.49 -1.38 1.20 0.00 0.00 173.24 174.16 2whs s HIS 200 N -0.81 -0.25 0.69 3.44 -3.43 -1.26 0.30 115.29 113.97 2whs s HIS 200 Ca 0.02 -0.06 -0.04 0.00 -0.80 0.00 0.00 55.06 54.19 2whs s HIS 200 Cb -0.02 0.37 0.08 0.00 -1.43 0.00 0.00 32.58 31.59 2whs s HIS 200 CO -0.03 -0.81 0.97 0.54 -2.00 0.00 0.00 174.74 173.41 2whs s ASN 201 N -2.82 4.68 0.23 7.38 4.22 -0.49 -4.97 114.94 123.18 2whs s ASN 201 Ca 0.05 0.10 -0.17 0.00 -2.14 0.00 0.00 52.86 50.69 2whs s ASN 201 Cb 0.00 -0.69 0.24 0.00 1.28 0.00 0.00 41.25 42.08 2whs s ASN 201 CO -0.09 -1.63 1.56 -0.09 -2.04 0.00 0.00 177.10 174.80 2whs h ARG 202 N -0.48 -0.02 -0.58 3.55 2.43 -2.02 -2.17 114.38 115.09 2whs h ARG 202 Ca -0.42 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 2whs h ARG 202 Cb 1.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 2whs h ARG 202 CO 0.51 -0.01 0.00 -0.40 -1.51 0.00 0.00 179.97 178.56 2whs n ASP 203 N -5.48 4.58 -3.50 -3.80 5.68 -1.26 -4.96 116.55 107.82 2whs n ASP 203 Ca 0.10 -2.50 -0.22 0.00 -0.50 0.00 0.00 54.79 51.67 2whs n ASP 203 Cb 0.40 -0.55 0.08 0.00 -1.14 0.00 0.00 41.12 39.91 2whs n ASP 203 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2whs n TYR 204 N 0.86 -2.64 0.79 2.11 4.02 -0.82 -4.48 117.16 117.00 2whs n TYR 204 Ca 0.24 0.98 0.10 0.00 -0.01 0.00 0.00 57.90 59.21 2whs n TYR 204 Cb 0.87 -4.99 -0.12 0.00 -0.02 0.00 0.00 39.34 35.08 2whs n TYR 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2whs n THR 205 N -4.71 0.00 -3.78 -0.72 -2.24 -1.26 -4.76 114.28 96.81 2whs n THR 205 Ca -0.08 -0.10 -0.24 0.00 -2.27 0.00 0.00 64.05 61.37 2whs n THR 205 Cb 0.59 0.83 -0.17 0.00 -2.10 0.00 0.00 70.33 69.48 2whs n THR 205 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2whs s SER 206 N -3.18 1.79 0.01 3.42 0.15 -1.26 -0.22 113.70 114.41 2whs s SER 206 Ca 0.05 -0.19 0.01 0.00 0.70 0.00 0.00 55.95 56.52 2whs s SER 206 Cb 0.15 -0.49 -0.01 0.00 -1.71 0.00 0.00 66.02 63.96 2whs s SER 206 CO 0.84 -0.20 -0.04 -0.69 1.20 0.00 0.00 173.24 174.36 2whs s VAL 207 N 1.94 0.24 -0.07 4.45 1.01 -0.63 -1.40 120.40 125.94 2whs s VAL 207 Ca 0.04 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.64 2whs s VAL 207 Cb -0.13 -0.26 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 2whs s VAL 207 CO -0.06 -0.13 -0.23 -1.61 0.00 0.00 0.00 175.10 173.07 2whs s GLU 208 N -0.60 2.72 0.14 2.72 2.02 0.15 0.10 118.70 125.94 2whs s GLU 208 Ca -0.04 -0.87 0.08 0.00 0.02 0.00 0.00 54.97 54.16 2whs s GLU 208 Cb -0.04 -2.24 -0.04 0.00 0.10 0.00 0.00 34.13 31.91 2whs s GLU 208 CO -0.00 0.34 -0.19 -0.65 0.02 0.00 0.00 175.26 174.77 2whs s GLN 209 N -0.05 1.22 0.17 1.61 -0.21 -0.72 -0.31 119.66 121.37 2whs s GLN 209 Ca -0.07 -1.31 0.10 0.00 0.02 0.00 0.00 55.36 54.10 2whs s GLN 209 Cb -0.15 -1.36 -0.04 0.00 1.00 0.00 0.00 33.01 32.46 2whs s GLN 209 CO 0.05 0.29 -0.21 0.00 -2.12 0.00 0.00 175.29 173.30 2whs s GLU 211 N -2.61 0.18 -0.12 0.00 2.12 -0.60 -1.16 118.70 116.52 2whs s GLU 211 Ca 0.16 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.34 2whs s GLU 211 Cb -0.07 -0.13 -0.02 0.00 0.26 0.00 0.00 34.13 34.17 2whs s GLU 211 CO 0.07 0.03 -0.13 0.42 -0.54 0.00 0.00 175.26 175.12 2whs s ILE 212 N -0.23 3.10 -0.10 -3.70 -1.09 0.11 -1.99 121.20 117.30 2whs s ILE 212 Ca -0.01 -0.65 -0.02 0.00 -2.23 0.00 0.00 60.65 57.73 2whs s ILE 212 Cb -0.02 -2.29 0.04 0.00 -1.58 0.00 0.00 42.46 38.61 2whs s ILE 212 CO -0.00 0.53 0.04 0.00 -1.23 0.00 0.00 174.94 174.28 2whs s ALA 213 N 0.19 0.56 -0.14 9.38 0.00 -0.41 -1.18 121.76 130.17 2whs s ALA 213 Ca -0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 51.96 51.74 2whs s ALA 213 Cb -0.15 -0.82 0.03 0.00 0.00 0.00 0.00 23.12 22.18 2whs s ALA 213 CO 0.05 -0.69 -0.10 0.42 0.00 0.00 0.00 175.76 175.44 2whs s ILE 214 N 2.04 1.29 0.36 0.00 1.01 0.14 -1.01 121.20 125.04 2whs s ILE 214 Ca 0.04 -0.51 -0.27 0.00 0.00 0.00 0.00 60.65 59.91 2whs s ILE 214 Cb -0.13 -1.28 -0.09 0.00 0.01 0.00 0.00 42.46 40.96 2whs s ILE 214 CO -0.06 0.37 1.25 0.00 0.00 0.00 0.00 174.94 176.51 2whs s ALA 215 N 1.59 3.35 0.10 9.38 0.00 -0.08 -1.45 121.76 134.66 2whs s ALA 215 Ca 0.04 1.15 0.09 0.00 0.00 0.00 0.00 51.96 53.24 2whs s ALA 215 Cb -0.13 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 2whs s ALA 215 CO -0.09 -0.61 -0.22 1.03 0.00 0.00 0.00 175.76 175.87 2whs s ARG 216 N -1.97 1.19 0.38 0.00 1.81 0.60 -4.68 118.95 116.28 2whs s ARG 216 Ca 0.52 -1.18 -0.26 0.00 -1.72 0.00 0.00 55.73 53.10 2whs s ARG 216 Cb -0.37 -1.49 -0.09 0.00 -0.45 0.00 0.00 34.95 32.56 2whs s ARG 216 CO 0.48 0.35 1.13 -1.01 -0.68 0.00 0.00 175.30 175.57 2whs s HIS 217 N -1.12 3.19 -0.36 -0.53 3.76 -1.26 -1.71 115.29 117.27 2whs s HIS 217 Ca 0.08 1.60 -0.16 0.00 -0.15 0.00 0.00 55.06 56.43 2whs s HIS 217 Cb -0.10 -3.32 -0.01 0.00 1.11 0.00 0.00 32.58 30.27 2whs s HIS 217 CO 0.04 -1.05 0.38 0.45 -0.85 0.00 0.00 174.74 173.72 2whs s SER 218 N -1.19 6.19 -0.16 1.40 0.15 -1.26 -4.80 113.70 114.03 2whs s SER 218 Ca 0.55 -0.31 0.13 0.00 0.70 0.00 0.00 55.95 57.02 2whs s SER 218 Cb -0.29 -2.20 0.65 0.00 -1.71 0.00 0.00 66.02 62.47 2whs s SER 218 CO 0.37 -0.39 1.52 0.18 1.20 0.00 0.00 173.24 176.11 2whs n LEU 219 N 5.44 4.61 -0.23 3.45 4.32 -1.26 -4.53 117.00 128.79 2whs n LEU 219 Ca -0.09 -2.33 0.13 0.00 -0.02 0.00 0.00 56.01 53.70 2whs n LEU 219 Cb 0.49 -0.61 0.45 0.00 -1.62 0.00 0.00 43.42 42.13 2whs n LEU 219 CO 0.42 0.61 0.73 0.18 -1.22 0.00 0.00 177.39 178.11 2whs n LEU 220 N 0.67 0.92 0.00 2.23 4.77 -1.26 -5.30 117.00 119.03 2whs n LEU 220 Ca 0.23 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2whs n LEU 220 Cb 0.94 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 2whs n LEU 220 CO 0.25 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.08