#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pkh s ILE 2 N 0.00 4.94 0.21 2.02 1.01 -1.26 -1.23 121.20 126.90 1pkh s ILE 2 Ca 0.00 1.40 -0.31 0.00 0.00 0.00 0.00 60.65 61.75 1pkh s ILE 2 Cb 0.00 -4.01 -0.10 0.00 0.01 0.00 0.00 42.46 38.36 1pkh s ILE 2 CO 0.00 0.33 1.50 -0.76 0.00 0.00 0.00 174.94 176.00 1pkh s LEU 3 N 0.32 4.38 0.78 2.97 1.02 0.05 -4.99 118.68 123.21 1pkh s LEU 3 Ca 0.35 2.64 -0.10 0.00 0.02 0.00 0.00 54.13 57.04 1pkh s LEU 3 Cb -0.18 -3.61 0.09 0.00 0.02 0.00 0.00 46.19 42.50 1pkh s LEU 3 CO 0.19 -0.76 1.13 -0.94 0.02 0.00 0.00 176.35 175.98 1pkh s SER 4 N 0.74 4.48 0.27 2.29 1.04 -1.26 -4.48 113.70 116.78 1pkh s SER 4 Ca 0.64 0.58 -0.10 0.00 0.48 0.00 0.00 55.95 57.55 1pkh s SER 4 Cb -0.43 -1.08 0.41 0.00 0.10 0.00 0.00 66.02 65.02 1pkh s SER 4 CO 0.38 -1.87 1.56 -2.24 0.98 0.00 0.00 173.24 172.04 1pkh h ASP 5 N -0.93 -1.04 -0.69 7.02 3.04 -1.00 0.33 116.42 123.16 1pkh h ASP 5 Ca -0.45 0.30 -0.07 0.00 -3.24 0.00 0.00 57.03 53.57 1pkh h ASP 5 Cb 1.31 0.65 -0.03 0.00 -1.04 0.00 0.00 39.33 40.22 1pkh h ASP 5 CO 0.60 -0.32 0.17 0.11 -2.04 0.00 0.00 179.24 177.76 1pkh h LYS 6 N -0.00 1.11 -0.40 4.15 1.57 -1.90 -1.37 116.57 119.74 1pkh h LYS 6 Ca 0.45 -0.26 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 1pkh h LYS 6 Cb 0.70 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1pkh h LYS 6 CO -1.01 0.98 0.10 -0.44 -0.57 0.00 0.00 179.45 178.51 1pkh h ASP 7 N 1.06 0.60 -0.62 0.86 3.32 -1.54 -1.20 116.42 118.90 1pkh h ASP 7 Ca 0.22 -0.23 0.03 0.00 0.02 0.00 0.00 57.03 57.07 1pkh h ASP 7 Cb 0.37 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1pkh h ASP 7 CO 0.00 0.67 0.38 0.40 -1.72 0.00 0.00 179.24 178.97 1pkh h ILE 8 N 0.50 1.07 -0.70 0.35 2.04 -0.64 -0.48 117.51 119.65 1pkh h ILE 8 Ca 0.13 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.74 1pkh h ILE 8 Cb 0.30 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 1pkh h ILE 8 CO 0.00 0.14 0.46 0.40 0.00 0.00 0.00 178.15 179.15 1pkh h ILE 9 N 0.75 1.16 -0.36 -0.67 2.04 -1.11 -0.97 117.51 118.36 1pkh h ILE 9 Ca 0.25 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1pkh h ILE 9 Cb 0.03 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 1pkh h ILE 9 CO -0.11 0.17 0.17 0.44 0.00 0.00 0.00 178.15 178.82 1pkh h ASP 10 N 0.93 0.47 0.57 1.72 3.32 -0.57 -0.09 116.42 122.77 1pkh h ASP 10 Ca 0.26 -0.13 -0.10 0.00 0.02 0.00 0.00 57.03 57.09 1pkh h ASP 10 Cb -0.08 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1pkh h ASP 10 CO -0.07 0.46 -0.47 1.88 -1.72 0.00 0.00 179.24 179.32 1pkh h TYR 11 N 0.44 0.00 -0.15 4.55 -1.99 -0.78 -2.12 116.97 116.91 1pkh h TYR 11 Ca 0.12 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.67 1pkh h TYR 11 Cb 0.12 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.86 1pkh h TYR 11 CO -0.02 0.47 -0.63 0.28 -0.00 0.00 0.00 178.16 178.27 1pkh h VAL 12 N 0.00 1.31 -0.81 -2.88 2.07 -1.02 0.50 116.25 115.43 1pkh h VAL 12 Ca -0.00 -1.87 0.03 0.00 0.82 0.00 0.00 66.70 65.68 1pkh h VAL 12 Cb 0.89 2.02 -0.05 0.00 -1.52 0.00 0.00 31.29 32.63 1pkh h VAL 12 CO 0.06 0.58 0.52 0.74 0.02 0.00 0.00 177.57 179.49 1pkh h THR 13 N 0.38 1.14 -0.21 2.57 2.02 -0.58 -2.11 112.91 116.11 1pkh h THR 13 Ca -0.04 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1pkh h THR 13 Cb 1.26 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1pkh h THR 13 CO 0.13 0.19 0.00 -1.54 0.37 0.00 0.00 175.52 174.67 1pkh n SER 14 N -4.57 1.80 -1.90 4.18 3.41 -0.84 -4.91 113.62 110.79 1pkh n SER 14 Ca 0.09 -1.77 -0.19 0.00 -0.26 0.00 0.00 58.87 56.74 1pkh n SER 14 Cb 0.08 -0.14 -0.04 0.00 -0.26 0.00 0.00 64.21 63.85 1pkh n SER 14 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1pkh n LYS 15 N 0.42 -1.45 -0.13 4.33 5.02 -0.79 -4.90 118.16 120.66 1pkh n LYS 15 Ca 0.16 1.02 -0.12 0.00 -2.02 0.00 0.00 58.31 57.34 1pkh n LYS 15 Cb 0.34 -5.49 -0.02 0.00 -0.02 0.00 0.00 35.03 29.84 1pkh n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pkh h ARG 16 N 0.00 0.86 -5.12 1.97 3.08 -1.19 -3.41 114.38 110.58 1pkh h ARG 16 Ca -0.43 -0.41 -0.66 0.00 0.07 0.00 0.00 59.98 58.55 1pkh h ARG 16 Cb 1.30 -0.01 -0.30 0.00 0.08 0.00 0.00 29.97 31.04 1pkh h ARG 16 CO 0.55 1.06 -0.79 0.42 -1.07 0.00 0.00 179.97 180.14 1pkh s ILE 17 N -4.52 2.77 -0.10 2.04 1.01 -0.67 -3.51 121.20 118.22 1pkh s ILE 17 Ca -0.12 -0.72 -0.17 0.00 0.00 0.00 0.00 60.65 59.65 1pkh s ILE 17 Cb 0.11 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1pkh s ILE 17 CO 0.85 0.50 0.43 -0.63 0.00 0.00 0.00 174.94 176.09 1pkh s ILE 18 N 1.05 5.17 -0.14 2.92 -1.09 -0.59 -4.07 121.20 124.45 1pkh s ILE 18 Ca -0.01 0.87 -0.03 0.00 -2.23 0.00 0.00 60.65 59.25 1pkh s ILE 18 Cb -0.15 -3.77 0.05 0.00 -1.58 0.00 0.00 42.46 37.02 1pkh s ILE 18 CO -0.03 0.38 0.05 -0.63 -1.23 0.00 0.00 174.94 173.49 1pkh s ILE 19 N 0.28 0.19 -0.13 2.92 1.01 -1.26 -1.62 121.20 122.59 1pkh s ILE 19 Ca 0.24 -0.17 -0.00 0.00 0.00 0.00 0.00 60.65 60.72 1pkh s ILE 19 Cb -0.15 -0.66 0.03 0.00 0.01 0.00 0.00 42.46 41.69 1pkh s ILE 19 CO 0.10 -0.11 -0.07 -0.54 0.00 0.00 0.00 174.94 174.33 1pkh s LYS 20 N 2.02 1.47 0.70 2.79 1.02 0.30 -3.34 119.74 124.71 1pkh s LYS 20 Ca 0.02 -0.32 -0.11 0.00 0.02 0.00 0.00 55.97 55.58 1pkh s LYS 20 Cb -0.15 -1.70 0.01 0.00 -0.52 0.00 0.00 37.83 35.48 1pkh s LYS 20 CO -0.07 -0.32 1.07 -1.25 -0.92 0.00 0.00 175.35 173.86 1pkh s PRO 21 N 1.70 2.87 -0.07 -1.68 0.04 -1.26 -0.63 135.00 135.96 1pkh s PRO 21 Ca 0.04 0.69 0.05 0.00 0.04 0.00 0.00 61.00 61.81 1pkh s PRO 21 Cb -0.13 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 1pkh s PRO 21 CO -0.08 -1.08 -0.23 0.12 0.04 0.00 0.00 177.00 175.77 1pkh s PHE 22 N -3.20 2.51 -0.18 0.56 5.36 -1.21 -4.83 117.98 116.99 1pkh s PHE 22 Ca 0.58 -0.75 0.00 0.00 -0.96 0.00 0.00 56.93 55.80 1pkh s PHE 22 Cb -0.12 -1.64 0.04 0.00 -0.34 0.00 0.00 43.02 40.95 1pkh s PHE 22 CO 0.54 -0.23 -0.08 1.21 -1.46 0.00 0.00 175.22 175.19 1pkh s ASN 23 N -0.05 3.12 0.62 6.13 3.84 -1.26 -5.03 114.94 122.31 1pkh s ASN 23 Ca -0.06 -0.78 0.37 0.00 0.21 0.00 0.00 52.86 52.59 1pkh s ASN 23 Cb -0.15 -1.07 2.06 0.00 -0.55 0.00 0.00 41.25 41.54 1pkh s ASN 23 CO 0.05 -0.17 2.28 0.07 -2.79 0.00 0.00 177.10 176.55 1pkh h LYS 24 N 8.05 0.00 0.00 0.43 2.10 -1.99 0.43 116.57 125.58 1pkh h LYS 24 Ca -0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.39 1pkh h LYS 24 Cb 1.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.43 1pkh h LYS 24 CO 0.44 0.01 0.00 -0.25 -2.00 0.00 0.00 179.45 177.65 1pkh n ASP 25 N -3.43 0.00 -0.43 7.07 8.00 -1.26 -2.25 116.55 124.25 1pkh n ASP 25 Ca -0.03 0.48 0.13 0.00 0.71 0.00 0.00 54.79 56.08 1pkh n ASP 25 Cb 0.10 -0.49 0.31 0.00 -0.02 0.00 0.00 41.12 41.02 1pkh n ASP 25 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1pkh n PHE 26 N -1.49 0.00 -2.53 1.24 3.72 0.14 -4.84 117.46 113.70 1pkh n PHE 26 Ca 0.04 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.01 1pkh n PHE 26 Cb 0.19 -0.05 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 1pkh n PHE 26 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1pkh s VAL 27 N -2.32 4.42 0.09 -4.37 1.01 -0.95 -0.71 120.40 117.57 1pkh s VAL 27 Ca 0.27 1.69 0.01 0.00 0.00 0.00 0.00 61.98 63.96 1pkh s VAL 27 Cb 0.20 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.41 1pkh s VAL 27 CO 0.46 -0.25 0.12 0.61 0.00 0.00 0.00 175.10 176.04 1pkh n GLY 28 N 3.66 2.03 0.36 4.51 0.00 0.30 -4.99 105.19 111.05 1pkh n GLY 28 Ca 0.13 -2.15 0.17 0.00 0.00 0.00 0.00 46.02 44.17 1pkh n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pkh h PRO 29 N 0.00 0.60 -0.08 1.61 0.11 -1.97 -3.28 132.00 128.99 1pkh h PRO 29 Ca -0.04 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.85 1pkh h PRO 29 Cb 0.19 -0.13 -0.20 0.00 0.11 0.00 0.00 31.00 30.97 1pkh h PRO 29 CO 0.06 0.40 -0.45 0.00 -0.21 0.00 0.00 178.00 177.79 1pkh s SER 31 N -1.66 -0.26 -0.11 0.00 1.04 -1.24 -4.60 113.70 106.88 1pkh s SER 31 Ca 0.12 -0.48 0.01 0.00 0.48 0.00 0.00 55.95 56.09 1pkh s SER 31 Cb 0.38 0.63 0.02 0.00 0.10 0.00 0.00 66.02 67.15 1pkh s SER 31 CO -0.10 -1.15 -0.15 -0.47 0.98 0.00 0.00 173.24 172.35 1pkh s TYR 32 N -3.68 1.97 0.21 5.02 6.14 -0.10 -0.54 117.35 126.36 1pkh s TYR 32 Ca 0.11 -0.95 -0.30 0.00 0.64 0.00 0.00 57.07 56.57 1pkh s TYR 32 Cb -0.04 -1.43 -0.08 0.00 0.42 0.00 0.00 41.96 40.83 1pkh s TYR 32 CO 0.04 -0.50 1.07 -0.51 0.64 0.00 0.00 175.55 176.29 1pkh s ASP 33 N 1.07 7.33 0.31 4.32 1.01 0.11 -0.74 116.67 130.08 1pkh s ASP 33 Ca -0.05 2.10 0.10 0.00 0.71 0.00 0.00 52.55 55.41 1pkh s ASP 33 Cb -0.15 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.13 1pkh s ASP 33 CO -0.03 -0.15 -0.02 0.68 0.21 0.00 0.00 175.17 175.87 1pkh s VAL 34 N -0.56 2.85 0.22 -1.27 -7.23 -0.23 -4.91 120.40 109.27 1pkh s VAL 34 Ca 0.47 -2.01 0.09 0.00 -1.81 0.00 0.00 61.98 58.72 1pkh s VAL 34 Cb -0.29 -2.74 -0.05 0.00 0.56 0.00 0.00 36.38 33.86 1pkh s VAL 34 CO 0.36 -0.28 -0.17 0.42 -0.31 0.00 0.00 175.10 175.12 1pkh s THR 35 N -2.46 1.95 -0.16 5.32 -4.23 -1.26 -1.00 115.64 113.80 1pkh s THR 35 Ca 0.33 -2.22 -0.25 0.00 -1.18 0.00 0.00 61.69 58.38 1pkh s THR 35 Cb -0.03 -2.08 -0.02 0.00 1.34 0.00 0.00 72.50 71.72 1pkh s THR 35 CO 0.19 -0.50 0.82 -0.22 -0.54 0.00 0.00 174.62 174.37 1pkh s LEU 36 N -3.26 4.18 0.89 4.79 2.96 -0.17 -0.67 118.68 127.39 1pkh s LEU 36 Ca 0.23 1.16 -0.12 0.00 -0.22 0.00 0.00 54.13 55.18 1pkh s LEU 36 Cb -0.03 -3.21 0.12 0.00 0.50 0.00 0.00 46.19 43.58 1pkh s LEU 36 CO 0.09 -0.37 1.14 -0.83 -1.32 0.00 0.00 176.35 175.06 1pkh s GLY 37 N 1.14 1.58 0.00 7.98 0.00 0.13 -0.33 107.32 117.82 1pkh s GLY 37 Ca 0.38 -0.54 0.27 0.00 0.00 0.00 0.00 44.72 44.83 1pkh s GLY 37 CO 0.13 0.00 1.64 2.09 0.00 0.00 0.00 173.10 176.96 1pkh n ASP 38 N -3.67 1.36 -4.62 1.64 5.68 -1.26 -4.73 116.55 110.96 1pkh n ASP 38 Ca 0.07 -1.26 -0.34 0.00 -0.50 0.00 0.00 54.79 52.76 1pkh n ASP 38 Cb 0.59 0.07 -0.10 0.00 -1.14 0.00 0.00 41.12 40.54 1pkh n ASP 38 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1pkh s GLU 39 N -2.23 3.26 0.12 0.11 0.41 -1.26 -1.30 118.70 117.81 1pkh s GLU 39 Ca 0.31 -0.44 0.04 0.00 -0.41 0.00 0.00 54.97 54.47 1pkh s GLU 39 Cb 0.20 -2.86 -0.04 0.00 -1.78 0.00 0.00 34.13 29.66 1pkh s GLU 39 CO 0.42 0.53 -0.10 -0.06 -0.49 0.00 0.00 175.26 175.56 1pkh s PHE 40 N -0.40 1.14 -0.02 1.61 0.40 0.50 -3.94 117.98 117.27 1pkh s PHE 40 Ca 0.07 -0.71 0.06 0.00 -0.60 0.00 0.00 56.93 55.75 1pkh s PHE 40 Cb -0.12 -0.61 -0.01 0.00 0.51 0.00 0.00 43.02 42.79 1pkh s PHE 40 CO 0.02 0.02 -0.20 0.42 0.70 0.00 0.00 175.22 176.19 1pkh s ILE 41 N -2.85 1.57 -0.07 0.64 1.01 0.02 -1.07 121.20 120.44 1pkh s ILE 41 Ca 0.10 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.96 1pkh s ILE 41 Cb -0.00 -1.31 0.00 0.00 0.01 0.00 0.00 42.46 41.16 1pkh s ILE 41 CO -0.00 0.44 -0.20 -0.63 0.00 0.00 0.00 174.94 174.55 1pkh s ILE 42 N -0.36 1.73 0.30 2.92 -1.09 -0.58 -1.50 121.20 122.62 1pkh s ILE 42 Ca 0.05 -0.85 -0.16 0.00 -2.23 0.00 0.00 60.65 57.47 1pkh s ILE 42 Cb -0.09 -1.50 -0.09 0.00 -1.58 0.00 0.00 42.46 39.20 1pkh s ILE 42 CO -0.00 0.49 0.73 -0.31 -1.23 0.00 0.00 174.94 174.61 1pkh s TYR 43 N 0.27 3.43 -0.06 3.97 2.02 -1.26 -0.79 117.35 124.93 1pkh s TYR 43 Ca -0.13 1.24 0.11 0.00 -0.37 0.00 0.00 57.07 57.92 1pkh s TYR 43 Cb -0.16 -2.54 0.21 0.00 -0.40 0.00 0.00 41.96 39.07 1pkh s TYR 43 CO 0.06 0.15 1.10 -0.40 -1.57 0.00 0.00 175.55 174.88 1pkh n ASP 44 N -0.15 1.03 -4.93 2.29 5.75 -0.85 -4.90 116.55 114.80 1pkh n ASP 44 Ca 0.02 -2.53 -0.25 0.00 -0.01 0.00 0.00 54.79 52.02 1pkh n ASP 44 Cb 0.53 -0.32 0.02 0.00 -1.03 0.00 0.00 41.12 40.32 1pkh n ASP 44 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1pkh s ASP 45 N -1.97 5.76 0.09 -1.12 1.01 -1.26 -5.01 116.67 114.18 1pkh s ASP 45 Ca 0.20 0.57 -0.16 0.00 0.71 0.00 0.00 52.55 53.87 1pkh s ASP 45 Cb 0.19 -1.70 -0.09 0.00 1.01 0.00 0.00 42.92 42.34 1pkh s ASP 45 CO -0.03 -0.87 1.43 -0.08 0.21 0.00 0.00 175.17 175.83 1pkh h GLU 46 N 0.09 0.64 -4.87 8.23 4.81 -1.99 -3.46 114.58 118.04 1pkh h GLU 46 Ca -0.46 -0.32 -0.30 0.00 -0.13 0.00 0.00 59.36 58.15 1pkh h GLU 46 Cb 1.25 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.49 1pkh h GLU 46 CO 0.59 0.91 -0.67 0.14 -0.73 0.00 0.00 179.01 179.26 1pkh s VAL 47 N -4.43 0.80 -0.35 0.32 -7.23 -1.26 -5.13 120.40 103.11 1pkh s VAL 47 Ca -0.13 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 57.91 1pkh s VAL 47 Cb 0.08 -2.10 -0.01 0.00 0.56 0.00 0.00 36.38 34.91 1pkh s VAL 47 CO 0.81 -0.50 0.25 -0.31 -0.31 0.00 0.00 175.10 175.04 1pkh s TYR 48 N -3.58 3.23 -0.33 2.82 1.51 -1.26 -5.03 117.35 114.71 1pkh s TYR 48 Ca 0.23 -0.28 0.02 0.00 -1.01 0.00 0.00 57.07 56.04 1pkh s TYR 48 Cb 0.06 -2.50 0.09 0.00 -0.11 0.00 0.00 41.96 39.50 1pkh s TYR 48 CO 0.04 -0.40 0.03 0.34 -1.11 0.00 0.00 175.55 174.45 1pkh s ASP 49 N 1.71 4.77 0.00 2.29 -1.08 -1.26 -4.98 116.67 118.13 1pkh s ASP 49 Ca 0.06 -1.91 0.21 0.00 -0.52 0.00 0.00 52.55 50.39 1pkh s ASP 49 Cb -0.18 -1.65 1.08 0.00 -1.46 0.00 0.00 42.92 40.72 1pkh s ASP 49 CO 0.10 -0.35 1.68 0.18 0.52 0.00 0.00 175.17 177.31 1pkh n LEU 50 N 4.36 0.00 0.03 -1.34 4.32 -1.26 -1.17 117.00 121.95 1pkh n LEU 50 Ca -0.02 0.28 0.13 0.00 -0.02 0.00 0.00 56.01 56.39 1pkh n LEU 50 Cb 0.42 -0.28 0.55 0.00 -1.62 0.00 0.00 43.42 42.49 1pkh n LEU 50 CO 0.24 -0.08 0.93 -1.54 -1.22 0.00 0.00 177.39 175.71 1pkh n SER 51 N -1.28 0.24 -4.72 -1.43 3.41 -1.26 -4.83 113.62 103.76 1pkh n SER 51 Ca 0.10 0.52 -0.23 0.00 -0.26 0.00 0.00 58.87 59.00 1pkh n SER 51 Cb 0.17 -0.59 -0.07 0.00 -0.26 0.00 0.00 64.21 63.46 1pkh n SER 51 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1pkh s LYS 52 N -3.03 2.34 -0.00 4.33 1.02 -0.31 -5.11 119.74 118.97 1pkh s LYS 52 Ca 0.13 -1.56 -0.29 0.00 0.02 0.00 0.00 55.97 54.27 1pkh s LYS 52 Cb 0.17 -2.15 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 1pkh s LYS 52 CO 0.54 0.13 0.93 -2.00 -0.92 0.00 0.00 175.35 174.02 1pkh s GLU 53 N -3.82 4.55 0.04 1.68 2.12 -1.26 -4.91 118.70 117.09 1pkh s GLU 53 Ca 0.37 1.32 -0.21 0.00 0.36 0.00 0.00 54.97 56.81 1pkh s GLU 53 Cb -0.02 -3.45 -0.06 0.00 0.26 0.00 0.00 34.13 30.86 1pkh s GLU 53 CO 0.22 -0.00 0.63 -0.51 -0.54 0.00 0.00 175.26 175.05 1pkh s LEU 54 N 0.88 4.47 0.13 2.70 1.43 -1.26 -5.05 118.68 121.97 1pkh s LEU 54 Ca 0.49 1.27 -0.27 0.00 -1.03 0.00 0.00 54.13 54.59 1pkh s LEU 54 Cb -0.21 -2.99 -0.07 0.00 0.03 0.00 0.00 46.19 42.96 1pkh s LEU 54 CO 0.26 0.15 0.86 0.20 0.23 0.00 0.00 176.35 178.05 1pkh s ASN 55 N -0.50 7.41 0.20 2.29 0.02 -1.26 -5.04 114.94 118.06 1pkh s ASN 55 Ca 0.32 1.68 -0.11 0.00 -1.02 0.00 0.00 52.86 53.73 1pkh s ASN 55 Cb -0.19 -2.54 -0.01 0.00 0.02 0.00 0.00 41.25 38.54 1pkh s ASN 55 CO 0.19 0.06 0.37 -0.72 0.02 0.00 0.00 177.10 177.02 1pkh s TYR 56 N -0.49 0.39 0.05 2.20 -0.85 -1.26 -2.00 117.35 115.39 1pkh s TYR 56 Ca 0.41 -0.73 0.09 0.00 -0.52 0.00 0.00 57.07 56.32 1pkh s TYR 56 Cb -0.23 0.04 -0.03 0.00 0.38 0.00 0.00 41.96 42.12 1pkh s TYR 56 CO 0.27 -0.83 -0.25 0.15 -1.52 0.00 0.00 175.55 173.36 1pkh s LYS 57 N -3.99 1.79 -0.18 -3.49 1.02 0.03 -4.89 119.74 110.03 1pkh s LYS 57 Ca 0.20 -1.12 -0.09 0.00 0.02 0.00 0.00 55.97 54.97 1pkh s LYS 57 Cb 0.02 -2.00 -0.05 0.00 -0.52 0.00 0.00 37.83 35.28 1pkh s LYS 57 CO 0.04 0.51 0.13 1.03 -0.92 0.00 0.00 175.35 176.14 1pkh s ARG 58 N -1.36 3.98 -0.05 1.68 0.52 -1.26 -1.52 118.95 120.94 1pkh s ARG 58 Ca 0.12 -0.20 0.06 0.00 -0.52 0.00 0.00 55.73 55.20 1pkh s ARG 58 Cb -0.10 -3.35 -0.01 0.00 0.52 0.00 0.00 34.95 32.01 1pkh s ARG 58 CO 0.03 0.43 -0.24 0.42 0.02 0.00 0.00 175.30 175.96 1pkh s ILE 59 N -0.01 1.94 -0.08 1.52 -1.09 -0.23 -4.99 121.20 118.25 1pkh s ILE 59 Ca 0.10 -1.01 0.04 0.00 -2.23 0.00 0.00 60.65 57.55 1pkh s ILE 59 Cb -0.11 -1.63 -0.01 0.00 -1.58 0.00 0.00 42.46 39.12 1pkh s ILE 59 CO -0.00 0.54 -0.22 -0.75 -1.23 0.00 0.00 174.94 173.28 1pkh s LYS 60 N -0.23 2.85 0.09 2.79 2.20 -1.26 -0.37 119.74 125.80 1pkh s LYS 60 Ca -0.01 -0.84 0.02 0.00 -0.36 0.00 0.00 55.97 54.78 1pkh s LYS 60 Cb -0.12 -2.30 -0.04 0.00 -1.51 0.00 0.00 37.83 33.85 1pkh s LYS 60 CO 0.02 0.31 0.19 0.96 -0.36 0.00 0.00 175.35 176.47 1pkh s ILE 61 N 0.03 5.10 -0.10 5.43 -4.36 -0.42 -5.02 121.20 121.86 1pkh s ILE 61 Ca -0.08 -0.59 -0.26 0.00 -0.26 0.00 0.00 60.65 59.46 1pkh s ILE 61 Cb -0.15 -3.51 -0.28 0.00 1.25 0.00 0.00 42.46 39.76 1pkh s ILE 61 CO 0.05 0.07 0.80 0.50 0.24 0.00 0.00 174.94 176.61 1pkh h LYS 62 N 2.91 0.12 0.00 0.37 3.64 -1.95 -3.46 116.57 118.20 1pkh h LYS 62 Ca -0.46 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 58.71 1pkh h LYS 62 Cb 1.17 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1pkh h LYS 62 CO 0.71 1.10 -0.28 0.09 -2.27 0.00 0.00 179.45 178.80 1pkh n ASN 63 N -4.40 0.58 -3.44 4.20 4.13 -1.26 -4.89 115.26 110.17 1pkh n ASN 63 Ca -0.12 0.00 -0.12 0.00 1.68 0.00 0.00 54.58 56.02 1pkh n ASN 63 Cb 0.63 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.84 1pkh n ASN 63 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1pkh s SER 64 N -4.12 -0.54 -0.00 6.41 1.04 -1.26 -0.56 113.70 114.67 1pkh s SER 64 Ca 0.00 0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.48 1pkh s SER 64 Cb 0.00 0.56 -0.00 0.00 0.10 0.00 0.00 66.02 66.67 1pkh s SER 64 CO 0.00 -0.88 -0.05 -0.51 0.98 0.00 0.00 173.24 172.78 1pkh s ILE 65 N -3.48 0.37 -0.29 -1.02 2.07 -0.50 -1.25 121.20 117.09 1pkh s ILE 65 Ca 0.01 -0.19 -0.10 0.00 -1.41 0.00 0.00 60.65 58.96 1pkh s ILE 65 Cb -0.01 -0.31 -0.03 0.00 0.13 0.00 0.00 42.46 42.24 1pkh s ILE 65 CO -0.11 0.11 0.15 -0.22 -1.91 0.00 0.00 174.94 172.95 1pkh s LEU 66 N -0.08 3.92 -0.37 8.50 2.96 -0.32 -0.74 118.68 132.55 1pkh s LEU 66 Ca 0.01 -0.26 -0.12 0.00 -0.22 0.00 0.00 54.13 53.54 1pkh s LEU 66 Cb -0.02 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 44.66 1pkh s LEU 66 CO -0.00 -0.11 0.22 -0.69 -1.32 0.00 0.00 176.35 174.46 1pkh s VAL 67 N 1.67 4.80 0.04 1.68 1.01 -0.27 -1.40 120.40 127.93 1pkh s VAL 67 Ca 0.06 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 1pkh s VAL 67 Cb -0.16 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1pkh s VAL 67 CO 0.07 -0.19 0.29 0.00 0.00 0.00 0.00 175.10 175.27 1pkh n PRO 69 N 0.84 0.64 -1.63 0.00 -0.02 -1.26 -1.49 135.00 132.08 1pkh n PRO 69 Ca -0.09 0.27 -0.44 0.00 -2.02 0.00 0.00 63.50 61.23 1pkh n PRO 69 Cb 0.52 -2.19 -0.01 0.00 -0.02 0.00 0.00 33.50 31.81 1pkh n PRO 69 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1pkh n LEU 70 N -1.29 2.53 -0.44 2.45 7.94 -1.26 -2.38 117.00 124.55 1pkh n LEU 70 Ca 0.13 1.18 -0.05 0.00 -1.11 0.00 0.00 56.01 56.16 1pkh n LEU 70 Cb 0.49 -1.37 -0.02 0.00 0.53 0.00 0.00 43.42 43.05 1pkh n LEU 70 CO 0.49 -1.04 -0.05 0.59 -1.11 0.00 0.00 177.39 176.26 1pkh n ASN 71 N 1.00 -3.38 0.10 1.96 3.02 -1.26 -4.85 115.26 111.84 1pkh n ASN 71 Ca 0.08 0.11 0.12 0.00 -0.03 0.00 0.00 54.58 54.85 1pkh n ASN 71 Cb 0.34 -1.60 0.45 0.00 -0.61 0.00 0.00 39.78 38.37 1pkh n ASN 71 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pkh n TYR 72 N -3.05 0.67 -3.49 3.10 9.36 -1.00 -4.96 117.16 117.78 1pkh n TYR 72 Ca -0.05 0.24 -0.19 0.00 3.32 0.00 0.00 57.90 61.21 1pkh n TYR 72 Cb 0.24 -0.89 0.01 0.00 -0.63 0.00 0.00 39.34 38.07 1pkh n TYR 72 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1pkh n ASN 73 N -2.09 -5.93 -4.69 2.98 5.03 -1.26 -4.88 115.26 104.42 1pkh n ASN 73 Ca 0.03 -0.51 -0.42 0.00 0.87 0.00 0.00 54.58 54.55 1pkh n ASN 73 Cb 0.28 -2.87 -0.03 0.00 -1.02 0.00 0.00 39.78 36.13 1pkh n ASN 73 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1pkh s LEU 74 N -4.17 4.31 0.43 3.41 1.43 -1.26 -5.04 118.68 117.78 1pkh s LEU 74 Ca 0.08 1.92 0.07 0.00 -1.03 0.00 0.00 54.13 55.17 1pkh s LEU 74 Cb -0.01 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 1pkh s LEU 74 CO 0.85 -0.57 0.29 0.42 0.23 0.00 0.00 176.35 177.56 1pkh s THR 75 N 1.92 2.40 0.14 5.49 -4.23 -1.26 -4.97 115.64 115.13 1pkh s THR 75 Ca 0.58 -1.52 -0.19 0.00 -1.18 0.00 0.00 61.69 59.38 1pkh s THR 75 Cb -0.27 -2.92 0.03 0.00 1.34 0.00 0.00 72.50 70.68 1pkh s THR 75 CO 0.25 0.00 1.68 -0.08 -0.54 0.00 0.00 174.62 175.93 1pkh h GLU 76 N 1.19 -0.02 -0.82 3.99 4.22 -1.99 0.21 114.58 121.35 1pkh h GLU 76 Ca -0.42 0.00 0.06 0.00 0.08 0.00 0.00 59.36 59.08 1pkh h GLU 76 Cb 1.26 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.46 1pkh h GLU 76 CO 0.63 -0.02 0.50 1.49 -2.18 0.00 0.00 179.01 179.44 1pkh h GLU 77 N -0.03 0.90 -0.33 1.92 4.22 -1.99 -2.10 114.58 117.17 1pkh h GLU 77 Ca 0.14 -0.05 -0.11 0.00 0.08 0.00 0.00 59.36 59.41 1pkh h GLU 77 Cb 0.23 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1pkh h GLU 77 CO -0.30 0.60 -0.23 -0.22 -2.18 0.00 0.00 179.01 176.68 1pkh h LYS 78 N 0.93 0.74 -0.55 1.92 1.63 -1.76 -0.11 116.57 119.37 1pkh h LYS 78 Ca 0.35 -0.35 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1pkh h LYS 78 Cb 0.15 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.74 1pkh h LYS 78 CO -0.16 0.97 0.31 0.82 -3.45 0.00 0.00 179.45 177.93 1pkh h ILE 79 N 0.51 1.18 -0.75 2.00 2.04 -0.80 -0.69 117.51 121.00 1pkh h ILE 79 Ca 0.07 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 1pkh h ILE 79 Cb 0.78 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1pkh h ILE 79 CO 0.06 0.20 0.29 0.78 0.00 0.00 0.00 178.15 179.48 1pkh h ASN 80 N 0.75 1.04 -0.51 1.72 2.35 -1.18 -0.79 115.58 118.95 1pkh h ASN 80 Ca 0.20 -0.16 0.05 0.00 -0.55 0.00 0.00 56.30 55.83 1pkh h ASN 80 Cb 0.04 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.10 1pkh h ASN 80 CO -0.03 0.93 0.25 0.22 -1.65 0.00 0.00 177.43 177.14 1pkh h TYR 81 N 1.10 0.45 -0.47 1.19 5.03 -0.72 0.72 116.97 124.27 1pkh h TYR 81 Ca 0.25 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.46 1pkh h TYR 81 Cb 0.22 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.36 1pkh h TYR 81 CO 0.02 0.21 -0.18 0.74 -1.32 0.00 0.00 178.16 177.63 1pkh h PHE 82 N 0.48 1.09 -0.50 -3.82 0.04 -0.81 -1.17 116.94 112.25 1pkh h PHE 82 Ca 0.23 -0.26 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 1pkh h PHE 82 Cb 0.15 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.02 1pkh h PHE 82 CO -0.11 1.06 0.28 0.87 -0.60 0.00 0.00 178.31 179.82 1pkh h LYS 83 N 0.81 0.69 -0.12 1.51 1.57 -0.90 -0.16 116.57 119.96 1pkh h LYS 83 Ca 0.11 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1pkh h LYS 83 Cb 0.75 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1pkh h LYS 83 CO 0.06 0.53 -0.46 0.93 -0.57 0.00 0.00 179.45 179.94 1pkh h GLU 84 N 0.66 0.30 0.08 3.15 5.08 -0.79 0.10 114.58 123.16 1pkh h GLU 84 Ca 0.18 -0.16 -0.27 0.00 -1.00 0.00 0.00 59.36 58.10 1pkh h GLU 84 Cb 0.04 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1pkh h GLU 84 CO -0.03 0.71 -1.35 -0.22 -1.00 0.00 0.00 179.01 177.12 1pkh h LYS 85 N 0.25 0.16 -0.01 2.33 3.64 -1.02 -3.37 116.57 118.55 1pkh h LYS 85 Ca 0.02 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1pkh h LYS 85 Cb 0.92 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1pkh h LYS 85 CO 0.08 1.04 -0.03 0.66 -2.27 0.00 0.00 179.45 178.92 1pkh n TYR 86 N -3.40 0.00 -2.62 1.91 4.01 -0.09 -5.00 117.16 111.96 1pkh n TYR 86 Ca -0.10 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.46 1pkh n TYR 86 Cb 1.01 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 40.06 1pkh n TYR 86 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1pkh n ASN 87 N 0.06 -5.25 -4.86 7.72 4.13 0.02 -4.98 115.26 112.09 1pkh n ASN 87 Ca 0.03 -0.13 -0.33 0.00 1.68 0.00 0.00 54.58 55.82 1pkh n ASN 87 Cb 0.11 -4.21 -0.06 0.00 -1.54 0.00 0.00 39.78 34.09 1pkh n ASN 87 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1pkh s VAL 88 N -2.98 4.88 -0.32 2.41 -7.23 -1.24 -4.82 120.40 111.11 1pkh s VAL 88 Ca 0.13 0.63 0.21 0.00 -1.81 0.00 0.00 61.98 61.14 1pkh s VAL 88 Cb -0.06 -3.65 0.18 0.00 0.56 0.00 0.00 36.38 33.41 1pkh s VAL 88 CO 0.16 0.02 1.40 0.44 -0.31 0.00 0.00 175.10 176.82 1pkh h ASP 89 N 2.85 0.00 -4.22 4.85 3.32 -1.55 -3.43 116.42 118.24 1pkh h ASP 89 Ca -0.47 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.49 1pkh h ASP 89 Cb 1.18 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.51 1pkh h ASP 89 CO 0.68 0.14 -0.05 -0.47 -1.72 0.00 0.00 179.24 177.82 1pkh s TYR 90 N -3.17 -0.57 -0.10 4.55 5.04 -1.24 -5.02 117.35 116.85 1pkh s TYR 90 Ca 0.04 1.31 0.01 0.00 -2.44 0.00 0.00 57.07 55.98 1pkh s TYR 90 Cb 0.07 0.23 0.02 0.00 0.35 0.00 0.00 41.96 42.63 1pkh s TYR 90 CO 0.72 -0.35 -0.09 0.08 -1.34 0.00 0.00 175.55 174.56 1pkh s VAL 91 N -0.11 1.06 0.10 3.14 1.01 -1.26 -1.17 120.40 123.16 1pkh s VAL 91 Ca -0.03 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.66 1pkh s VAL 91 Cb -0.03 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 1pkh s VAL 91 CO 0.03 0.36 -0.17 0.54 0.00 0.00 0.00 175.10 175.86 1pkh s VAL 92 N 1.32 1.43 0.13 2.92 0.11 -0.49 -4.98 120.40 120.83 1pkh s VAL 92 Ca -0.02 -1.52 0.11 0.00 -2.93 0.00 0.00 61.98 57.62 1pkh s VAL 92 Cb -0.14 -1.39 -0.04 0.00 -1.53 0.00 0.00 36.38 33.28 1pkh s VAL 92 CO -0.04 -0.21 -0.26 -1.83 -3.33 0.00 0.00 175.10 169.43 1pkh s GLU 93 N -2.06 1.39 2.65 1.54 -1.05 -1.26 -0.42 118.70 119.48 1pkh s GLU 93 Ca 0.04 -1.35 0.00 0.00 -0.15 0.00 0.00 54.97 53.52 1pkh s GLU 93 Cb -0.09 -1.86 0.00 0.00 -0.44 0.00 0.00 34.13 31.74 1pkh s GLU 93 CO 0.03 0.44 0.00 0.41 0.95 0.00 0.00 175.26 177.09 1pkh n GLY 94 N 0.88 -0.73 3.77 -3.83 0.00 -0.55 -4.85 105.19 99.87 1pkh n GLY 94 Ca -0.18 -1.16 -0.39 0.00 0.00 0.00 0.00 46.02 44.30 1pkh n GLY 94 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pkh s GLY 95 N -0.24 2.95 -0.00 -0.02 0.00 -1.26 -4.69 107.32 104.06 1pkh s GLY 95 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1pkh s GLY 95 CO 0.00 1.18 -0.02 0.54 0.00 0.00 0.00 173.10 174.81 1pkh s VAL 96 N -1.39 0.12 -0.03 1.40 0.11 -0.68 -4.81 120.40 115.13 1pkh s VAL 96 Ca 0.47 -0.06 -0.14 0.00 -2.93 0.00 0.00 61.98 59.32 1pkh s VAL 96 Cb -0.24 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.44 1pkh s VAL 96 CO 0.31 0.04 0.38 -0.76 -3.33 0.00 0.00 175.10 171.74 1pkh s LEU 97 N -0.02 4.45 0.00 2.54 1.43 -0.57 -0.96 118.68 125.56 1pkh s LEU 97 Ca 0.00 0.89 0.00 0.00 -1.03 0.00 0.00 54.13 53.99 1pkh s LEU 97 Cb -0.01 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.68 1pkh s LEU 97 CO -0.00 0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.49 1pkh n GLY 98 N 2.00 4.50 3.19 -3.19 0.00 0.13 -0.80 105.19 111.01 1pkh n GLY 98 Ca -0.14 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.76 1pkh n GLY 98 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pkh s THR 99 N -1.13 0.08 0.64 2.61 -1.32 -1.25 -0.87 115.64 114.40 1pkh s THR 99 Ca 0.00 -0.68 -0.14 0.00 -1.21 0.00 0.00 61.69 59.66 1pkh s THR 99 Cb 0.00 -0.69 -0.01 0.00 -1.51 0.00 0.00 72.50 70.29 1pkh s THR 99 CO 0.00 -0.38 1.07 0.42 -2.21 0.00 0.00 174.62 173.52 1pkh s THR 100 N -1.84 3.71 0.23 5.08 -4.23 -0.49 -0.69 115.64 117.40 1pkh s THR 100 Ca -0.11 0.74 -0.02 0.00 -1.18 0.00 0.00 61.69 61.13 1pkh s THR 100 Cb -0.04 -3.30 0.03 0.00 1.34 0.00 0.00 72.50 70.53 1pkh s THR 100 CO 0.00 -0.55 1.64 0.78 -0.54 0.00 0.00 174.62 175.96 1pkh h ASN 101 N 0.03 0.64 -3.36 3.99 -0.26 -1.18 -3.42 115.58 112.03 1pkh h ASN 101 Ca -0.46 -0.24 -0.53 0.00 -0.56 0.00 0.00 56.30 54.51 1pkh h ASN 101 Cb 1.22 -0.18 0.01 0.00 -1.06 0.00 0.00 38.32 38.32 1pkh h ASN 101 CO 0.56 0.90 0.56 -1.61 -1.06 0.00 0.00 177.43 176.78 1pkh s GLU 102 N -4.46 4.47 -0.15 0.81 8.01 -1.26 -4.59 118.70 121.53 1pkh s GLU 102 Ca -0.08 1.82 -0.12 0.00 0.01 0.00 0.00 54.97 56.60 1pkh s GLU 102 Cb 0.13 -3.29 -0.05 0.00 -4.31 0.00 0.00 34.13 26.62 1pkh s GLU 102 CO 0.82 -0.15 0.25 -0.47 0.01 0.00 0.00 175.26 175.73 1pkh s TYR 103 N 0.40 3.49 0.21 1.61 6.14 0.20 -4.05 117.35 125.34 1pkh s TYR 103 Ca 0.55 0.57 0.09 0.00 0.64 0.00 0.00 57.07 58.92 1pkh s TYR 103 Cb -0.31 -2.26 -0.05 0.00 0.42 0.00 0.00 41.96 39.76 1pkh s TYR 103 CO 0.33 0.33 -0.17 0.96 0.64 0.00 0.00 175.55 177.64 1pkh s ILE 104 N 0.17 1.96 -0.05 3.14 -4.36 0.23 -0.54 121.20 121.75 1pkh s ILE 104 Ca 0.15 -2.15 0.01 0.00 -0.26 0.00 0.00 60.65 58.40 1pkh s ILE 104 Cb -0.13 -2.04 0.02 0.00 1.25 0.00 0.00 42.46 41.57 1pkh s ILE 104 CO 0.03 -0.44 -0.04 -1.61 0.24 0.00 0.00 174.94 173.13 1pkh s GLU 105 N -3.28 0.81 -0.08 0.37 2.02 -0.64 -0.89 118.70 116.99 1pkh s GLU 105 Ca 0.22 -0.07 -0.04 0.00 0.02 0.00 0.00 54.97 55.10 1pkh s GLU 105 Cb -0.04 -0.87 -0.04 0.00 0.10 0.00 0.00 34.13 33.28 1pkh s GLU 105 CO 0.09 -0.12 0.08 -0.51 0.02 0.00 0.00 175.26 174.81 1pkh s LEU 106 N 1.09 3.98 0.00 1.80 1.43 0.47 -1.55 118.68 125.91 1pkh s LEU 106 Ca -0.08 0.28 -0.17 0.00 -1.03 0.00 0.00 54.13 53.13 1pkh s LEU 106 Cb -0.14 -2.02 0.24 0.00 0.03 0.00 0.00 46.19 44.30 1pkh s LEU 106 CO -0.01 0.37 1.21 -0.81 0.23 0.00 0.00 176.35 177.34 1pkh n PRO 107 N 1.88 -1.81 0.00 1.29 -0.04 -1.23 -2.15 135.00 132.94 1pkh n PRO 107 Ca -0.18 -1.88 0.13 0.00 -0.04 0.00 0.00 63.50 61.53 1pkh n PRO 107 Cb 0.54 -1.39 0.74 0.00 -0.04 0.00 0.00 33.50 33.35 1pkh n PRO 107 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1pkh n ASN 108 N -4.13 0.00 -0.02 3.54 0.23 -1.26 -2.26 115.26 111.37 1pkh n ASN 108 Ca 0.16 -0.53 0.02 0.00 -0.53 0.00 0.00 54.58 53.70 1pkh n ASN 108 Cb 0.56 -0.12 0.03 0.00 -2.08 0.00 0.00 39.78 38.17 1pkh n ASN 108 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1pkh n ASP 109 N -1.12 2.06 -4.01 0.53 5.75 -1.26 -0.89 116.55 117.61 1pkh n ASP 109 Ca 0.17 -2.23 -0.20 0.00 -0.01 0.00 0.00 54.79 52.52 1pkh n ASP 109 Cb 0.14 -0.09 -0.15 0.00 -1.03 0.00 0.00 41.12 39.99 1pkh n ASP 109 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1pkh s ILE 110 N -1.39 0.76 0.04 2.12 -1.09 -1.21 -1.11 121.20 119.31 1pkh s ILE 110 Ca 0.07 -0.37 0.08 0.00 -2.23 0.00 0.00 60.65 58.20 1pkh s ILE 110 Cb 0.06 -0.67 -0.03 0.00 -1.58 0.00 0.00 42.46 40.24 1pkh s ILE 110 CO 0.01 0.23 -0.22 -0.55 -1.23 0.00 0.00 174.94 173.18 1pkh s SER 111 N 0.08 3.50 0.15 3.58 0.15 -0.59 -3.61 113.70 116.95 1pkh s SER 111 Ca -0.01 -0.50 0.11 0.00 0.70 0.00 0.00 55.95 56.25 1pkh s SER 111 Cb -0.07 -0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 63.74 1pkh s SER 111 CO 0.00 0.26 -0.24 0.00 1.20 0.00 0.00 173.24 174.46 1pkh s ALA 112 N -0.86 2.50 -0.13 5.45 0.00 -1.09 -0.42 121.76 127.21 1pkh s ALA 112 Ca 0.13 -1.50 0.01 0.00 0.00 0.00 0.00 51.96 50.60 1pkh s ALA 112 Cb -0.10 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 1pkh s ALA 112 CO 0.03 0.51 -0.16 -1.14 0.00 0.00 0.00 175.76 175.01 1pkh s GLN 113 N -2.28 3.27 0.04 0.00 0.74 0.72 0.46 119.66 122.61 1pkh s GLN 113 Ca 0.17 -0.74 -0.24 0.00 0.05 0.00 0.00 55.36 54.59 1pkh s GLN 113 Cb -0.09 -2.56 -0.05 0.00 1.10 0.00 0.00 33.01 31.40 1pkh s GLN 113 CO 0.08 0.15 0.74 -0.47 -0.55 0.00 0.00 175.29 175.25 1pkh s TYR 114 N 0.47 3.73 0.02 1.67 6.14 -0.41 -1.00 117.35 127.97 1pkh s TYR 114 Ca -0.11 1.44 0.03 0.00 0.64 0.00 0.00 57.07 59.07 1pkh s TYR 114 Cb -0.16 -2.79 -0.02 0.00 0.42 0.00 0.00 41.96 39.41 1pkh s TYR 114 CO 0.05 0.28 -0.09 -1.14 0.64 0.00 0.00 175.55 175.29 1pkh s GLN 115 N -0.08 0.67 0.60 4.97 0.74 -0.25 -4.47 119.66 121.84 1pkh s GLN 115 Ca 0.38 -0.54 -0.17 0.00 0.05 0.00 0.00 55.36 55.07 1pkh s GLN 115 Cb -0.20 -0.60 -0.03 0.00 1.10 0.00 0.00 33.01 33.27 1pkh s GLN 115 CO 0.22 0.15 1.12 0.20 -0.55 0.00 0.00 175.29 176.43 1pkh s GLY 116 N -0.84 2.41 0.34 2.59 0.00 -1.26 -0.40 107.32 110.16 1pkh s GLY 116 Ca -0.01 0.69 -0.29 0.00 0.00 0.00 0.00 44.72 45.12 1pkh s GLY 116 CO 0.00 1.05 1.50 -2.13 0.00 0.00 0.00 173.10 173.52 1pkh n ARG 117 N -1.81 2.61 -0.15 2.90 0.63 -0.34 -4.75 116.66 115.75 1pkh n ARG 117 Ca 0.11 0.92 -0.04 0.00 -0.92 0.00 0.00 57.85 57.92 1pkh n ARG 117 Cb 0.51 -2.65 0.05 0.00 0.45 0.00 0.00 32.46 30.82 1pkh n ARG 117 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 1pkh h SER 118 N 3.57 0.25 -0.33 6.15 0.02 -1.93 -1.33 113.55 119.95 1pkh h SER 118 Ca -0.49 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 1pkh h SER 118 Cb 1.24 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.77 1pkh h SER 118 CO 0.69 0.18 0.22 0.77 -1.14 0.00 0.00 176.83 177.56 1pkh h SER 119 N 0.39 0.29 0.39 3.07 4.64 -1.99 -1.14 113.55 119.21 1pkh h SER 119 Ca 0.21 -0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.24 1pkh h SER 119 Cb 0.18 -0.07 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1pkh h SER 119 CO -0.19 0.20 -1.24 -0.07 -0.87 0.00 0.00 176.83 174.66 1pkh h LEU 120 N 0.34 0.64 -1.41 5.97 3.38 -1.72 -3.21 115.31 119.29 1pkh h LEU 120 Ca 0.14 -0.63 0.09 0.00 0.09 0.00 0.00 57.88 57.57 1pkh h LEU 120 Cb 0.13 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 1pkh h LEU 120 CO -0.03 1.47 0.49 1.23 0.09 0.00 0.00 178.44 181.69 1pkh h GLY 121 N 0.93 0.93 2.00 0.83 0.00 -0.59 -1.19 103.07 105.99 1pkh h GLY 121 Ca -0.16 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1pkh h GLY 121 CO 0.22 0.16 0.00 0.54 0.00 0.00 0.00 176.54 177.47 1pkh n ARG 122 N -4.49 0.09 -0.46 4.80 1.74 -0.49 -1.45 116.66 116.39 1pkh n ARG 122 Ca 0.12 0.31 0.05 0.00 -0.77 0.00 0.00 57.85 57.56 1pkh n ARG 122 Cb 0.32 -1.67 0.21 0.00 -1.02 0.00 0.00 32.46 30.30 1pkh n ARG 122 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1pkh n VAL 123 N -1.85 2.25 -2.81 1.55 0.24 -0.54 -4.97 118.33 112.20 1pkh n VAL 123 Ca 0.03 -2.36 -0.20 0.00 -2.04 0.00 0.00 64.34 59.77 1pkh n VAL 123 Cb 0.22 -0.27 0.02 0.00 -1.47 0.00 0.00 33.84 32.34 1pkh n VAL 123 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1pkh n PHE 124 N -0.99 -1.56 -3.75 6.34 3.72 -0.53 -4.69 117.46 116.00 1pkh n PHE 124 Ca 0.23 0.36 -0.37 0.00 -0.05 0.00 0.00 57.45 57.63 1pkh n PHE 124 Cb 0.85 -4.02 -0.12 0.00 -0.94 0.00 0.00 39.48 35.25 1pkh n PHE 124 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1pkh s LEU 125 N -5.84 3.57 0.04 4.37 1.98 -0.64 -0.49 118.68 121.68 1pkh s LEU 125 Ca 0.21 -0.15 0.05 0.00 -2.89 0.00 0.00 54.13 51.35 1pkh s LEU 125 Cb -0.09 -1.96 -0.04 0.00 0.66 0.00 0.00 46.19 44.76 1pkh s LEU 125 CO 0.26 -0.02 -0.09 0.42 -1.89 0.00 0.00 176.35 175.04 1pkh s THR 126 N 1.52 3.48 -0.03 3.68 -4.23 -0.49 -3.39 115.64 116.19 1pkh s THR 126 Ca 0.06 -0.98 0.04 0.00 -1.18 0.00 0.00 61.69 59.63 1pkh s THR 126 Cb -0.15 -2.55 0.07 0.00 1.34 0.00 0.00 72.50 71.21 1pkh s THR 126 CO 0.05 0.29 0.95 -1.54 -0.54 0.00 0.00 174.62 173.83 1pkh n SER 127 N 1.25 1.62 -3.73 3.99 3.41 -1.24 -1.77 113.62 117.16 1pkh n SER 127 Ca -0.15 -2.09 -0.12 0.00 -0.26 0.00 0.00 58.87 56.26 1pkh n SER 127 Cb 0.52 -0.11 -0.11 0.00 -0.26 0.00 0.00 64.21 64.25 1pkh n SER 127 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1pkh s HIS 128 N -1.20 -0.46 -2.14 7.33 3.76 -1.03 -1.13 115.29 120.41 1pkh s HIS 128 Ca 0.07 1.06 0.22 0.00 -0.15 0.00 0.00 55.06 56.26 1pkh s HIS 128 Cb 0.06 0.17 0.50 0.00 1.11 0.00 0.00 32.58 34.42 1pkh s HIS 128 CO 0.01 -0.26 1.43 1.04 -0.85 0.00 0.00 174.74 176.11 1pkh n GLN 129 N 3.64 2.57 -4.12 1.40 1.13 -1.26 -4.93 117.38 115.81 1pkh n GLN 129 Ca -0.19 -2.40 -0.10 0.00 -1.94 0.00 0.00 57.00 52.36 1pkh n GLN 129 Cb 0.56 -1.51 -0.09 0.00 0.11 0.00 0.00 30.24 29.30 1pkh n GLN 129 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1pkh s THR 130 N -1.24 0.05 0.60 5.09 -4.23 -1.26 -5.04 115.64 109.61 1pkh s THR 130 Ca 0.41 -1.80 0.32 0.00 -1.18 0.00 0.00 61.69 59.44 1pkh s THR 130 Cb 0.23 -2.20 0.37 0.00 1.34 0.00 0.00 72.50 72.24 1pkh s THR 130 CO 0.31 -0.21 2.23 0.00 -0.54 0.00 0.00 174.62 176.41 1pkh h ALA 131 N 2.65 1.51 0.00 3.99 0.00 -1.92 -3.47 119.26 122.02 1pkh h ALA 131 Ca -0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1pkh h ALA 131 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1pkh h ALA 131 CO 0.52 -0.07 0.00 0.41 0.00 0.00 0.00 179.25 180.12 1pkh n GLY 132 N -1.30 0.63 3.58 0.00 0.00 -1.26 -4.54 105.19 102.29 1pkh n GLY 132 Ca -0.02 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.53 1pkh n GLY 132 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1pkh n TRP 133 N -2.73 1.23 -4.52 1.61 7.02 -1.26 -1.29 117.44 117.49 1pkh n TRP 133 Ca 0.00 0.70 -0.29 0.00 -1.02 0.00 0.00 57.50 56.89 1pkh n TRP 133 Cb 0.00 -2.26 -0.17 0.00 -2.42 0.00 0.00 31.31 26.47 1pkh n TRP 133 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 1pkh s ILE 134 N -0.60 1.56 0.44 -0.99 1.01 0.17 -4.95 121.20 117.84 1pkh s ILE 134 Ca 0.66 -0.68 -0.25 0.00 0.00 0.00 0.00 60.65 60.38 1pkh s ILE 134 Cb -0.78 -1.41 -0.09 0.00 0.01 0.00 0.00 42.46 40.18 1pkh s ILE 134 CO 0.56 0.45 1.27 0.47 0.00 0.00 0.00 174.94 177.68 1pkh n ASP 135 N 4.13 2.50 -4.62 3.58 8.00 -1.26 -2.66 116.55 126.22 1pkh n ASP 135 Ca -0.19 1.09 -0.44 0.00 0.71 0.00 0.00 54.79 55.96 1pkh n ASP 135 Cb 0.51 -1.50 -0.01 0.00 -0.02 0.00 0.00 41.12 40.10 1pkh n ASP 135 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pkh n ALA 136 N -0.32 0.22 -0.23 2.24 0.00 -1.24 -1.72 120.51 119.46 1pkh n ALA 136 Ca 0.07 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1pkh n ALA 136 Cb 0.40 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.77 1pkh n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pkh n GLY 137 N 1.09 1.48 3.76 0.00 0.00 -0.91 -4.83 105.19 105.78 1pkh n GLY 137 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1pkh n GLY 137 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1pkh s PHE 138 N -2.85 2.38 -0.06 1.61 5.36 -0.70 -4.66 117.98 119.06 1pkh s PHE 138 Ca 0.00 1.27 0.01 0.00 -0.96 0.00 0.00 56.93 57.25 1pkh s PHE 138 Cb 0.00 -3.93 0.02 0.00 -0.34 0.00 0.00 43.02 38.77 1pkh s PHE 138 CO 0.00 -3.03 -0.07 0.15 -1.46 0.00 0.00 175.22 170.81 1pkh s LYS 139 N -2.56 1.19 0.00 10.12 1.02 -1.26 -0.39 119.74 127.86 1pkh s LYS 139 Ca 0.64 -0.21 0.00 0.00 0.02 0.00 0.00 55.97 56.42 1pkh s LYS 139 Cb -0.44 -1.14 0.00 0.00 -0.52 0.00 0.00 37.83 35.73 1pkh s LYS 139 CO 0.55 -0.09 0.00 0.41 -0.92 0.00 0.00 175.35 175.30 1pkh n GLY 140 N 4.20 1.79 3.86 -3.33 0.00 -0.07 -4.99 105.19 106.65 1pkh n GLY 140 Ca -0.21 -1.33 -0.30 0.00 0.00 0.00 0.00 46.02 44.19 1pkh n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pkh s LYS 141 N -1.94 2.22 -0.23 1.61 1.02 -1.26 -0.60 119.74 120.56 1pkh s LYS 141 Ca 0.00 0.37 -0.13 0.00 0.02 0.00 0.00 55.97 56.23 1pkh s LYS 141 Cb 0.00 -1.96 -0.04 0.00 -0.52 0.00 0.00 37.83 35.31 1pkh s LYS 141 CO 0.00 -1.47 0.29 0.42 -0.92 0.00 0.00 175.35 173.67 1pkh s ILE 142 N -3.37 5.26 0.01 2.17 -1.09 -1.26 -4.93 121.20 117.99 1pkh s ILE 142 Ca 0.61 0.44 -0.30 0.00 -2.23 0.00 0.00 60.65 59.17 1pkh s ILE 142 Cb -0.12 -3.62 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1pkh s ILE 142 CO 0.52 0.27 1.02 -0.89 -1.23 0.00 0.00 174.94 174.63 1pkh s THR 143 N 1.37 4.72 -0.17 2.92 2.01 -1.26 -1.40 115.64 123.83 1pkh s THR 143 Ca 0.13 1.96 -0.07 0.00 0.31 0.00 0.00 61.69 64.01 1pkh s THR 143 Cb -0.15 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.07 1pkh s THR 143 CO 0.07 0.14 0.08 -0.76 -0.69 0.00 0.00 174.62 173.46 1pkh s LEU 144 N 1.07 3.93 -0.57 4.42 1.43 -0.05 -4.95 118.68 123.95 1pkh s LEU 144 Ca 0.53 0.16 -0.07 0.00 -1.03 0.00 0.00 54.13 53.72 1pkh s LEU 144 Cb -0.22 -1.98 0.15 0.00 0.03 0.00 0.00 46.19 44.16 1pkh s LEU 144 CO 0.28 0.22 0.43 -1.61 0.23 0.00 0.00 176.35 175.90 1pkh s GLU 145 N 0.07 2.63 -0.23 1.70 2.02 -0.28 -0.70 118.70 123.91 1pkh s GLU 145 Ca 0.06 -2.15 -0.11 0.00 0.02 0.00 0.00 54.97 52.79 1pkh s GLU 145 Cb -0.12 -3.90 -0.05 0.00 0.10 0.00 0.00 34.13 30.17 1pkh s GLU 145 CO 0.00 -1.19 0.17 0.42 0.02 0.00 0.00 175.26 174.69 1pkh s ILE 146 N 0.65 5.36 -0.05 -1.63 1.01 -0.13 -2.46 121.20 123.94 1pkh s ILE 146 Ca 0.12 0.21 -0.04 0.00 0.00 0.00 0.00 60.65 60.94 1pkh s ILE 146 Cb -0.21 -3.51 0.02 0.00 0.01 0.00 0.00 42.46 38.77 1pkh s ILE 146 CO -0.03 0.35 0.12 -0.69 0.00 0.00 0.00 174.94 174.69 1pkh s VAL 147 N 1.00 -0.01 -0.13 2.92 1.01 -0.73 -1.69 120.40 122.77 1pkh s VAL 147 Ca 0.08 0.03 -0.07 0.00 0.00 0.00 0.00 61.98 62.03 1pkh s VAL 147 Cb -0.13 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 1pkh s VAL 147 CO 0.04 0.01 0.11 0.00 0.00 0.00 0.00 175.10 175.26 1pkh s ALA 148 N 0.27 3.71 -0.68 5.51 0.00 -1.26 -1.39 121.76 127.91 1pkh s ALA 148 Ca -0.02 -0.68 0.06 0.00 0.00 0.00 0.00 51.96 51.32 1pkh s ALA 148 Cb -0.03 -1.91 0.03 0.00 0.00 0.00 0.00 23.12 21.22 1pkh s ALA 148 CO -0.01 0.51 0.63 1.19 0.00 0.00 0.00 175.76 178.08 1pkh n PHE 149 N 2.35 0.00 0.00 0.00 3.72 0.36 -3.99 117.46 119.91 1pkh n PHE 149 Ca -0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1pkh n PHE 149 Cb 0.54 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.08 1pkh n PHE 149 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1pkh n ASP 150 N 0.15 0.00 -4.45 4.37 2.03 -1.26 -5.04 116.55 112.35 1pkh n ASP 150 Ca 0.03 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.13 1pkh n ASP 150 Cb 0.14 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.43 1pkh n ASP 150 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1pkh s LYS 151 N -0.88 1.63 0.54 -0.67 1.02 -1.26 -4.87 119.74 115.25 1pkh s LYS 151 Ca 0.00 -1.89 -0.22 0.00 0.02 0.00 0.00 55.97 53.88 1pkh s LYS 151 Cb 0.00 -0.95 -0.05 0.00 -0.52 0.00 0.00 37.83 36.31 1pkh s LYS 151 CO 0.00 -0.13 1.35 -2.30 -0.92 0.00 0.00 175.35 173.35 1pkh n PRO 152 N -0.67 1.70 -4.77 -1.68 -0.02 -1.26 -4.62 135.00 123.68 1pkh n PRO 152 Ca -0.03 0.62 -0.27 0.00 -2.02 0.00 0.00 63.50 61.81 1pkh n PRO 152 Cb 0.66 -2.56 -0.17 0.00 -0.02 0.00 0.00 33.50 31.41 1pkh n PRO 152 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pkh s VAL 153 N -1.29 1.40 -0.05 -1.45 1.01 -0.16 -4.94 120.40 114.92 1pkh s VAL 153 Ca 0.71 -0.63 -0.27 0.00 0.00 0.00 0.00 61.98 61.79 1pkh s VAL 153 Cb -0.42 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 1pkh s VAL 153 CO 0.50 0.41 0.86 -0.63 0.00 0.00 0.00 175.10 176.24 1pkh s ILE 154 N 0.57 4.93 -0.07 2.22 1.01 -1.26 -1.12 121.20 127.49 1pkh s ILE 154 Ca -0.16 1.79 0.03 0.00 0.00 0.00 0.00 60.65 62.31 1pkh s ILE 154 Cb -0.16 -4.20 -0.02 0.00 0.01 0.00 0.00 42.46 38.09 1pkh s ILE 154 CO 0.05 0.17 -0.15 -0.76 0.00 0.00 0.00 174.94 174.25 1pkh s LEU 155 N 1.13 2.68 -0.12 2.97 1.43 0.08 -4.99 118.68 121.85 1pkh s LEU 155 Ca 0.45 -0.25 -0.03 0.00 -1.03 0.00 0.00 54.13 53.27 1pkh s LEU 155 Cb -0.19 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 1pkh s LEU 155 CO 0.22 0.30 0.00 -0.31 0.23 0.00 0.00 176.35 176.79 1pkh s TYR 156 N -0.48 3.14 0.12 0.29 2.02 -1.26 -1.42 117.35 119.76 1pkh s TYR 156 Ca 0.06 0.03 -0.35 0.00 -0.37 0.00 0.00 57.07 56.44 1pkh s TYR 156 Cb -0.12 -1.89 -0.17 0.00 -0.40 0.00 0.00 41.96 39.39 1pkh s TYR 156 CO 0.02 0.27 1.19 1.17 -1.57 0.00 0.00 175.55 176.63 1pkh n LYS 157 N 2.78 0.97 -0.88 -0.62 4.81 0.28 -1.75 118.16 123.74 1pkh n LYS 157 Ca -0.18 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.61 1pkh n LYS 157 Cb 0.53 -1.88 0.00 0.00 0.02 0.00 0.00 35.03 33.70 1pkh n LYS 157 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1pkh n ASN 158 N 2.14 -0.92 -4.75 3.14 5.03 0.56 -4.96 115.26 115.49 1pkh n ASN 158 Ca 0.17 0.00 -0.34 0.00 0.87 0.00 0.00 54.58 55.28 1pkh n ASN 158 Cb 0.20 -0.93 0.06 0.00 -1.02 0.00 0.00 39.78 38.09 1pkh n ASN 158 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pkh s GLN 159 N -0.38 2.64 0.11 3.52 -2.07 -0.72 -4.44 119.66 118.32 1pkh s GLN 159 Ca 0.00 1.54 -0.31 0.00 -1.82 0.00 0.00 55.36 54.77 1pkh s GLN 159 Cb 0.00 -1.92 -0.09 0.00 -1.09 0.00 0.00 33.01 29.91 1pkh s GLN 159 CO 0.00 -1.40 1.66 1.03 -1.32 0.00 0.00 175.29 175.26 1pkh s ARG 160 N -3.95 4.19 -0.03 9.60 0.52 -1.26 -1.00 118.95 127.02 1pkh s ARG 160 Ca 0.70 2.39 0.05 0.00 -0.52 0.00 0.00 55.73 58.35 1pkh s ARG 160 Cb -0.24 -3.47 -0.07 0.00 0.52 0.00 0.00 34.95 31.69 1pkh s ARG 160 CO 0.41 -0.72 0.06 1.51 0.02 0.00 0.00 175.30 176.58 1pkh n ILE 161 N 4.51 0.21 -3.36 1.52 0.13 -0.17 -4.89 119.36 117.32 1pkh n ILE 161 Ca 0.16 -0.18 0.00 0.00 -1.10 0.00 0.00 62.75 61.63 1pkh n ILE 161 Cb 0.39 -0.36 0.00 0.00 -0.84 0.00 0.00 39.64 38.83 1pkh n ILE 161 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1pkh n GLY 162 N 2.48 1.10 3.11 4.50 0.00 -1.20 -1.20 105.19 113.98 1pkh n GLY 162 Ca -0.05 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 1pkh n GLY 162 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pkh s GLN 163 N -1.11 0.56 -0.17 1.61 1.11 0.46 -1.07 119.66 121.05 1pkh s GLN 163 Ca 0.00 -0.71 -0.06 0.00 0.01 0.00 0.00 55.36 54.59 1pkh s GLN 163 Cb 0.00 0.22 -0.04 0.00 -1.01 0.00 0.00 33.01 32.18 1pkh s GLN 163 CO 0.00 -0.14 0.04 -0.51 0.01 0.00 0.00 175.29 174.69 1pkh s LEU 164 N -2.02 3.70 -0.19 2.90 1.43 0.08 -1.09 118.68 123.50 1pkh s LEU 164 Ca -0.07 0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.05 1pkh s LEU 164 Cb -0.02 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 1pkh s LEU 164 CO -0.04 0.19 -0.05 -0.63 0.23 0.00 0.00 176.35 176.05 1pkh s ILE 165 N 0.28 3.55 -0.15 -0.59 1.09 -0.17 -0.93 121.20 124.28 1pkh s ILE 165 Ca 0.02 -0.46 -0.04 0.00 -1.10 0.00 0.00 60.65 59.07 1pkh s ILE 165 Cb -0.13 -2.58 -0.03 0.00 -1.06 0.00 0.00 42.46 38.67 1pkh s ILE 165 CO 0.01 0.46 -0.01 -0.36 -0.10 0.00 0.00 174.94 174.93 1pkh s PHE 166 N 0.93 3.08 -0.01 3.97 0.08 -1.26 -0.20 117.98 124.57 1pkh s PHE 166 Ca -0.00 -0.15 0.07 0.00 0.12 0.00 0.00 56.93 56.96 1pkh s PHE 166 Cb -0.15 -1.95 -0.02 0.00 -0.57 0.00 0.00 43.02 40.33 1pkh s PHE 166 CO 0.01 0.08 -0.23 0.45 -0.10 0.00 0.00 175.22 175.43 1pkh s SER 167 N 0.18 3.37 0.40 1.36 0.15 0.44 -0.77 113.70 118.81 1pkh s SER 167 Ca -0.00 -0.41 -0.26 0.00 0.70 0.00 0.00 55.95 55.97 1pkh s SER 167 Cb -0.13 -0.48 -0.09 0.00 -1.71 0.00 0.00 66.02 63.61 1pkh s SER 167 CO 0.02 0.31 1.32 -0.54 1.20 0.00 0.00 173.24 175.56 1pkh s LYS 168 N -0.78 4.00 0.43 5.44 -0.14 -0.36 -1.55 119.74 126.79 1pkh s LYS 168 Ca 0.11 2.20 -0.17 0.00 -1.36 0.00 0.00 55.97 56.75 1pkh s LYS 168 Cb -0.10 -2.80 -0.09 0.00 -1.68 0.00 0.00 37.83 33.16 1pkh s LYS 168 CO 0.00 -0.48 0.90 -0.51 -0.76 0.00 0.00 175.35 174.51 1pkh s LEU 169 N -2.35 3.85 0.36 3.17 1.43 -0.27 -4.33 118.68 120.53 1pkh s LEU 169 Ca 0.56 1.52 0.12 0.00 -1.03 0.00 0.00 54.13 55.30 1pkh s LEU 169 Cb -0.39 -4.40 0.67 0.00 0.03 0.00 0.00 46.19 42.10 1pkh s LEU 169 CO 0.51 -0.41 1.80 0.25 0.23 0.00 0.00 176.35 178.73 1pkh h LEU 170 N 1.59 0.04 -7.89 1.79 5.85 -1.96 -3.45 115.31 111.28 1pkh h LEU 170 Ca -0.48 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.13 1pkh h LEU 170 Cb 1.18 -0.01 -0.15 0.00 0.37 0.00 0.00 40.66 42.05 1pkh h LEU 170 CO 0.62 0.42 -0.44 -0.44 -0.34 0.00 0.00 178.44 178.26 1pkh s SER 171 N -6.92 0.19 0.37 1.25 0.01 -1.26 -5.14 113.70 102.20 1pkh s SER 171 Ca -0.03 -0.68 -0.27 0.00 1.31 0.00 0.00 55.95 56.27 1pkh s SER 171 Cb 0.14 0.30 -0.10 0.00 0.21 0.00 0.00 66.02 66.57 1pkh s SER 171 CO 0.73 -0.67 1.35 -2.16 0.41 0.00 0.00 173.24 172.90 1pkh s PRO 172 N -3.66 4.13 0.62 12.44 0.04 -1.26 -4.83 135.00 142.48 1pkh s PRO 172 Ca 0.04 2.28 -0.09 0.00 0.04 0.00 0.00 61.00 63.27 1pkh s PRO 172 Cb 0.04 -2.92 -0.02 0.00 0.04 0.00 0.00 34.50 31.65 1pkh s PRO 172 CO -0.10 -0.40 0.99 0.00 0.04 0.00 0.00 177.00 177.53 1pkh s ALA 173 N -1.18 3.12 -0.71 8.56 0.00 -0.07 -5.01 121.76 126.48 1pkh s ALA 173 Ca 0.53 -0.33 -0.03 0.00 0.00 0.00 0.00 51.96 52.13 1pkh s ALA 173 Cb -0.41 -2.91 0.23 0.00 0.00 0.00 0.00 23.12 20.04 1pkh s ALA 173 CO 0.54 -0.79 2.33 -0.25 0.00 0.00 0.00 175.76 177.59 1pkh n ASP 174 N -2.72 7.12 0.00 0.00 9.92 -1.26 -4.87 116.55 124.73 1pkh n ASP 174 Ca 0.05 -3.57 0.00 0.00 -0.53 0.00 0.00 54.79 50.74 1pkh n ASP 174 Cb 0.56 -1.14 0.00 0.00 -0.64 0.00 0.00 41.12 39.89 1pkh n ASP 174 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85