#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 0.15 2.02 1.01 -1.26 -1.17 121.20 126.89 1pkh s ILE 2 Ca 0.00 1.52 -0.31 0.00 0.00 0.00 0.00 60.65 61.86 1pkh s ILE 2 Cb 0.00 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.31 1pkh s ILE 2 CO 0.00 0.29 1.52 -0.76 0.00 0.00 0.00 174.94 175.99 1pkh s LEU 3 N 0.50 4.37 0.89 2.97 1.02 0.20 -4.98 118.68 123.65 1pkh s LEU 3 Ca 0.38 2.54 -0.14 0.00 0.02 0.00 0.00 54.13 56.93 1pkh s LEU 3 Cb -0.19 -3.59 0.14 0.00 0.02 0.00 0.00 46.19 42.57 1pkh s LEU 3 CO 0.20 -0.78 1.21 -0.94 0.02 0.00 0.00 176.35 176.06 1pkh s SER 4 N 1.17 3.74 0.27 2.29 1.04 -1.26 -4.43 113.70 116.52 1pkh s SER 4 Ca 0.69 0.64 -0.02 0.00 0.48 0.00 0.00 55.95 57.74 1pkh s SER 4 Cb -0.42 -1.00 0.59 0.00 0.10 0.00 0.00 66.02 65.30 1pkh s SER 4 CO 0.31 -2.37 1.64 -2.24 0.98 0.00 0.00 173.24 171.56 1pkh h ASP 5 N -1.38 -0.14 -0.76 7.02 -0.00 -0.89 0.54 116.42 120.81 1pkh h ASP 5 Ca -0.46 0.19 0.01 0.00 -0.00 0.00 0.00 57.03 56.77 1pkh h ASP 5 Cb 1.30 0.29 -0.04 0.00 -0.00 0.00 0.00 39.33 40.89 1pkh h ASP 5 CO 0.55 -0.16 0.50 0.50 -0.00 0.00 0.00 179.24 180.63 1pkh h LYS 6 N 0.17 1.00 -0.14 4.15 3.64 -1.90 -1.07 116.57 122.42 1pkh h LYS 6 Ca 0.49 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.75 1pkh h LYS 6 Cb 0.94 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1pkh h LYS 6 CO -0.65 0.67 -0.13 -0.44 -2.27 0.00 0.00 179.45 176.62 1pkh h ASP 7 N 1.03 0.36 -0.51 4.20 3.45 -1.61 -1.95 116.42 121.39 1pkh h ASP 7 Ca 0.28 -0.48 0.06 0.00 0.43 0.00 0.00 57.03 57.32 1pkh h ASP 7 Cb -0.11 -0.10 -0.05 0.00 -0.56 0.00 0.00 39.33 38.50 1pkh h ASP 7 CO -0.06 0.76 0.20 0.40 -1.57 0.00 0.00 179.24 178.98 1pkh h ILE 8 N -0.03 0.86 -0.58 0.35 2.04 -0.67 0.06 117.51 119.54 1pkh h ILE 8 Ca 0.02 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1pkh h ILE 8 Cb 0.66 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1pkh h ILE 8 CO 0.03 0.07 0.31 0.40 0.00 0.00 0.00 178.15 178.96 1pkh h ILE 9 N 0.39 1.19 -0.19 -0.67 1.08 -1.13 -0.68 117.51 117.51 1pkh h ILE 9 Ca 0.24 -0.50 0.02 0.00 -0.39 0.00 0.00 64.86 64.23 1pkh h ILE 9 Cb 0.23 0.47 -0.02 0.00 -3.07 0.00 0.00 36.82 34.43 1pkh h ILE 9 CO -0.23 0.21 0.04 0.44 -0.69 0.00 0.00 178.15 177.92 1pkh h ASP 10 N 0.78 0.02 0.19 1.72 3.32 -0.82 -0.29 116.42 121.34 1pkh h ASP 10 Ca 0.20 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.17 1pkh h ASP 10 Cb 0.06 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1pkh h ASP 10 CO -0.03 0.04 -0.40 1.88 -1.72 0.00 0.00 179.24 179.01 1pkh h TYR 11 N 0.12 0.33 -0.29 4.55 0.99 -0.75 -1.93 116.97 119.99 1pkh h TYR 11 Ca 0.08 -0.09 -0.16 0.00 2.00 0.00 0.00 58.73 60.57 1pkh h TYR 11 Cb 0.07 -0.07 -0.00 0.00 1.00 0.00 0.00 36.73 37.73 1pkh h TYR 11 CO -0.14 0.64 -0.45 0.28 -0.00 0.00 0.00 178.16 178.50 1pkh h VAL 12 N 0.24 1.29 -0.76 -2.88 2.07 -0.95 -0.27 116.25 114.98 1pkh h VAL 12 Ca 0.02 -1.64 0.05 0.00 0.82 0.00 0.00 66.70 65.95 1pkh h VAL 12 Cb 0.81 1.62 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 1pkh h VAL 12 CO 0.06 0.53 0.46 0.74 0.02 0.00 0.00 177.57 179.39 1pkh h THR 13 N 0.59 1.05 -0.14 2.57 2.02 -0.56 -2.08 112.91 116.35 1pkh h THR 13 Ca 0.03 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1pkh h THR 13 Cb 1.05 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 1pkh h THR 13 CO 0.10 0.16 0.00 -1.54 0.37 0.00 0.00 175.52 174.61 1pkh n SER 14 N -4.67 1.52 -1.33 4.18 3.41 -0.77 -4.91 113.62 111.05 1pkh n SER 14 Ca 0.10 -1.66 -0.15 0.00 -0.26 0.00 0.00 58.87 56.89 1pkh n SER 14 Cb 0.13 -0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 63.95 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 0.22 -1.09 -0.04 4.33 5.02 -0.78 -4.90 118.16 120.92 1pkh n LYS 15 Ca 0.16 0.92 -0.15 0.00 -2.02 0.00 0.00 58.31 57.22 1pkh n LYS 15 Cb 0.31 -5.12 -0.04 0.00 -0.02 0.00 0.00 35.03 30.16 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 0.79 -5.11 1.97 3.08 -1.33 -3.40 114.38 110.37 1pkh h ARG 16 Ca -0.32 -0.58 -0.67 0.00 0.07 0.00 0.00 59.98 58.49 1pkh h ARG 16 Cb 1.07 0.10 -0.31 0.00 0.08 0.00 0.00 29.97 30.91 1pkh h ARG 16 CO 0.44 1.20 -0.80 0.42 -1.07 0.00 0.00 179.97 180.15 1pkh s ILE 17 N -3.90 2.63 -0.04 2.04 1.01 -0.76 -3.55 121.20 118.63 1pkh s ILE 17 Ca -0.10 -0.77 -0.20 0.00 0.00 0.00 0.00 60.65 59.58 1pkh s ILE 17 Cb 0.09 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.39 1pkh s ILE 17 CO 0.89 0.50 0.57 -0.63 0.00 0.00 0.00 174.94 176.28 1pkh s ILE 18 N 1.08 4.99 -0.10 2.92 -1.09 -0.46 -4.04 121.20 124.50 1pkh s ILE 18 Ca -0.00 1.19 -0.02 0.00 -2.23 0.00 0.00 60.65 59.58 1pkh s ILE 18 Cb -0.14 -3.91 0.04 0.00 -1.58 0.00 0.00 42.46 36.87 1pkh s ILE 18 CO -0.04 0.38 0.03 -0.63 -1.23 0.00 0.00 174.94 173.45 1pkh s ILE 19 N 0.07 0.24 -0.12 2.92 1.01 -1.26 -1.64 121.20 122.42 1pkh s ILE 19 Ca 0.30 0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.97 1pkh s ILE 19 Cb -0.17 -0.55 0.03 0.00 0.01 0.00 0.00 42.46 41.78 1pkh s ILE 19 CO 0.16 0.08 -0.04 -0.54 0.00 0.00 0.00 174.94 174.60 1pkh s LYS 20 N 2.02 1.15 0.57 2.79 1.02 -0.02 -3.07 119.74 124.20 1pkh s LYS 20 Ca 0.03 -0.20 -0.17 0.00 0.02 0.00 0.00 55.97 55.65 1pkh s LYS 20 Cb -0.14 -1.52 -0.04 0.00 -0.52 0.00 0.00 37.83 35.62 1pkh s LYS 20 CO -0.06 -0.34 1.08 -1.25 -0.92 0.00 0.00 175.35 173.87 1pkh s PRO 21 N 1.79 3.30 -0.15 -1.68 0.04 -1.26 -0.98 135.00 136.06 1pkh s PRO 21 Ca 0.04 1.38 -0.05 0.00 0.04 0.00 0.00 61.00 62.41 1pkh s PRO 21 Cb -0.13 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 1pkh s PRO 21 CO -0.07 -0.85 0.02 0.12 0.04 0.00 0.00 177.00 176.26 1pkh s PHE 22 N -2.16 3.17 -0.19 0.56 2.19 -1.18 -4.85 117.98 115.53 1pkh s PHE 22 Ca 0.67 -0.01 0.01 0.00 0.33 0.00 0.00 56.93 57.93 1pkh s PHE 22 Cb -0.19 -1.98 0.04 0.00 -1.31 0.00 0.00 43.02 39.57 1pkh s PHE 22 CO 0.32 0.17 -0.11 -0.80 1.83 0.00 0.00 175.22 176.63 1pkh s ASN 23 N 0.10 3.24 0.52 6.13 0.01 -1.26 -5.02 114.94 118.65 1pkh s ASN 23 Ca 0.03 -0.80 0.29 0.00 -0.71 0.00 0.00 52.86 51.67 1pkh s ASN 23 Cb -0.13 -1.22 1.41 0.00 0.41 0.00 0.00 41.25 41.72 1pkh s ASN 23 CO 0.01 -0.12 2.03 0.50 -1.51 0.00 0.00 177.10 178.01 1pkh h LYS 24 N 7.99 0.00 0.00 -0.60 3.64 -1.99 -1.16 116.57 124.46 1pkh h LYS 24 Ca -0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1pkh h LYS 24 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1pkh h LYS 24 CO 0.49 0.12 0.00 -0.40 -2.27 0.00 0.00 179.45 177.39 1pkh n ASP 25 N -3.46 0.00 -0.55 4.20 3.85 -1.26 -2.44 116.55 116.89 1pkh n ASP 25 Ca -0.01 -0.66 0.13 0.00 -0.71 0.00 0.00 54.79 53.54 1pkh n ASP 25 Cb 0.27 -0.08 0.34 0.00 -1.35 0.00 0.00 41.12 40.31 1pkh n ASP 25 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 1pkh n PHE 26 N -1.08 0.00 -2.56 2.11 3.01 -0.44 -4.83 117.46 113.68 1pkh n PHE 26 Ca 0.19 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.22 1pkh n PHE 26 Cb 0.13 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 39.55 1pkh n PHE 26 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1pkh s VAL 27 N -2.15 4.35 0.32 -4.37 1.01 -1.02 -1.13 120.40 117.41 1pkh s VAL 27 Ca 0.31 1.54 0.02 0.00 0.00 0.00 0.00 61.98 63.85 1pkh s VAL 27 Cb 0.20 -4.34 0.06 0.00 0.00 0.00 0.00 36.38 32.30 1pkh s VAL 27 CO 0.39 -0.52 0.44 0.61 0.00 0.00 0.00 175.10 176.02 1pkh n GLY 28 N 4.10 1.27 0.37 4.51 0.00 0.26 -4.99 105.19 110.71 1pkh n GLY 28 Ca 0.13 -2.08 0.13 0.00 0.00 0.00 0.00 46.02 44.20 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 0.62 -0.16 1.61 0.11 -1.97 -3.30 132.00 128.92 1pkh h PRO 29 Ca -0.15 -0.04 -0.20 0.00 0.11 0.00 0.00 66.00 65.73 1pkh h PRO 29 Cb 0.59 -0.14 -0.24 0.00 0.11 0.00 0.00 31.00 31.33 1pkh h PRO 29 CO 0.18 0.41 -0.57 0.00 -0.21 0.00 0.00 178.00 177.80 1pkh s SER 31 N -2.07 -0.16 -0.11 0.00 1.04 -1.25 -4.57 113.70 106.57 1pkh s SER 31 Ca 0.16 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 56.13 1pkh s SER 31 Cb 0.40 0.52 0.02 0.00 0.10 0.00 0.00 66.02 67.07 1pkh s SER 31 CO -0.10 -0.98 -0.14 -0.47 0.98 0.00 0.00 173.24 172.54 1pkh s TYR 32 N -3.23 1.90 0.26 5.02 5.04 0.01 -0.57 117.35 125.78 1pkh s TYR 32 Ca 0.13 -0.93 -0.30 0.00 -2.44 0.00 0.00 57.07 53.53 1pkh s TYR 32 Cb -0.02 -1.41 -0.09 0.00 0.35 0.00 0.00 41.96 40.79 1pkh s TYR 32 CO 0.03 -0.51 0.99 -0.51 -1.34 0.00 0.00 175.55 174.21 1pkh s ASP 33 N 1.17 7.52 0.29 4.32 1.01 -0.28 -0.49 116.67 130.20 1pkh s ASP 33 Ca -0.03 2.03 0.11 0.00 0.71 0.00 0.00 52.55 55.37 1pkh s ASP 33 Cb -0.14 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.12 1pkh s ASP 33 CO -0.04 0.06 -0.14 0.68 0.21 0.00 0.00 175.17 175.94 1pkh s VAL 34 N -1.20 2.65 0.14 -1.27 -7.23 -0.41 -4.92 120.40 108.17 1pkh s VAL 34 Ca 0.43 -2.26 0.08 0.00 -1.81 0.00 0.00 61.98 58.41 1pkh s VAL 34 Cb -0.27 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 1pkh s VAL 34 CO 0.34 -0.36 -0.17 0.42 -0.31 0.00 0.00 175.10 175.02 1pkh s THR 35 N -2.49 1.64 -0.16 5.32 -4.23 -1.26 -0.99 115.64 113.48 1pkh s THR 35 Ca 0.31 -1.82 -0.27 0.00 -1.18 0.00 0.00 61.69 58.73 1pkh s THR 35 Cb -0.04 -1.71 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 1pkh s THR 35 CO 0.16 -0.33 0.92 -0.22 -0.54 0.00 0.00 174.62 174.62 1pkh s LEU 36 N -2.53 4.18 0.86 4.79 2.96 0.03 -0.68 118.68 128.29 1pkh s LEU 36 Ca 0.13 1.32 -0.12 0.00 -0.22 0.00 0.00 54.13 55.24 1pkh s LEU 36 Cb -0.06 -3.38 0.11 0.00 0.50 0.00 0.00 46.19 43.35 1pkh s LEU 36 CO 0.05 -0.46 1.10 -0.83 -1.32 0.00 0.00 176.35 174.89 1pkh s GLY 37 N 1.15 1.62 0.00 7.98 0.00 -0.01 -0.24 107.32 117.81 1pkh s GLY 37 Ca 0.42 -0.17 0.26 0.00 0.00 0.00 0.00 44.72 45.23 1pkh s GLY 37 CO 0.13 0.31 1.71 2.09 0.00 0.00 0.00 173.10 177.33 1pkh n ASP 38 N -3.69 1.43 -4.65 1.64 5.68 -1.26 -4.71 116.55 110.98 1pkh n ASP 38 Ca 0.07 -1.54 -0.35 0.00 -0.50 0.00 0.00 54.79 52.48 1pkh n ASP 38 Cb 0.56 -0.03 -0.10 0.00 -1.14 0.00 0.00 41.12 40.41 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 -1.93 2.96 0.06 0.11 2.02 -1.26 -1.59 118.70 119.07 1pkh s GLU 39 Ca 0.36 -0.44 0.03 0.00 0.02 0.00 0.00 54.97 54.94 1pkh s GLU 39 Cb 0.20 -2.75 -0.03 0.00 0.10 0.00 0.00 34.13 31.64 1pkh s GLU 39 CO 0.31 0.68 -0.09 -0.06 0.02 0.00 0.00 175.26 176.12 1pkh s PHE 40 N -0.82 0.86 -0.06 1.61 0.40 -0.23 -4.06 117.98 115.68 1pkh s PHE 40 Ca 0.12 -0.58 0.05 0.00 -0.60 0.00 0.00 56.93 55.93 1pkh s PHE 40 Cb -0.11 -0.50 -0.01 0.00 0.51 0.00 0.00 43.02 42.91 1pkh s PHE 40 CO 0.02 -0.05 -0.22 0.42 0.70 0.00 0.00 175.22 176.09 1pkh s ILE 41 N -1.85 1.82 -0.13 0.64 1.01 -0.10 -0.42 121.20 122.16 1pkh s ILE 41 Ca -0.03 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 59.72 1pkh s ILE 41 Cb -0.07 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.86 1pkh s ILE 41 CO -0.00 0.51 -0.20 -0.63 0.00 0.00 0.00 174.94 174.62 1pkh s ILE 42 N 0.00 1.90 0.53 2.92 1.09 -0.22 -1.43 121.20 126.00 1pkh s ILE 42 Ca -0.06 -0.88 -0.18 0.00 -1.10 0.00 0.00 60.65 58.42 1pkh s ILE 42 Cb -0.14 -1.70 -0.06 0.00 -1.06 0.00 0.00 42.46 39.50 1pkh s ILE 42 CO 0.04 0.52 1.05 -0.31 -0.10 0.00 0.00 174.94 176.14 1pkh s TYR 43 N 0.89 2.99 -0.57 3.97 2.02 -1.26 0.14 117.35 125.53 1pkh s TYR 43 Ca -0.06 1.55 0.06 0.00 -0.37 0.00 0.00 57.07 58.24 1pkh s TYR 43 Cb -0.15 -3.05 0.20 0.00 -0.40 0.00 0.00 41.96 38.56 1pkh s TYR 43 CO -0.02 -0.97 0.53 -3.47 -1.57 0.00 0.00 175.55 170.04 1pkh n ASP 44 N -1.41 1.89 -3.76 2.29 2.03 0.39 -4.83 116.55 113.16 1pkh n ASP 44 Ca 0.09 -2.98 -0.13 0.00 0.52 0.00 0.00 54.79 52.28 1pkh n ASP 44 Cb 0.53 -0.67 -0.09 0.00 -0.72 0.00 0.00 41.12 40.17 1pkh n ASP 44 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1pkh s ASP 45 N -1.31 -0.21 0.14 1.67 1.01 -1.26 -4.61 116.67 112.09 1pkh s ASP 45 Ca 0.32 0.15 -0.11 0.00 0.71 0.00 0.00 52.55 53.62 1pkh s ASP 45 Cb 0.06 0.35 -0.06 0.00 1.01 0.00 0.00 42.92 44.28 1pkh s ASP 45 CO -0.13 -0.41 1.44 -0.08 0.21 0.00 0.00 175.17 176.20 1pkh h GLU 46 N 4.04 0.92 -4.35 8.23 4.81 -1.99 -3.45 114.58 122.78 1pkh h GLU 46 Ca -0.29 -0.53 -0.18 0.00 -0.13 0.00 0.00 59.36 58.23 1pkh h GLU 46 Cb 1.18 0.04 -0.17 0.00 0.63 0.00 0.00 28.75 30.43 1pkh h GLU 46 CO 0.39 1.18 -0.70 0.14 -0.73 0.00 0.00 179.01 179.29 1pkh s VAL 47 N -4.27 0.38 -0.41 0.32 -7.23 -1.26 -5.12 120.40 102.81 1pkh s VAL 47 Ca -0.11 -1.57 -0.14 0.00 -1.81 0.00 0.00 61.98 58.35 1pkh s VAL 47 Cb 0.11 -1.20 0.03 0.00 0.56 0.00 0.00 36.38 35.88 1pkh s VAL 47 CO 0.89 -0.78 0.28 -0.31 -0.31 0.00 0.00 175.10 174.87 1pkh s TYR 48 N -3.01 3.25 -0.34 2.82 2.02 -1.26 -5.03 117.35 115.79 1pkh s TYR 48 Ca 0.02 -0.79 -0.07 0.00 -0.37 0.00 0.00 57.07 55.86 1pkh s TYR 48 Cb 0.01 -2.63 0.04 0.00 -0.40 0.00 0.00 41.96 38.98 1pkh s TYR 48 CO -0.05 -0.65 0.11 0.34 -1.57 0.00 0.00 175.55 173.73 1pkh s ASP 49 N 1.77 5.34 0.34 2.29 2.15 -1.26 -4.99 116.67 122.32 1pkh s ASP 49 Ca 0.04 -1.11 0.26 0.00 0.43 0.00 0.00 52.55 52.17 1pkh s ASP 49 Cb -0.20 -1.88 1.20 0.00 -0.30 0.00 0.00 42.92 41.74 1pkh s ASP 49 CO 0.08 -0.32 1.78 -0.07 -0.17 0.00 0.00 175.17 176.46 1pkh h LEU 50 N 8.24 0.00 -2.39 -1.34 3.38 -2.02 -1.01 115.31 120.17 1pkh h LEU 50 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1pkh h LEU 50 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1pkh h LEU 50 CO 0.61 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.91 1pkh h SER 51 N 0.00 0.00 -1.99 -0.43 4.64 -2.04 -3.44 113.55 110.29 1pkh h SER 51 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1pkh h SER 51 Cb 0.23 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1pkh h SER 51 CO 0.00 0.00 -0.42 -0.54 -0.87 0.00 0.00 176.83 175.00 1pkh s LYS 52 N -3.96 3.09 -0.27 4.77 -0.14 -0.38 -5.09 119.74 117.76 1pkh s LYS 52 Ca -0.03 -1.01 -0.29 0.00 -1.36 0.00 0.00 55.97 53.28 1pkh s LYS 52 Cb 0.11 -2.72 0.01 0.00 -1.68 0.00 0.00 37.83 33.56 1pkh s LYS 52 CO 0.46 0.23 1.09 -2.00 -0.76 0.00 0.00 175.35 174.37 1pkh s GLU 53 N -4.02 4.14 0.48 1.68 2.12 -1.26 -4.94 118.70 116.90 1pkh s GLU 53 Ca 0.39 1.23 -0.20 0.00 0.36 0.00 0.00 54.97 56.74 1pkh s GLU 53 Cb -0.08 -3.71 -0.09 0.00 0.26 0.00 0.00 34.13 30.51 1pkh s GLU 53 CO 0.28 -0.80 1.03 -0.51 -0.54 0.00 0.00 175.26 174.73 1pkh s LEU 54 N 3.51 3.85 0.27 2.70 1.43 -1.26 -5.02 118.68 124.17 1pkh s LEU 54 Ca 0.46 1.91 -0.27 0.00 -1.03 0.00 0.00 54.13 55.20 1pkh s LEU 54 Cb -0.14 -4.56 -0.09 0.00 0.03 0.00 0.00 46.19 41.43 1pkh s LEU 54 CO 0.12 -0.75 0.92 0.20 0.23 0.00 0.00 176.35 177.07 1pkh s ASN 55 N -1.99 7.44 0.23 2.29 -0.87 -1.26 -5.00 114.94 115.77 1pkh s ASN 55 Ca 0.67 1.84 -0.14 0.00 -1.57 0.00 0.00 52.86 53.65 1pkh s ASN 55 Cb -0.16 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.50 1pkh s ASN 55 CO 0.19 0.05 0.49 -0.72 -2.57 0.00 0.00 177.10 174.54 1pkh s TYR 56 N -1.41 0.21 -0.03 2.20 -0.85 -1.26 -0.46 117.35 115.75 1pkh s TYR 56 Ca 0.45 -0.58 0.05 0.00 -0.52 0.00 0.00 57.07 56.47 1pkh s TYR 56 Cb -0.22 0.25 -0.02 0.00 0.38 0.00 0.00 41.96 42.35 1pkh s TYR 56 CO 0.27 -0.97 -0.18 0.15 -1.52 0.00 0.00 175.55 173.29 1pkh s LYS 57 N -3.97 2.33 -0.09 -3.49 3.01 0.12 -4.84 119.74 112.80 1pkh s LYS 57 Ca 0.18 -0.80 -0.05 0.00 -1.01 0.00 0.00 55.97 54.28 1pkh s LYS 57 Cb -0.01 -2.25 -0.04 0.00 -1.01 0.00 0.00 37.83 34.52 1pkh s LYS 57 CO 0.05 0.59 0.13 1.03 0.51 0.00 0.00 175.35 177.66 1pkh s ARG 58 N -0.78 3.36 0.08 1.68 0.52 -1.26 -1.06 118.95 121.49 1pkh s ARG 58 Ca 0.11 -0.22 0.03 0.00 -0.52 0.00 0.00 55.73 55.14 1pkh s ARG 58 Cb -0.10 -3.10 -0.03 0.00 0.52 0.00 0.00 34.95 32.23 1pkh s ARG 58 CO 0.01 0.74 -0.10 0.96 0.02 0.00 0.00 175.30 176.93 1pkh s ILE 59 N -1.07 0.85 -0.12 1.52 -4.36 0.43 -4.99 121.20 113.46 1pkh s ILE 59 Ca 0.17 -1.52 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 1pkh s ILE 59 Cb -0.12 -1.21 0.02 0.00 1.25 0.00 0.00 42.46 42.40 1pkh s ILE 59 CO 0.07 -0.52 -0.10 -0.75 0.24 0.00 0.00 174.94 173.87 1pkh s LYS 60 N -2.55 1.79 0.13 0.37 2.20 -1.26 -1.06 119.74 119.36 1pkh s LYS 60 Ca 0.02 -0.37 -0.18 0.00 -0.36 0.00 0.00 55.97 55.08 1pkh s LYS 60 Cb -0.04 -1.73 -0.07 0.00 -1.51 0.00 0.00 37.83 34.47 1pkh s LYS 60 CO -0.00 -0.23 0.60 0.96 -0.36 0.00 0.00 175.35 176.33 1pkh s ILE 61 N 1.53 4.72 0.13 5.43 -4.36 -0.62 -4.98 121.20 123.05 1pkh s ILE 61 Ca 0.03 1.14 -0.03 0.00 -0.26 0.00 0.00 60.65 61.53 1pkh s ILE 61 Cb -0.13 -3.85 -0.18 0.00 1.25 0.00 0.00 42.46 39.54 1pkh s ILE 61 CO -0.08 0.39 1.31 0.11 0.24 0.00 0.00 174.94 176.91 1pkh h LYS 62 N 4.00 0.35 0.00 0.37 6.56 -1.95 -3.45 116.57 122.44 1pkh h LYS 62 Ca -0.49 -0.39 0.00 0.00 -1.06 0.00 0.00 60.65 58.71 1pkh h LYS 62 Cb 1.20 0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.98 1pkh h LYS 62 CO 0.65 1.08 0.00 -1.71 -2.06 0.00 0.00 179.45 177.41 1pkh n ASN 63 N -3.71 0.00 -3.60 0.86 5.15 -1.26 -4.94 115.26 107.77 1pkh n ASN 63 Ca -0.06 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.79 1pkh n ASN 63 Cb 0.84 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 40.04 1pkh n ASN 63 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1pkh s SER 64 N -1.99 -0.38 -0.01 1.20 1.04 -1.26 -0.31 113.70 112.00 1pkh s SER 64 Ca 0.00 0.04 0.02 0.00 0.48 0.00 0.00 55.95 56.49 1pkh s SER 64 Cb 0.00 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 1pkh s SER 64 CO 0.00 -0.74 -0.05 -0.51 0.98 0.00 0.00 173.24 172.92 1pkh s ILE 65 N -2.75 0.42 -0.31 -1.02 2.07 -0.08 -1.09 121.20 118.44 1pkh s ILE 65 Ca -0.04 -0.21 -0.12 0.00 -1.41 0.00 0.00 60.65 58.87 1pkh s ILE 65 Cb -0.00 -0.37 -0.03 0.00 0.13 0.00 0.00 42.46 42.19 1pkh s ILE 65 CO -0.04 0.13 0.23 -0.22 -1.91 0.00 0.00 174.94 173.13 1pkh s LEU 66 N -0.03 4.26 -0.30 8.50 2.96 -0.45 -0.75 118.68 132.87 1pkh s LEU 66 Ca 0.01 -0.18 -0.09 0.00 -0.22 0.00 0.00 54.13 53.64 1pkh s LEU 66 Cb -0.03 -2.16 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 1pkh s LEU 66 CO -0.00 -0.16 0.15 -0.69 -1.32 0.00 0.00 176.35 174.33 1pkh s VAL 67 N 1.78 4.65 0.04 1.68 1.01 -0.27 -1.36 120.40 127.93 1pkh s VAL 67 Ca 0.07 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1pkh s VAL 67 Cb -0.17 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1pkh s VAL 67 CO 0.11 0.12 0.13 0.00 0.00 0.00 0.00 175.10 175.46 1pkh n PRO 69 N 0.67 0.14 -1.64 0.00 -0.02 -1.25 -1.09 135.00 131.81 1pkh n PRO 69 Ca -0.09 0.12 -0.41 0.00 -2.02 0.00 0.00 63.50 61.10 1pkh n PRO 69 Cb 0.52 -2.32 0.02 0.00 -0.02 0.00 0.00 33.50 31.70 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 -2.80 3.21 -1.91 2.45 7.94 -1.26 -2.83 117.00 121.80 1pkh n LEU 70 Ca 0.13 1.04 -0.13 0.00 -1.11 0.00 0.00 56.01 55.93 1pkh n LEU 70 Cb 0.51 -1.41 0.02 0.00 0.53 0.00 0.00 43.42 43.07 1pkh n LEU 70 CO 0.49 -1.23 0.02 0.59 -1.11 0.00 0.00 177.39 176.15 1pkh n ASN 71 N 0.27 -4.26 0.05 1.96 3.02 -1.26 -4.89 115.26 110.16 1pkh n ASN 71 Ca 0.09 -0.19 0.12 0.00 -0.03 0.00 0.00 54.58 54.57 1pkh n ASN 71 Cb 0.40 -3.09 0.27 0.00 -0.61 0.00 0.00 39.78 36.75 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 -3.97 0.47 -3.24 3.10 9.36 -1.13 -4.98 117.16 116.76 1pkh n TYR 72 Ca -0.06 0.14 -0.24 0.00 3.32 0.00 0.00 57.90 61.06 1pkh n TYR 72 Cb 0.57 -0.62 0.02 0.00 -0.63 0.00 0.00 39.34 38.68 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 -1.97 -6.55 -4.59 2.98 5.03 -1.26 -4.93 115.26 103.97 1pkh n ASN 73 Ca 0.04 0.08 -0.43 0.00 0.87 0.00 0.00 54.58 55.15 1pkh n ASN 73 Cb 0.41 -3.31 -0.04 0.00 -1.02 0.00 0.00 39.78 35.82 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 -2.71 4.01 0.28 3.41 1.43 -1.26 -5.03 118.68 118.82 1pkh s LEU 74 Ca 0.30 0.39 0.06 0.00 -1.03 0.00 0.00 54.13 53.85 1pkh s LEU 74 Cb -0.05 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 42.94 1pkh s LEU 74 CO 0.83 -0.91 0.34 0.42 0.23 0.00 0.00 176.35 177.27 1pkh s THR 75 N 3.53 4.58 0.38 5.49 -4.23 -1.26 -4.93 115.64 119.19 1pkh s THR 75 Ca 0.37 -1.13 0.15 0.00 -1.18 0.00 0.00 61.69 59.91 1pkh s THR 75 Cb -0.11 -3.57 0.37 0.00 1.34 0.00 0.00 72.50 70.52 1pkh s THR 75 CO 0.21 -0.27 1.78 -0.33 -0.54 0.00 0.00 174.62 175.46 1pkh h GLU 76 N 1.18 0.46 -0.42 3.99 5.08 -1.99 0.98 114.58 123.87 1pkh h GLU 76 Ca -0.49 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 57.75 1pkh h GLU 76 Cb 1.24 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1pkh h GLU 76 CO 0.59 0.30 -0.12 1.05 -1.00 0.00 0.00 179.01 179.83 1pkh h GLU 77 N 0.47 0.82 -0.55 2.33 9.09 -2.00 -0.99 114.58 123.76 1pkh h GLU 77 Ca 0.59 -0.32 -0.11 0.00 0.05 0.00 0.00 59.36 59.56 1pkh h GLU 77 Cb 1.35 -0.04 -0.02 0.00 -1.65 0.00 0.00 28.75 28.38 1pkh h GLU 77 CO -0.32 0.95 -0.08 -0.22 0.05 0.00 0.00 179.01 179.39 1pkh h LYS 78 N 0.65 1.02 0.02 1.06 1.63 -1.53 -1.24 116.57 118.18 1pkh h LYS 78 Ca 0.11 -0.36 -0.00 0.00 -0.85 0.00 0.00 60.65 59.54 1pkh h LYS 78 Cb 0.65 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 1pkh h LYS 78 CO 0.04 1.05 -0.01 0.82 -3.45 0.00 0.00 179.45 177.90 1pkh h ILE 79 N 0.91 1.02 -0.12 2.00 2.04 -0.74 -0.88 117.51 121.74 1pkh h ILE 79 Ca 0.15 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 1pkh h ILE 79 Cb 0.64 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1pkh h ILE 79 CO 0.04 0.03 -0.22 0.78 0.00 0.00 0.00 178.15 178.79 1pkh h ASN 80 N -0.08 0.20 -0.19 1.72 2.35 -1.05 -0.20 115.58 118.33 1pkh h ASN 80 Ca -0.00 -0.05 0.05 0.00 -0.55 0.00 0.00 56.30 55.75 1pkh h ASN 80 Cb 0.07 -0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 1pkh h ASN 80 CO 0.00 0.43 -0.25 0.22 -1.65 0.00 0.00 177.43 176.18 1pkh h TYR 81 N 0.19 -0.68 -0.41 1.19 5.03 -0.77 0.88 116.97 122.39 1pkh h TYR 81 Ca 0.03 0.04 -0.13 0.00 2.58 0.00 0.00 58.73 61.25 1pkh h TYR 81 Cb 0.49 0.33 -0.01 0.00 1.55 0.00 0.00 36.73 39.09 1pkh h TYR 81 CO 0.01 -0.33 -0.25 0.74 -1.32 0.00 0.00 178.16 177.00 1pkh h PHE 82 N -0.29 0.99 -0.57 -3.82 0.05 -0.61 0.34 116.94 113.02 1pkh h PHE 82 Ca 0.12 -0.24 -0.02 0.00 3.82 0.00 0.00 57.97 61.64 1pkh h PHE 82 Cb 0.47 -0.23 -0.03 0.00 2.00 0.00 0.00 35.95 38.17 1pkh h PHE 82 CO -0.38 1.02 0.27 0.87 -0.18 0.00 0.00 178.31 179.90 1pkh h LYS 83 N 0.74 0.83 -0.28 1.51 1.57 -0.83 0.25 116.57 120.36 1pkh h LYS 83 Ca 0.09 -0.13 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1pkh h LYS 83 Cb 0.80 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 1pkh h LYS 83 CO 0.07 0.69 -0.13 1.05 -0.57 0.00 0.00 179.45 180.56 1pkh h GLU 84 N 0.78 0.58 0.06 3.15 4.11 -0.60 -0.51 114.58 122.14 1pkh h GLU 84 Ca 0.20 -0.25 -0.24 0.00 0.07 0.00 0.00 59.36 59.13 1pkh h GLU 84 Cb 0.14 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1pkh h GLU 84 CO -0.02 0.82 -1.06 -0.22 0.07 0.00 0.00 179.01 178.59 1pkh h LYS 85 N 0.33 0.32 -0.06 1.06 3.64 -0.60 -3.32 116.57 117.93 1pkh h LYS 85 Ca 0.06 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1pkh h LYS 85 Cb 0.64 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1pkh h LYS 85 CO 0.04 1.14 0.00 0.66 -2.27 0.00 0.00 179.45 179.02 1pkh n TYR 86 N -3.64 0.07 -3.47 1.91 4.01 0.87 -4.99 117.16 111.91 1pkh n TYR 86 Ca -0.07 -0.09 -0.24 0.00 -0.16 0.00 0.00 57.90 57.34 1pkh n TYR 86 Cb 0.91 -0.01 0.06 0.00 -0.31 0.00 0.00 39.34 40.00 1pkh n TYR 86 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1pkh n ASN 87 N 0.46 -6.13 -4.89 7.72 5.15 -0.20 -5.00 115.26 112.37 1pkh n ASN 87 Ca 0.06 -0.49 -0.30 0.00 -0.60 0.00 0.00 54.58 53.24 1pkh n ASN 87 Cb 0.25 -4.87 -0.04 0.00 -0.53 0.00 0.00 39.78 34.59 1pkh n ASN 87 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1pkh s VAL 88 N -3.27 4.97 0.03 3.44 -7.23 -1.24 -4.85 120.40 112.25 1pkh s VAL 88 Ca 0.52 0.29 0.10 0.00 -1.81 0.00 0.00 61.98 61.07 1pkh s VAL 88 Cb -0.23 -3.67 -0.15 0.00 0.56 0.00 0.00 36.38 32.88 1pkh s VAL 88 CO 0.64 -0.20 1.21 0.44 -0.31 0.00 0.00 175.10 176.88 1pkh h ASP 89 N 2.11 0.00 -4.67 4.85 3.32 -1.48 -3.43 116.42 117.12 1pkh h ASP 89 Ca -0.47 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.44 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 0.87 -0.37 -0.31 -1.72 0.00 0.00 179.24 178.39 1pkh s TYR 90 N -2.76 -0.15 -0.13 4.55 1.51 -1.23 -5.02 117.35 114.12 1pkh s TYR 90 Ca 0.01 0.28 0.01 0.00 -1.01 0.00 0.00 57.07 56.35 1pkh s TYR 90 Cb 0.09 0.06 0.02 0.00 -0.11 0.00 0.00 41.96 42.02 1pkh s TYR 90 CO 0.80 -0.29 -0.13 0.08 -1.11 0.00 0.00 175.55 174.90 1pkh s VAL 91 N -0.94 1.44 0.19 0.71 1.01 -1.26 -1.34 120.40 120.21 1pkh s VAL 91 Ca -0.10 -0.56 0.05 0.00 0.00 0.00 0.00 61.98 61.36 1pkh s VAL 91 Cb -0.05 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 1pkh s VAL 91 CO 0.02 0.44 -0.07 0.68 0.00 0.00 0.00 175.10 176.16 1pkh s VAL 92 N 1.41 1.25 0.12 2.92 -7.23 -0.46 -4.99 120.40 113.41 1pkh s VAL 92 Ca 0.02 -2.08 0.07 0.00 -1.81 0.00 0.00 61.98 58.18 1pkh s VAL 92 Cb -0.13 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 1pkh s VAL 92 CO -0.08 -0.56 -0.17 -1.83 -0.31 0.00 0.00 175.10 172.15 1pkh s GLU 93 N -3.77 1.05 2.27 4.82 -1.05 -1.26 -0.69 118.70 120.08 1pkh s GLU 93 Ca 0.22 -1.20 0.00 0.00 -0.15 0.00 0.00 54.97 53.85 1pkh s GLU 93 Cb 0.03 -1.09 0.00 0.00 -0.44 0.00 0.00 34.13 32.63 1pkh s GLU 93 CO 0.05 0.23 0.00 0.41 0.95 0.00 0.00 175.26 176.90 1pkh n GLY 94 N 0.77 -1.06 3.75 -3.83 0.00 -0.25 -4.84 105.19 99.73 1pkh n GLY 94 Ca -0.17 -1.22 -0.40 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.47 3.02 -0.02 -0.02 0.00 -1.26 -4.72 107.32 103.86 1pkh s GLY 95 Ca 0.00 0.74 0.02 0.00 0.00 0.00 0.00 44.72 45.48 1pkh s GLY 95 CO 0.00 1.43 -0.07 0.54 0.00 0.00 0.00 173.10 175.00 1pkh s VAL 96 N -0.78 0.59 0.02 1.40 0.11 -0.73 -4.76 120.40 116.25 1pkh s VAL 96 Ca 0.45 -0.27 -0.17 0.00 -2.93 0.00 0.00 61.98 59.06 1pkh s VAL 96 Cb -0.28 -0.53 -0.06 0.00 -1.53 0.00 0.00 36.38 33.98 1pkh s VAL 96 CO 0.35 0.19 0.50 -0.76 -3.33 0.00 0.00 175.10 172.05 1pkh s LEU 97 N 0.18 4.47 0.00 2.54 1.43 -0.51 -0.49 118.68 126.30 1pkh s LEU 97 Ca -0.02 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 1pkh s LEU 97 Cb -0.07 -2.75 -0.00 0.00 0.03 0.00 0.00 46.19 43.40 1pkh s LEU 97 CO -0.00 0.25 0.01 0.61 0.23 0.00 0.00 176.35 177.45 1pkh n GLY 98 N 1.98 4.07 3.13 -3.19 0.00 0.24 -0.93 105.19 110.50 1pkh n GLY 98 Ca -0.11 -1.94 -0.12 0.00 0.00 0.00 0.00 46.02 43.86 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 -1.59 0.07 0.63 2.61 -1.32 -1.26 -0.84 115.64 113.95 1pkh s THR 99 Ca 0.01 -0.61 -0.16 0.00 -1.21 0.00 0.00 61.69 59.72 1pkh s THR 99 Cb 0.00 -0.47 -0.02 0.00 -1.51 0.00 0.00 72.50 70.51 1pkh s THR 99 CO 0.01 -0.34 1.11 0.42 -2.21 0.00 0.00 174.62 173.61 1pkh s THR 100 N -1.31 3.28 0.35 5.08 -4.23 -0.51 -0.83 115.64 117.47 1pkh s THR 100 Ca -0.14 0.63 0.10 0.00 -1.18 0.00 0.00 61.69 61.10 1pkh s THR 100 Cb -0.07 -3.16 0.09 0.00 1.34 0.00 0.00 72.50 70.70 1pkh s THR 100 CO 0.02 -0.33 1.80 0.78 -0.54 0.00 0.00 174.62 176.35 1pkh h ASN 101 N 0.31 0.15 -3.50 3.99 -0.26 -1.19 -3.42 115.58 111.65 1pkh h ASN 101 Ca -0.47 -0.05 -0.52 0.00 -0.56 0.00 0.00 56.30 54.69 1pkh h ASN 101 Cb 1.25 -0.04 -0.02 0.00 -1.06 0.00 0.00 38.32 38.45 1pkh h ASN 101 CO 0.55 0.47 0.37 -1.61 -1.06 0.00 0.00 177.43 176.16 1pkh s GLU 102 N -4.31 4.64 -0.18 0.81 8.01 -1.26 -4.57 118.70 121.84 1pkh s GLU 102 Ca -0.04 1.46 -0.13 0.00 0.01 0.00 0.00 54.97 56.27 1pkh s GLU 102 Cb 0.14 -3.40 -0.05 0.00 -4.31 0.00 0.00 34.13 26.52 1pkh s GLU 102 CO 0.74 0.11 0.25 -0.47 0.01 0.00 0.00 175.26 175.90 1pkh s TYR 103 N 0.35 3.42 0.19 1.61 6.14 -0.15 -4.04 117.35 124.87 1pkh s TYR 103 Ca 0.49 0.50 0.09 0.00 0.64 0.00 0.00 57.07 58.79 1pkh s TYR 103 Cb -0.23 -2.31 -0.04 0.00 0.42 0.00 0.00 41.96 39.79 1pkh s TYR 103 CO 0.29 0.21 -0.19 0.96 0.64 0.00 0.00 175.55 177.47 1pkh s ILE 104 N 0.59 1.96 -0.06 3.14 -4.36 0.52 -0.84 121.20 122.15 1pkh s ILE 104 Ca 0.14 -2.04 0.01 0.00 -0.26 0.00 0.00 60.65 58.50 1pkh s ILE 104 Cb -0.13 -1.97 0.02 0.00 1.25 0.00 0.00 42.46 41.63 1pkh s ILE 104 CO 0.03 -0.35 -0.08 -1.61 0.24 0.00 0.00 174.94 173.17 1pkh s GLU 105 N -3.01 1.30 -0.13 0.37 2.02 -0.65 -0.64 118.70 117.95 1pkh s GLU 105 Ca 0.19 -0.26 -0.06 0.00 0.02 0.00 0.00 54.97 54.87 1pkh s GLU 105 Cb -0.05 -1.19 -0.04 0.00 0.10 0.00 0.00 34.13 32.95 1pkh s GLU 105 CO 0.08 -0.06 0.09 -0.51 0.02 0.00 0.00 175.26 174.88 1pkh s LEU 106 N 0.92 4.04 0.00 1.80 1.43 -0.05 -1.35 118.68 125.47 1pkh s LEU 106 Ca -0.10 0.29 -0.17 0.00 -1.03 0.00 0.00 54.13 53.11 1pkh s LEU 106 Cb -0.15 -1.98 0.24 0.00 0.03 0.00 0.00 46.19 44.33 1pkh s LEU 106 CO 0.01 0.34 1.17 -0.81 0.23 0.00 0.00 176.35 177.29 1pkh n PRO 107 N 2.43 -1.85 0.00 1.29 -0.04 -1.23 -2.16 135.00 133.43 1pkh n PRO 107 Ca -0.19 -1.83 0.11 0.00 -0.04 0.00 0.00 63.50 61.56 1pkh n PRO 107 Cb 0.54 -1.37 0.65 0.00 -0.04 0.00 0.00 33.50 33.28 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 -4.14 0.00 -0.05 3.54 0.23 -1.26 -2.44 115.26 111.14 1pkh n ASN 108 Ca 0.15 -1.19 0.05 0.00 -0.53 0.00 0.00 54.58 53.05 1pkh n ASN 108 Cb 0.55 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.31 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 -0.87 2.00 -3.96 0.53 5.75 -1.26 -0.78 116.55 117.97 1pkh n ASP 109 Ca 0.16 -2.46 -0.18 0.00 -0.01 0.00 0.00 54.79 52.31 1pkh n ASP 109 Cb 0.08 -0.20 -0.15 0.00 -1.03 0.00 0.00 41.12 39.81 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 -1.78 0.53 0.16 2.12 -1.09 -1.21 -1.28 121.20 118.64 1pkh s ILE 110 Ca 0.15 -0.24 0.10 0.00 -2.23 0.00 0.00 60.65 58.43 1pkh s ILE 110 Cb 0.13 -0.48 -0.04 0.00 -1.58 0.00 0.00 42.46 40.49 1pkh s ILE 110 CO 0.01 0.17 -0.20 -0.55 -1.23 0.00 0.00 174.94 173.15 1pkh s SER 111 N 0.17 3.73 0.08 3.58 0.15 -0.55 -3.62 113.70 117.23 1pkh s SER 111 Ca -0.02 -0.69 0.08 0.00 0.70 0.00 0.00 55.95 56.02 1pkh s SER 111 Cb -0.06 -0.44 -0.03 0.00 -1.71 0.00 0.00 66.02 63.78 1pkh s SER 111 CO -0.00 0.15 -0.21 0.00 1.20 0.00 0.00 173.24 174.38 1pkh s ALA 112 N -1.41 1.77 -0.15 5.45 0.00 -1.18 -0.49 121.76 125.76 1pkh s ALA 112 Ca 0.20 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1pkh s ALA 112 Cb -0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1pkh s ALA 112 CO 0.10 0.37 -0.15 -1.14 0.00 0.00 0.00 175.76 174.95 1pkh s GLN 113 N -1.64 3.27 0.10 0.00 0.74 0.61 0.38 119.66 123.12 1pkh s GLN 113 Ca 0.07 -0.73 -0.24 0.00 0.05 0.00 0.00 55.36 54.51 1pkh s GLN 113 Cb -0.10 -2.62 -0.07 0.00 1.10 0.00 0.00 33.01 31.32 1pkh s GLN 113 CO 0.03 0.08 0.72 -0.47 -0.55 0.00 0.00 175.29 175.11 1pkh s TYR 114 N 0.66 3.83 -0.00 1.67 5.04 -0.30 -1.00 117.35 127.25 1pkh s TYR 114 Ca -0.08 1.49 0.02 0.00 -2.44 0.00 0.00 57.07 56.07 1pkh s TYR 114 Cb -0.16 -2.72 -0.01 0.00 0.35 0.00 0.00 41.96 39.43 1pkh s TYR 114 CO 0.02 0.46 -0.07 1.14 -1.34 0.00 0.00 175.55 175.76 1pkh s GLN 115 N -0.79 0.54 0.58 4.97 -2.07 -0.18 -4.44 119.66 118.26 1pkh s GLN 115 Ca 0.35 -0.26 -0.18 0.00 -1.82 0.00 0.00 55.36 53.45 1pkh s GLN 115 Cb -0.21 -0.51 -0.04 0.00 -1.09 0.00 0.00 33.01 31.15 1pkh s GLN 115 CO 0.23 0.14 1.13 0.20 -1.32 0.00 0.00 175.29 175.67 1pkh s GLY 116 N -0.22 2.50 0.52 2.60 0.00 -1.26 -0.54 107.32 110.92 1pkh s GLY 116 Ca 0.02 0.75 -0.20 0.00 0.00 0.00 0.00 44.72 45.29 1pkh s GLY 116 CO -0.00 1.11 1.12 1.09 0.00 0.00 0.00 173.10 176.41 1pkh s ARG 117 N -3.51 3.53 0.23 2.90 1.70 -0.49 -4.80 118.95 118.51 1pkh s ARG 117 Ca 0.71 1.59 -0.07 0.00 -0.47 0.00 0.00 55.73 57.49 1pkh s ARG 117 Cb -0.23 -2.10 0.24 0.00 -0.57 0.00 0.00 34.95 32.29 1pkh s ARG 117 CO 0.31 -0.70 1.89 0.77 -1.08 0.00 0.00 175.30 176.49 1pkh h SER 118 N 1.44 0.97 0.43 -2.89 0.02 -1.92 -1.11 113.55 110.49 1pkh h SER 118 Ca -0.50 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.37 1pkh h SER 118 Cb 1.25 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 1pkh h SER 118 CO 0.58 0.68 -0.31 0.77 -1.14 0.00 0.00 176.83 177.41 1pkh h SER 119 N 1.14 0.00 0.41 3.07 4.64 -1.98 -0.31 113.55 120.51 1pkh h SER 119 Ca 0.34 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.34 1pkh h SER 119 Cb -0.05 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1pkh h SER 119 CO -0.10 0.31 -1.40 -0.07 -0.87 0.00 0.00 176.83 174.71 1pkh h LEU 120 N 0.00 0.69 -1.48 5.97 3.38 -1.76 -3.24 115.31 118.87 1pkh h LEU 120 Ca -0.00 -0.74 0.12 0.00 0.09 0.00 0.00 57.88 57.35 1pkh h LEU 120 Cb 0.62 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1pkh h LEU 120 CO 0.04 1.58 0.49 1.23 0.09 0.00 0.00 178.44 181.87 1pkh h GLY 121 N 0.73 0.85 2.00 0.83 0.00 -0.67 -0.51 103.07 106.30 1pkh h GLY 121 Ca -0.21 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1pkh h GLY 121 CO 0.25 0.12 0.00 -0.09 0.00 0.00 0.00 176.54 176.81 1pkh h ARG 122 N 0.56 0.00 -0.20 4.80 2.43 -1.09 -0.78 114.38 120.10 1pkh h ARG 122 Ca 0.35 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.51 1pkh h ARG 122 Cb 0.61 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1pkh h ARG 122 CO -0.13 0.00 -0.01 1.33 -1.51 0.00 0.00 179.97 179.65 1pkh n VAL 123 N -3.05 2.21 -2.74 0.20 0.24 -0.30 -4.98 118.33 109.91 1pkh n VAL 123 Ca -0.02 -2.08 -0.17 0.00 -2.04 0.00 0.00 64.34 60.03 1pkh n VAL 123 Cb 0.13 -0.26 0.02 0.00 -1.47 0.00 0.00 33.84 32.27 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 -0.82 -1.37 -3.89 6.34 3.72 -0.30 -4.71 117.46 116.42 1pkh n PHE 124 Ca 0.21 0.33 -0.36 0.00 -0.05 0.00 0.00 57.45 57.58 1pkh n PHE 124 Cb 0.84 -3.62 -0.12 0.00 -0.94 0.00 0.00 39.48 35.63 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 -5.12 3.43 0.14 4.37 1.98 -0.60 -0.83 118.68 122.06 1pkh s LEU 125 Ca 0.19 -0.16 0.09 0.00 -2.89 0.00 0.00 54.13 51.35 1pkh s LEU 125 Cb -0.08 -1.90 -0.04 0.00 0.66 0.00 0.00 46.19 44.83 1pkh s LEU 125 CO 0.23 0.03 -0.13 0.42 -1.89 0.00 0.00 176.35 175.01 1pkh s THR 126 N 1.24 3.09 -0.03 3.68 -4.23 -0.39 -3.21 115.64 115.80 1pkh s THR 126 Ca 0.04 -1.53 0.04 0.00 -1.18 0.00 0.00 61.69 59.06 1pkh s THR 126 Cb -0.15 -2.48 0.06 0.00 1.34 0.00 0.00 72.50 71.28 1pkh s THR 126 CO 0.03 0.01 0.98 -1.54 -0.54 0.00 0.00 174.62 173.55 1pkh n SER 127 N 0.43 1.77 -3.64 3.99 3.41 -1.24 -1.74 113.62 116.61 1pkh n SER 127 Ca -0.13 -2.12 -0.11 0.00 -0.26 0.00 0.00 58.87 56.25 1pkh n SER 127 Cb 0.54 -0.10 -0.07 0.00 -0.26 0.00 0.00 64.21 64.32 1pkh n SER 127 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1pkh s HIS 128 N -1.25 -0.67 0.00 7.33 2.46 -1.01 -0.87 115.29 121.29 1pkh s HIS 128 Ca 0.07 1.58 0.00 0.00 0.47 0.00 0.00 55.06 57.17 1pkh s HIS 128 Cb 0.06 0.34 0.00 0.00 -0.13 0.00 0.00 32.58 32.85 1pkh s HIS 128 CO 0.01 -0.32 0.82 1.04 -2.47 0.00 0.00 174.74 173.81 1pkh n GLN 129 N 2.68 1.60 -4.01 2.88 3.00 -1.26 -4.93 117.38 117.33 1pkh n GLN 129 Ca -0.14 -1.14 -0.25 0.00 -0.01 0.00 0.00 57.00 55.46 1pkh n GLN 129 Cb 0.56 -0.99 -0.05 0.00 0.00 0.00 0.00 30.24 29.76 1pkh n GLN 129 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 1pkh s THR 130 N -0.64 2.12 0.39 5.09 -4.23 -1.26 -5.04 115.64 112.06 1pkh s THR 130 Ca 0.00 -1.60 0.26 0.00 -1.18 0.00 0.00 61.69 59.17 1pkh s THR 130 Cb 0.00 -2.72 0.28 0.00 1.34 0.00 0.00 72.50 71.39 1pkh s THR 130 CO 0.00 0.00 2.04 0.00 -0.54 0.00 0.00 174.62 176.12 1pkh h ALA 131 N 1.17 1.28 0.00 3.99 0.00 -1.94 -3.47 119.26 120.30 1pkh h ALA 131 Ca -0.41 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1pkh h ALA 131 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1pkh h ALA 131 CO 0.65 0.18 0.00 0.41 0.00 0.00 0.00 179.25 180.48 1pkh n GLY 132 N -0.61 0.73 3.77 0.00 0.00 -1.26 -4.54 105.19 103.28 1pkh n GLY 132 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1pkh n GLY 132 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pkh s TRP 133 N -2.40 2.82 -0.07 1.61 0.52 -1.26 -1.15 118.94 119.02 1pkh s TRP 133 Ca 0.00 1.30 0.05 0.00 0.02 0.00 0.00 56.10 57.48 1pkh s TRP 133 Cb 0.00 -3.84 -0.01 0.00 -1.15 0.00 0.00 33.47 28.47 1pkh s TRP 133 CO 0.00 -2.40 -0.24 0.42 0.02 0.00 0.00 176.95 174.75 1pkh s ILE 134 N -1.14 2.02 0.46 2.03 1.01 0.16 -4.96 121.20 120.78 1pkh s ILE 134 Ca 0.51 -1.03 -0.24 0.00 0.00 0.00 0.00 60.65 59.88 1pkh s ILE 134 Cb -0.43 -1.72 -0.07 0.00 0.01 0.00 0.00 42.46 40.25 1pkh s ILE 134 CO 0.58 0.56 1.32 -1.81 0.00 0.00 0.00 174.94 175.59 1pkh s ASP 135 N -0.01 5.95 0.36 3.58 1.01 -1.26 -3.12 116.67 123.18 1pkh s ASP 135 Ca -0.08 2.69 -0.26 0.00 0.71 0.00 0.00 52.55 55.60 1pkh s ASP 135 Cb -0.15 -2.64 -0.12 0.00 1.01 0.00 0.00 42.92 41.03 1pkh s ASP 135 CO 0.05 -1.10 1.12 0.00 0.21 0.00 0.00 175.17 175.44 1pkh n ALA 136 N -0.31 0.51 0.00 5.23 0.00 -1.24 -1.77 120.51 122.94 1pkh n ALA 136 Ca 0.06 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1pkh n ALA 136 Cb 0.44 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.76 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 1.03 1.88 3.74 0.00 0.00 -0.92 -4.83 105.19 106.09 1pkh n GLY 137 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1pkh n GLY 137 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1pkh n PHE 138 N -2.00 2.50 -3.94 1.61 7.35 -0.73 -4.66 117.46 117.59 1pkh n PHE 138 Ca 0.00 0.46 -0.23 0.00 -0.76 0.00 0.00 57.45 56.93 1pkh n PHE 138 Cb 0.00 -2.43 -0.17 0.00 0.35 0.00 0.00 39.48 37.23 1pkh n PHE 138 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1pkh s LYS 139 N -2.34 0.88 0.00 -4.13 1.02 -1.26 -0.87 119.74 113.04 1pkh s LYS 139 Ca 0.61 -0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.56 1pkh s LYS 139 Cb -0.47 -1.06 0.00 0.00 -0.52 0.00 0.00 37.83 35.78 1pkh s LYS 139 CO 0.58 -0.22 0.00 0.41 -0.92 0.00 0.00 175.35 175.20 1pkh n GLY 140 N 4.72 0.62 3.86 -3.33 0.00 0.18 -4.97 105.19 106.27 1pkh n GLY 140 Ca -0.14 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.99 2.12 -0.22 1.61 1.02 -1.26 -0.35 119.74 120.67 1pkh s LYS 141 Ca 0.00 0.35 -0.10 0.00 0.02 0.00 0.00 55.97 56.25 1pkh s LYS 141 Cb 0.00 -1.95 -0.05 0.00 -0.52 0.00 0.00 37.83 35.32 1pkh s LYS 141 CO 0.00 -1.53 0.13 0.42 -0.92 0.00 0.00 175.35 173.45 1pkh s ILE 142 N -3.38 5.25 0.02 2.17 1.01 -1.26 -4.93 121.20 120.09 1pkh s ILE 142 Ca 0.61 0.14 -0.30 0.00 0.00 0.00 0.00 60.65 61.10 1pkh s ILE 142 Cb -0.12 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 1pkh s ILE 142 CO 0.52 0.39 0.97 -0.89 0.00 0.00 0.00 174.94 175.93 1pkh s THR 143 N 0.74 4.79 -0.14 2.92 2.01 -1.26 -1.42 115.64 123.28 1pkh s THR 143 Ca 0.07 2.05 -0.04 0.00 0.31 0.00 0.00 61.69 64.08 1pkh s THR 143 Cb -0.13 -4.32 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 1pkh s THR 143 CO 0.02 0.20 0.01 -0.76 -0.69 0.00 0.00 174.62 173.40 1pkh s LEU 144 N 0.79 3.58 -0.36 4.42 1.43 -0.02 -4.96 118.68 123.55 1pkh s LEU 144 Ca 0.51 0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1pkh s LEU 144 Cb -0.21 -1.86 0.10 0.00 0.03 0.00 0.00 46.19 44.24 1pkh s LEU 144 CO 0.28 0.26 0.11 -1.61 0.23 0.00 0.00 176.35 175.62 1pkh s GLU 145 N -0.16 1.91 -0.22 1.70 8.01 -0.05 -0.59 118.70 129.31 1pkh s GLU 145 Ca 0.05 -1.73 -0.09 0.00 0.01 0.00 0.00 54.97 53.21 1pkh s GLU 145 Cb -0.12 -3.37 -0.04 0.00 -4.31 0.00 0.00 34.13 26.28 1pkh s GLU 145 CO 0.02 -0.94 0.11 0.42 0.01 0.00 0.00 175.26 174.88 1pkh s ILE 146 N 1.08 5.04 -0.05 -1.63 1.01 0.36 -2.40 121.20 124.61 1pkh s ILE 146 Ca 0.06 0.06 -0.03 0.00 0.00 0.00 0.00 60.65 60.75 1pkh s ILE 146 Cb -0.21 -3.32 0.02 0.00 0.01 0.00 0.00 42.46 38.96 1pkh s ILE 146 CO -0.05 0.39 0.11 -0.69 0.00 0.00 0.00 174.94 174.70 1pkh s VAL 147 N 0.86 -0.02 -0.17 2.92 1.01 -0.71 -1.77 120.40 122.52 1pkh s VAL 147 Ca 0.06 0.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.05 1pkh s VAL 147 Cb -0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 1pkh s VAL 147 CO 0.03 0.03 0.08 0.00 0.00 0.00 0.00 175.10 175.24 1pkh s ALA 148 N 0.55 3.51 -1.33 5.51 0.00 -1.26 -1.27 121.76 127.47 1pkh s ALA 148 Ca -0.04 -0.73 0.13 0.00 0.00 0.00 0.00 51.96 51.32 1pkh s ALA 148 Cb -0.06 -1.92 0.04 0.00 0.00 0.00 0.00 23.12 21.18 1pkh s ALA 148 CO -0.02 0.29 0.80 1.19 0.00 0.00 0.00 175.76 178.01 1pkh n PHE 149 N 3.15 0.00 0.00 0.00 3.01 -0.01 -3.95 117.46 119.65 1pkh n PHE 149 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.29 1pkh n PHE 149 Cb 0.53 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.00 1pkh n PHE 149 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1pkh n ASP 150 N 0.17 0.00 -4.38 4.37 2.03 -1.26 -5.03 116.55 112.45 1pkh n ASP 150 Ca 0.06 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.18 1pkh n ASP 150 Cb 0.29 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.58 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 -0.91 1.44 0.49 -0.67 -0.14 -1.26 -4.85 119.74 113.85 1pkh s LYS 151 Ca 0.00 -1.73 -0.23 0.00 -1.36 0.00 0.00 55.97 52.65 1pkh s LYS 151 Cb 0.00 -0.88 -0.06 0.00 -1.68 0.00 0.00 37.83 35.20 1pkh s LYS 151 CO 0.00 -0.03 1.35 -2.14 -0.76 0.00 0.00 175.35 173.77 1pkh s PRO 152 N -3.80 3.45 -0.04 -1.68 0.02 -1.26 -4.62 135.00 127.08 1pkh s PRO 152 Ca 0.29 2.24 0.04 0.00 0.02 0.00 0.00 61.00 63.58 1pkh s PRO 152 Cb 0.05 -2.44 -0.00 0.00 0.02 0.00 0.00 34.50 32.12 1pkh s PRO 152 CO 0.10 -0.94 -0.15 0.08 -0.33 0.00 0.00 177.00 175.76 1pkh s VAL 153 N -1.29 1.29 -0.13 3.83 1.01 -0.31 -4.93 120.40 119.86 1pkh s VAL 153 Ca 0.66 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 61.77 1pkh s VAL 153 Cb -0.40 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1pkh s VAL 153 CO 0.49 0.38 0.74 -0.63 0.00 0.00 0.00 175.10 176.08 1pkh s ILE 154 N 0.08 4.98 0.05 2.22 1.01 -1.26 -1.11 121.20 127.16 1pkh s ILE 154 Ca -0.04 1.47 0.07 0.00 0.00 0.00 0.00 60.65 62.15 1pkh s ILE 154 Cb -0.11 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 1pkh s ILE 154 CO 0.02 0.13 -0.18 -0.76 0.00 0.00 0.00 174.94 174.15 1pkh s LEU 155 N 1.56 2.62 -0.05 2.97 1.43 0.07 -4.98 118.68 122.30 1pkh s LEU 155 Ca 0.36 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.06 1pkh s LEU 155 Cb -0.17 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1pkh s LEU 155 CO 0.14 0.25 -0.17 -0.31 0.23 0.00 0.00 176.35 176.49 1pkh s TYR 156 N -0.95 2.64 0.13 0.29 1.51 -1.26 -0.91 117.35 118.80 1pkh s TYR 156 Ca 0.15 -0.27 -0.35 0.00 -1.01 0.00 0.00 57.07 55.59 1pkh s TYR 156 Cb -0.10 -1.62 -0.16 0.00 -0.11 0.00 0.00 41.96 39.96 1pkh s TYR 156 CO 0.06 0.10 1.29 1.17 -1.11 0.00 0.00 175.55 177.06 1pkh n LYS 157 N 2.45 1.25 -0.95 -0.62 4.81 0.58 -2.13 118.16 123.55 1pkh n LYS 157 Ca -0.17 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 1pkh n LYS 157 Cb 0.52 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.52 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 2.38 -2.21 -4.77 3.14 5.03 0.67 -4.97 115.26 114.53 1pkh n ASN 158 Ca 0.17 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.29 1pkh n ASN 158 Cb 0.22 -0.95 0.04 0.00 -1.02 0.00 0.00 39.78 38.07 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 -0.37 2.91 0.17 3.52 -2.07 -0.90 -4.45 119.66 118.46 1pkh s GLN 159 Ca 0.00 1.40 -0.31 0.00 -1.82 0.00 0.00 55.36 54.63 1pkh s GLN 159 Cb 0.00 -1.96 -0.10 0.00 -1.09 0.00 0.00 33.01 29.86 1pkh s GLN 159 CO 0.00 -1.17 1.52 1.03 -1.32 0.00 0.00 175.29 175.35 1pkh s ARG 160 N -4.00 4.24 -0.03 9.60 0.52 -1.26 -0.79 118.95 127.23 1pkh s ARG 160 Ca 0.67 2.31 0.04 0.00 -0.52 0.00 0.00 55.73 58.23 1pkh s ARG 160 Cb -0.20 -3.16 -0.05 0.00 0.52 0.00 0.00 34.95 32.05 1pkh s ARG 160 CO 0.39 -0.55 0.03 1.51 0.02 0.00 0.00 175.30 176.71 1pkh n ILE 161 N 3.65 0.22 -3.19 1.52 0.13 -0.16 -4.87 119.36 116.65 1pkh n ILE 161 Ca 0.12 -0.16 0.00 0.00 -1.10 0.00 0.00 62.75 61.62 1pkh n ILE 161 Cb 0.39 -0.62 0.00 0.00 -0.84 0.00 0.00 39.64 38.57 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 2.65 1.25 3.03 4.50 0.00 -1.21 -1.40 105.19 114.02 1pkh n GLY 162 Ca -0.05 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.74 0.42 -0.16 1.61 1.11 0.30 -1.29 119.66 120.92 1pkh s GLN 163 Ca 0.00 -0.74 -0.06 0.00 0.01 0.00 0.00 55.36 54.57 1pkh s GLN 163 Cb 0.00 0.15 -0.04 0.00 -1.01 0.00 0.00 33.01 32.12 1pkh s GLN 163 CO 0.00 -0.08 0.04 -0.51 0.01 0.00 0.00 175.29 174.75 1pkh s LEU 164 N -1.85 3.70 -0.21 2.90 1.43 0.35 -1.01 118.68 123.99 1pkh s LEU 164 Ca -0.10 0.08 -0.05 0.00 -1.03 0.00 0.00 54.13 53.03 1pkh s LEU 164 Cb -0.05 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 1pkh s LEU 164 CO -0.03 0.22 -0.01 -0.63 0.23 0.00 0.00 176.35 176.14 1pkh s ILE 165 N 0.06 3.83 -0.16 -0.59 1.09 -0.17 -0.81 121.20 124.45 1pkh s ILE 165 Ca 0.04 -0.35 -0.06 0.00 -1.10 0.00 0.00 60.65 59.18 1pkh s ILE 165 Cb -0.12 -2.74 -0.04 0.00 -1.06 0.00 0.00 42.46 38.50 1pkh s ILE 165 CO 0.01 0.42 0.03 -0.36 -0.10 0.00 0.00 174.94 174.94 1pkh s PHE 166 N 1.17 3.19 -0.02 3.97 0.08 -1.26 -0.28 117.98 124.82 1pkh s PHE 166 Ca 0.03 0.00 0.08 0.00 0.12 0.00 0.00 56.93 57.16 1pkh s PHE 166 Cb -0.14 -2.01 -0.02 0.00 -0.57 0.00 0.00 43.02 40.28 1pkh s PHE 166 CO 0.01 0.16 -0.25 0.45 -0.10 0.00 0.00 175.22 175.49 1pkh s SER 167 N 0.18 3.14 0.32 1.36 0.15 0.36 -0.63 113.70 118.59 1pkh s SER 167 Ca 0.03 -0.45 -0.29 0.00 0.70 0.00 0.00 55.95 55.94 1pkh s SER 167 Cb -0.13 -0.41 -0.10 0.00 -1.71 0.00 0.00 66.02 63.67 1pkh s SER 167 CO 0.01 0.32 1.28 -0.54 1.20 0.00 0.00 173.24 175.51 1pkh s LYS 168 N -0.59 4.40 0.44 5.44 -0.14 -0.32 -1.49 119.74 127.48 1pkh s LYS 168 Ca 0.09 2.15 -0.16 0.00 -1.36 0.00 0.00 55.97 56.70 1pkh s LYS 168 Cb -0.10 -3.09 -0.08 0.00 -1.68 0.00 0.00 37.83 32.88 1pkh s LYS 168 CO -0.01 -0.13 0.88 -0.51 -0.76 0.00 0.00 175.35 174.83 1pkh s LEU 169 N -1.75 3.80 0.35 3.17 1.43 -0.40 -4.15 118.68 121.13 1pkh s LEU 169 Ca 0.48 1.43 0.09 0.00 -1.03 0.00 0.00 54.13 55.10 1pkh s LEU 169 Cb -0.39 -4.32 0.66 0.00 0.03 0.00 0.00 46.19 42.17 1pkh s LEU 169 CO 0.51 -0.44 1.83 0.25 0.23 0.00 0.00 176.35 178.73 1pkh h LEU 170 N 1.39 0.21 -7.85 1.79 5.85 -1.96 -3.45 115.31 111.30 1pkh h LEU 170 Ca -0.47 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.09 1pkh h LEU 170 Cb 1.18 -0.06 -0.15 0.00 0.37 0.00 0.00 40.66 42.01 1pkh h LEU 170 CO 0.63 0.48 -0.41 -0.44 -0.34 0.00 0.00 178.44 178.35 1pkh s SER 171 N -6.88 0.15 0.39 1.25 0.01 -1.26 -5.14 113.70 102.22 1pkh s SER 171 Ca -0.05 -0.65 -0.27 0.00 1.31 0.00 0.00 55.95 56.29 1pkh s SER 171 Cb 0.15 0.32 -0.09 0.00 0.21 0.00 0.00 66.02 66.60 1pkh s SER 171 CO 0.75 -0.69 1.32 -2.16 0.41 0.00 0.00 173.24 172.87 1pkh s PRO 172 N -3.69 4.02 0.30 12.44 0.04 -1.26 -4.82 135.00 142.02 1pkh s PRO 172 Ca 0.04 2.21 -0.14 0.00 0.04 0.00 0.00 61.00 63.14 1pkh s PRO 172 Cb 0.04 -2.81 -0.09 0.00 0.04 0.00 0.00 34.50 31.69 1pkh s PRO 172 CO -0.10 -0.47 0.70 0.00 0.04 0.00 0.00 177.00 177.17 1pkh s ALA 173 N -1.23 3.38 -0.37 8.56 0.00 0.04 -5.02 121.76 127.12 1pkh s ALA 173 Ca 0.56 -0.01 -0.29 0.00 0.00 0.00 0.00 51.96 52.22 1pkh s ALA 173 Cb -0.39 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.03 1pkh s ALA 173 CO 0.51 0.37 1.22 0.34 0.00 0.00 0.00 175.76 178.19 1pkh s ASP 174 N -2.24 6.68 0.00 0.00 3.68 -1.26 -4.85 116.67 118.69 1pkh s ASP 174 Ca 0.52 0.92 0.11 0.00 2.13 0.00 0.00 52.55 56.23 1pkh s ASP 174 Cb -0.11 -2.54 0.68 0.00 -1.45 0.00 0.00 42.92 39.50 1pkh s ASP 174 CO 0.18 -1.12 1.39 1.33 0.13 0.00 0.00 175.17 177.08 1pkh n VAL 175 N 6.40 0.00 0.00 1.11 0.24 -1.26 -4.85 118.33 119.97 1pkh n VAL 175 Ca 0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 1pkh n VAL 175 Cb 0.48 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 1pkh n VAL 175 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pkh n GLY 176 N 0.60 3.02 3.29 7.63 0.00 -1.26 -4.98 105.19 113.49 1pkh n GLY 176 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 1pkh n GLY 176 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pkh s TYR 177 N -2.66 -0.17 -0.02 1.61 1.13 -1.26 -5.16 117.35 110.81 1pkh s TYR 177 Ca 0.00 -0.02 0.05 0.00 -1.41 0.00 0.00 57.07 55.70 1pkh s TYR 177 Cb 0.00 0.18 -0.01 0.00 -1.10 0.00 0.00 41.96 41.03 1pkh s TYR 177 CO 0.00 -0.60 -0.18 -1.54 -2.51 0.00 0.00 175.55 170.73 1pkh s SER 178 N -2.36 2.12 -0.21 -0.18 1.04 -1.26 -5.09 113.70 107.76 1pkh s SER 178 Ca -0.02 -0.33 0.02 0.00 0.48 0.00 0.00 55.95 56.10 1pkh s SER 178 Cb 0.01 -0.33 0.04 0.00 0.10 0.00 0.00 66.02 65.84 1pkh s SER 178 CO -0.07 0.20 -0.14 -1.61 0.98 0.00 0.00 173.24 172.61 1pkh s GLU 179 N -0.30 2.43 -0.20 4.02 2.02 -1.26 -5.12 118.70 120.29 1pkh s GLU 179 Ca 0.04 -0.98 -0.01 0.00 0.02 0.00 0.00 54.97 54.04 1pkh s GLU 179 Cb -0.08 -2.60 0.01 0.00 0.10 0.00 0.00 34.13 31.56 1pkh s GLU 179 CO 0.00 -0.39 -0.13 1.03 0.02 0.00 0.00 175.26 175.80 1pkh s ARG 180 N 1.28 3.10 0.00 1.61 3.00 -1.26 -5.05 118.95 121.63 1pkh s ARG 180 Ca -0.01 -0.78 0.00 0.00 0.00 0.00 0.00 55.73 54.94 1pkh s ARG 180 Cb -0.16 -2.78 0.00 0.00 0.00 0.00 0.00 34.95 32.01 1pkh s ARG 180 CO -0.09 -0.23 0.00 1.17 0.00 0.00 0.00 175.30 176.15 1pkh n LYS 181 N 4.69 0.00 0.00 3.54 3.00 -1.26 -5.38 118.16 122.75 1pkh n LYS 181 Ca -0.19 0.00 0.15 0.00 -0.00 0.00 0.00 58.31 58.26 1pkh n LYS 181 Cb 0.50 0.00 0.69 0.00 0.00 0.00 0.00 35.03 36.22 1pkh n LYS 181 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81