#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k23 n ASP 2 N 0.00 2.92 0.01 1.08 8.00 -1.26 -4.90 116.55 122.40 2k23 n ASP 2 Ca 0.00 -3.27 0.02 0.00 0.71 0.00 0.00 54.79 52.25 2k23 n ASP 2 Cb 0.00 -0.66 0.37 0.00 -0.02 0.00 0.00 41.12 40.81 2k23 n ASP 2 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2k23 h SER 3 N 4.09 0.46 -3.64 -2.24 0.02 -1.99 -3.34 113.55 106.90 2k23 h SER 3 Ca 0.17 -0.05 -0.68 0.00 -0.84 0.00 0.00 61.79 60.39 2k23 h SER 3 Cb 0.71 -0.12 -0.37 0.00 0.14 0.00 0.00 62.40 62.77 2k23 h SER 3 CO 0.75 0.43 -0.60 -0.89 -1.14 0.00 0.00 176.83 175.37 2k23 s THR 4 N -5.23 2.91 -1.60 -2.27 2.01 -1.26 -4.99 115.64 105.22 2k23 s THR 4 Ca -0.08 -2.28 -0.10 0.00 0.31 0.00 0.00 61.69 59.54 2k23 s THR 4 Cb 0.16 -3.04 -0.07 0.00 0.01 0.00 0.00 72.50 69.57 2k23 s THR 4 CO 0.74 -0.67 2.88 0.00 -0.69 0.00 0.00 174.62 176.88 2k23 n GLN 5 N 4.34 3.64 0.02 4.92 6.02 -1.26 -4.37 117.38 130.70 2k23 n GLN 5 Ca 0.01 -2.28 0.13 0.00 -0.01 0.00 0.00 57.00 54.86 2k23 n GLN 5 Cb 0.41 -2.85 0.49 0.00 1.02 0.00 0.00 30.24 29.32 2k23 n GLN 5 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2k23 n ASN 6 N 3.79 0.27 -4.76 1.08 4.05 -1.26 -4.80 115.26 113.62 2k23 n ASN 6 Ca 0.76 0.36 -0.40 0.00 0.45 0.00 0.00 54.58 55.75 2k23 n ASN 6 Cb 0.25 -0.38 -0.06 0.00 1.23 0.00 0.00 39.78 40.82 2k23 n ASN 6 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 177.26 172.73 2k23 s LEU 7 N -3.33 4.56 0.78 1.20 -0.00 -1.26 -4.97 118.68 115.65 2k23 s LEU 7 Ca 0.12 1.64 -0.12 0.00 -0.00 0.00 0.00 54.13 55.78 2k23 s LEU 7 Cb 0.17 -3.34 0.06 0.00 -0.00 0.00 0.00 46.19 43.09 2k23 s LEU 7 CO 0.58 0.13 1.15 -0.63 -0.00 0.00 0.00 176.35 177.59 2k23 s ILE 8 N -0.76 2.43 -0.18 1.48 1.01 -1.26 -4.85 121.20 119.06 2k23 s ILE 8 Ca 0.38 0.13 -0.02 0.00 0.00 0.00 0.00 60.65 61.15 2k23 s ILE 8 Cb -0.23 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.05 2k23 s ILE 8 CO 0.26 -0.18 0.42 -2.65 0.00 0.00 0.00 174.94 172.79 2k23 n PRO 9 N -3.23 0.00 -2.57 2.79 -0.02 -1.26 -4.79 135.00 125.92 2k23 n PRO 9 Ca 0.08 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.13 2k23 n PRO 9 Cb 0.60 -0.22 -0.02 0.00 -0.02 0.00 0.00 33.50 33.84 2k23 n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k23 s ALA 10 N 0.00 2.99 -0.16 3.55 0.00 -1.26 -4.68 121.76 122.20 2k23 s ALA 10 Ca 0.23 -0.80 -0.08 0.00 0.00 0.00 0.00 51.96 51.32 2k23 s ALA 10 Cb -0.15 -4.04 -0.04 0.00 0.00 0.00 0.00 23.12 18.89 2k23 s ALA 10 CO 0.10 -2.66 0.13 -1.25 0.00 0.00 0.00 175.76 172.08 2k23 s PRO 11 N 4.98 3.81 0.91 0.00 0.04 -1.26 -5.11 135.00 138.36 2k23 s PRO 11 Ca 0.44 -0.18 -0.12 0.00 0.04 0.00 0.00 61.00 61.17 2k23 s PRO 11 Cb -0.08 -3.29 0.14 0.00 0.04 0.00 0.00 34.50 31.31 2k23 s PRO 11 CO 0.26 0.53 1.10 -2.14 0.04 0.00 0.00 177.00 176.79 2k23 s PRO 12 N -0.32 1.15 0.44 0.56 0.02 -1.26 -4.89 135.00 130.71 2k23 s PRO 12 Ca 0.11 0.59 0.27 0.00 0.02 0.00 0.00 61.00 61.99 2k23 s PRO 12 Cb -0.12 -1.82 1.33 0.00 0.02 0.00 0.00 34.50 33.92 2k23 s PRO 12 CO 0.01 -2.25 1.70 1.25 -0.33 0.00 0.00 177.00 177.38 2k23 h LEU 13 N -1.55 0.28 0.00 -5.54 7.12 -1.96 -0.10 115.31 113.56 2k23 h LEU 13 Ca -0.51 0.09 0.00 0.00 0.13 0.00 0.00 57.88 57.59 2k23 h LEU 13 Cb 1.30 0.06 0.00 0.00 -0.53 0.00 0.00 40.66 41.49 2k23 h LEU 13 CO 0.58 -0.04 0.00 2.30 -0.13 0.00 0.00 178.44 181.15 2k23 n ILE 14 N -4.56 0.11 0.87 4.05 -5.35 -1.26 -1.54 119.36 111.68 2k23 n ILE 14 Ca 0.31 0.03 0.11 0.00 -0.27 0.00 0.00 62.75 62.93 2k23 n ILE 14 Cb 1.21 -0.68 0.10 0.00 -1.74 0.00 0.00 39.64 38.53 2k23 n ILE 14 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2k23 n SER 15 N -1.09 0.65 -4.45 7.28 7.64 -0.05 -4.89 113.62 118.71 2k23 n SER 15 Ca 0.14 -0.39 -0.33 0.00 1.01 0.00 0.00 58.87 59.30 2k23 n SER 15 Cb 0.10 0.56 -0.13 0.00 -1.01 0.00 0.00 64.21 63.73 2k23 n SER 15 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2k23 s VAL 16 N -3.06 3.51 0.76 0.44 0.11 -0.59 -4.98 120.40 116.60 2k23 s VAL 16 Ca 0.08 -0.50 -0.14 0.00 -2.93 0.00 0.00 61.98 58.49 2k23 s VAL 16 Cb 0.16 -2.50 0.06 0.00 -1.53 0.00 0.00 36.38 32.56 2k23 s VAL 16 CO 0.77 0.52 1.22 -2.16 -3.33 0.00 0.00 175.10 172.11 2k23 s PRO 17 N 0.24 1.91 0.08 1.54 0.04 -1.26 -5.01 135.00 132.54 2k23 s PRO 17 Ca -0.05 1.80 0.04 0.00 0.04 0.00 0.00 61.00 62.82 2k23 s PRO 17 Cb -0.15 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 2k23 s PRO 17 CO 0.04 -2.01 -0.11 -1.17 0.04 0.00 0.00 177.00 173.79 2k23 s LEU 18 N -5.36 2.34 -0.30 -3.56 2.96 -1.26 -3.55 118.68 109.94 2k23 s LEU 18 Ca 0.75 -0.70 -0.29 0.00 -0.22 0.00 0.00 54.13 53.67 2k23 s LEU 18 Cb -0.30 -0.32 -0.00 0.00 0.50 0.00 0.00 46.19 46.07 2k23 s LEU 18 CO 0.47 -0.20 1.35 -1.58 -1.32 0.00 0.00 176.35 175.08 2k23 s GLN 19 N -2.23 3.86 -0.16 1.98 -0.44 -1.12 -4.96 119.66 116.59 2k23 s GLN 19 Ca -0.00 1.26 -0.22 0.00 -2.50 0.00 0.00 55.36 53.90 2k23 s GLN 19 Cb -0.06 -3.92 -0.03 0.00 -1.64 0.00 0.00 33.01 27.36 2k23 s GLN 19 CO 0.01 -1.20 0.65 -1.25 0.50 0.00 0.00 175.29 174.00 2k23 s PRO 20 N 4.32 4.28 0.00 1.67 0.04 -1.26 -3.90 135.00 140.14 2k23 s PRO 20 Ca 0.59 0.70 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2k23 s PRO 20 Cb -0.17 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.83 2k23 s PRO 20 CO 0.25 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.54 2k23 n GLY 21 N 3.57 0.73 3.75 0.56 0.00 -1.26 -5.03 105.19 107.52 2k23 n GLY 21 Ca -0.01 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 2k23 n GLY 21 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2k23 s PHE 22 N -2.65 3.20 -0.23 1.61 5.36 -1.25 -5.01 117.98 119.00 2k23 s PHE 22 Ca 0.00 1.36 -0.01 0.00 -0.96 0.00 0.00 56.93 57.33 2k23 s PHE 22 Cb 0.00 -3.60 0.03 0.00 -0.34 0.00 0.00 43.02 39.11 2k23 s PHE 22 CO 0.00 -1.71 -0.10 -1.58 -1.46 0.00 0.00 175.22 170.37 2k23 s TRP 23 N -0.62 3.02 0.22 10.12 0.52 -1.26 -4.98 118.94 125.96 2k23 s TRP 23 Ca 0.52 -1.64 -0.12 0.00 0.02 0.00 0.00 56.10 54.87 2k23 s TRP 23 Cb -0.37 -2.01 0.27 0.00 -1.15 0.00 0.00 33.47 30.21 2k23 s TRP 23 CO 0.45 -0.76 1.62 1.79 0.02 0.00 0.00 176.95 180.08 2k23 h THR 24 N 6.15 0.34 -0.08 2.01 1.35 -1.96 -1.53 112.91 119.19 2k23 h THR 24 Ca -0.35 -0.00 -0.18 0.00 -0.55 0.00 0.00 66.41 65.33 2k23 h THR 24 Cb 1.11 0.33 0.01 0.00 -1.73 0.00 0.00 68.15 67.87 2k23 h THR 24 CO 0.58 0.00 -0.64 -0.08 -0.25 0.00 0.00 175.52 175.12 2k23 h GLU 25 N 0.01 0.58 0.00 4.72 4.81 -1.97 -3.22 114.58 119.52 2k23 h GLU 25 Ca 0.33 -0.52 -0.10 0.00 -0.13 0.00 0.00 59.36 58.94 2k23 h GLU 25 Cb 0.51 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 2k23 h GLU 25 CO -0.67 1.14 -0.63 0.00 -0.73 0.00 0.00 179.01 178.12 2k23 h ARG 26 N 0.20 0.00 -0.69 1.92 3.08 -1.93 -2.97 114.38 113.99 2k23 h ARG 26 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2k23 h ARG 26 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2k23 h ARG 26 CO 0.13 0.38 0.00 1.19 -1.07 0.00 0.00 179.97 180.60 2k23 n PHE 27 N -3.12 1.33 -3.32 3.04 3.01 -0.60 -4.74 117.46 113.06 2k23 n PHE 27 Ca 0.00 -0.56 -0.34 0.00 1.01 0.00 0.00 57.45 57.56 2k23 n PHE 27 Cb 0.72 -0.16 -0.06 0.00 -0.01 0.00 0.00 39.48 39.97 2k23 n PHE 27 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 2k23 s GLN 28 N -1.57 3.94 0.00 -1.08 -0.44 -1.12 -4.95 119.66 114.44 2k23 s GLN 28 Ca 0.51 0.47 0.00 0.00 -2.50 0.00 0.00 55.36 53.83 2k23 s GLN 28 Cb 0.31 -2.73 0.00 0.00 -1.64 0.00 0.00 33.01 28.95 2k23 s GLN 28 CO 0.28 0.35 0.00 0.41 0.50 0.00 0.00 175.29 176.83 2k23 n GLY 29 N 0.23 0.58 3.71 2.59 0.00 -1.11 -4.99 105.19 106.20 2k23 n GLY 29 Ca -0.01 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 2k23 n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k23 s ARG 30 N -1.16 4.50 -0.21 1.61 3.00 -1.26 -1.56 118.95 123.87 2k23 s ARG 30 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 55.73 56.91 2k23 s ARG 30 Cb 0.00 -3.46 0.05 0.00 0.00 0.00 0.00 34.95 31.55 2k23 s ARG 30 CO 0.00 -0.00 -0.05 -1.58 0.00 0.00 0.00 175.30 173.67 2k23 s TRP 31 N 0.93 2.09 -0.02 -0.53 0.52 -0.28 -4.56 118.94 117.08 2k23 s TRP 31 Ca 0.46 -1.49 -0.14 0.00 0.02 0.00 0.00 56.10 54.94 2k23 s TRP 31 Cb -0.20 -1.46 -0.05 0.00 -1.15 0.00 0.00 33.47 30.61 2k23 s TRP 31 CO 0.24 -0.72 0.39 -0.06 0.02 0.00 0.00 176.95 176.82 2k23 s PHE 32 N 1.50 3.69 -0.81 -1.98 0.08 0.21 -0.62 117.98 120.05 2k23 s PHE 32 Ca -0.03 0.94 -0.23 0.00 0.12 0.00 0.00 56.93 57.73 2k23 s PHE 32 Cb -0.18 -2.29 0.06 0.00 -0.57 0.00 0.00 43.02 40.05 2k23 s PHE 32 CO -0.07 0.60 1.19 0.08 -0.10 0.00 0.00 175.22 176.92 2k23 s VAL 33 N -0.88 4.13 -2.10 -0.44 1.01 -1.16 -0.36 120.40 120.60 2k23 s VAL 33 Ca 0.23 -0.45 0.26 0.00 0.00 0.00 0.00 61.98 62.02 2k23 s VAL 33 Cb -0.16 -4.85 0.29 0.00 0.00 0.00 0.00 36.38 31.65 2k23 s VAL 33 CO 0.12 -1.69 1.51 0.52 0.00 0.00 0.00 175.10 175.56 2k23 n VAL 34 N 6.20 0.00 -3.57 2.92 0.31 0.13 -4.49 118.33 119.83 2k23 n VAL 34 Ca 0.11 -0.21 -0.06 0.00 -0.01 0.00 0.00 64.34 64.17 2k23 n VAL 34 Cb 0.48 0.66 -0.02 0.00 -0.91 0.00 0.00 33.84 34.06 2k23 n VAL 34 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2k23 s GLY 35 N -2.33 -0.39 -0.24 2.92 0.00 -0.87 -2.53 107.32 103.87 2k23 s GLY 35 Ca 0.27 0.93 -0.16 0.00 0.00 0.00 0.00 44.72 45.76 2k23 s GLY 35 CO 0.46 0.29 0.61 -2.27 0.00 0.00 0.00 173.10 172.20 2k23 s LEU 36 N -2.54 -0.61 0.11 0.66 2.96 -0.81 -0.56 118.68 117.89 2k23 s LEU 36 Ca 0.07 1.31 0.06 0.00 -0.22 0.00 0.00 54.13 55.35 2k23 s LEU 36 Cb -0.01 2.09 -0.04 0.00 0.50 0.00 0.00 46.19 48.74 2k23 s LEU 36 CO -0.06 -0.22 -0.15 0.00 -1.32 0.00 0.00 176.35 174.59 2k23 s ALA 37 N 1.24 1.51 0.00 5.97 0.00 0.20 0.48 121.76 131.16 2k23 s ALA 37 Ca -0.07 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.64 2k23 s ALA 37 Cb -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2k23 s ALA 37 CO -0.13 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.19 2k23 n GLY 38 N 0.71 4.17 0.25 0.00 0.00 0.13 0.30 105.19 110.75 2k23 n GLY 38 Ca -0.17 -0.86 0.09 0.00 0.00 0.00 0.00 46.02 45.08 2k23 n GLY 38 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2k23 h ASN 39 N 0.00 0.00 -0.01 1.61 -0.73 -1.62 -0.16 115.58 114.67 2k23 h ASN 39 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2k23 h ASN 39 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.59 2k23 h ASN 39 CO 0.00 0.12 -0.00 0.00 -0.37 0.00 0.00 177.43 177.18 2k23 n ALA 40 N -2.42 2.57 -1.79 1.57 0.00 -1.25 -4.92 120.51 114.26 2k23 n ALA 40 Ca -0.02 -0.48 -0.41 0.00 0.00 0.00 0.00 53.44 52.53 2k23 n ALA 40 Cb 0.20 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 2k23 n ALA 40 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2k23 s VAL 41 N -2.01 2.59 -1.27 0.00 1.01 -0.07 -4.92 120.40 115.73 2k23 s VAL 41 Ca 0.36 0.58 -0.19 0.00 0.00 0.00 0.00 61.98 62.74 2k23 s VAL 41 Cb 0.21 -3.37 0.05 0.00 0.00 0.00 0.00 36.38 33.27 2k23 s VAL 41 CO 0.33 0.13 1.74 -1.58 0.00 0.00 0.00 175.10 175.72 2k23 s GLN 42 N -1.65 3.83 -0.66 2.72 2.00 -1.26 -4.90 119.66 119.73 2k23 s GLN 42 Ca 0.51 -1.85 -0.07 0.00 -2.00 0.00 0.00 55.36 51.94 2k23 s GLN 42 Cb -0.41 -5.50 0.17 0.00 0.80 0.00 0.00 33.01 28.07 2k23 s GLN 42 CO 0.53 -2.41 0.52 0.21 -0.50 0.00 0.00 175.29 173.65 2k23 s LYS 43 N 4.49 2.87 -0.05 1.67 2.36 -1.26 -3.11 119.74 126.70 2k23 s LYS 43 Ca 0.55 -2.37 -0.25 0.00 -2.55 0.00 0.00 55.97 51.35 2k23 s LYS 43 Cb 0.03 -3.98 -0.23 0.00 -1.05 0.00 0.00 37.83 32.60 2k23 s LYS 43 CO 0.07 -1.21 1.04 1.05 1.55 0.00 0.00 175.35 177.85 2k23 h GLU 44 N 7.51 0.15 0.00 4.03 9.09 -1.90 -3.46 114.58 130.00 2k23 h GLU 44 Ca -0.01 -0.15 0.00 0.00 0.05 0.00 0.00 59.36 59.25 2k23 h GLU 44 Cb 1.00 0.04 0.00 0.00 -1.65 0.00 0.00 28.75 28.14 2k23 h GLU 44 CO 0.75 0.88 0.00 -2.13 0.05 0.00 0.00 179.01 178.56 2k23 n ARG 45 N -4.55 0.00 0.09 1.06 3.00 -1.26 -5.03 116.66 109.97 2k23 n ARG 45 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.76 2k23 n ARG 45 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.93 2k23 n ARG 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k23 n GLN 46 N -0.04 0.00 -2.73 -0.14 10.64 -1.26 -5.08 117.38 118.77 2k23 n GLN 46 Ca 0.00 0.00 -0.05 0.00 -1.83 0.00 0.00 57.00 55.12 2k23 n GLN 46 Cb 0.00 0.00 0.03 0.00 -0.86 0.00 0.00 30.24 29.41 2k23 n GLN 46 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2k23 n SER 47 N -3.03 -2.76 0.05 2.61 7.64 -1.26 -3.82 113.62 113.04 2k23 n SER 47 Ca 0.00 -2.63 0.13 0.00 1.01 0.00 0.00 58.87 57.38 2k23 n SER 47 Cb 0.00 1.52 0.36 0.00 -1.01 0.00 0.00 64.21 65.08 2k23 n SER 47 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2k23 n ARG 48 N 2.32 0.17 -1.41 1.43 3.00 -1.22 -4.81 116.66 116.13 2k23 n ARG 48 Ca 0.12 0.09 -0.29 0.00 -0.00 0.00 0.00 57.85 57.77 2k23 n ARG 48 Cb 0.61 -1.65 0.13 0.00 0.00 0.00 0.00 32.46 31.55 2k23 n ARG 48 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 2k23 s PHE 49 N -3.08 2.52 -0.18 -0.14 5.36 -1.18 -5.02 117.98 116.26 2k23 s PHE 49 Ca 0.10 1.07 -0.15 0.00 -0.96 0.00 0.00 56.93 56.99 2k23 s PHE 49 Cb 0.15 -3.22 0.05 0.00 -0.34 0.00 0.00 43.02 39.66 2k23 s PHE 49 CO 0.63 -2.24 0.47 0.99 -1.46 0.00 0.00 175.22 173.62 2k23 s THR 50 N -3.11 -0.00 0.34 0.12 2.01 -1.26 -4.31 115.64 109.43 2k23 s THR 50 Ca 0.63 0.01 -0.28 0.00 0.31 0.00 0.00 61.69 62.36 2k23 s THR 50 Cb -0.16 -0.67 -0.10 0.00 0.01 0.00 0.00 72.50 71.58 2k23 s THR 50 CO 0.55 0.01 1.27 0.00 -0.69 0.00 0.00 174.62 175.76 2k23 s MET 51 N 0.47 4.29 0.38 4.92 0.23 -1.08 -4.85 119.30 123.66 2k23 s MET 51 Ca -0.02 2.13 0.07 0.00 -1.03 0.00 0.00 55.69 56.84 2k23 s MET 51 Cb -0.04 -3.00 -0.07 0.00 -1.53 0.00 0.00 34.83 30.19 2k23 s MET 51 CO -0.02 -0.21 -0.01 1.52 -2.03 0.00 0.00 175.02 174.28 2k23 s TYR 52 N -1.19 2.38 -0.25 3.16 -0.85 -1.26 -4.68 117.35 114.66 2k23 s TYR 52 Ca 0.50 -0.69 -0.08 0.00 -0.52 0.00 0.00 57.07 56.29 2k23 s TYR 52 Cb -0.38 -1.60 -0.03 0.00 0.38 0.00 0.00 41.96 40.33 2k23 s TYR 52 CO 0.50 0.40 0.09 -1.12 -1.52 0.00 0.00 175.55 173.90 2k23 s SER 53 N -3.64 5.33 -0.54 -0.18 0.01 -1.23 -3.00 113.70 110.45 2k23 s SER 53 Ca 0.34 -0.15 -0.17 0.00 1.31 0.00 0.00 55.95 57.28 2k23 s SER 53 Cb 0.08 -1.96 0.10 0.00 0.21 0.00 0.00 66.02 64.45 2k23 s SER 53 CO 0.17 -0.02 0.56 -0.89 0.41 0.00 0.00 173.24 173.47 2k23 s THR 54 N 1.56 5.04 -0.46 1.44 2.01 0.21 -2.75 115.64 122.69 2k23 s THR 54 Ca 0.06 -1.09 -0.11 0.00 0.31 0.00 0.00 61.69 60.86 2k23 s THR 54 Cb -0.15 -4.34 0.09 0.00 0.01 0.00 0.00 72.50 68.11 2k23 s THR 54 CO 0.05 -0.88 0.34 -0.63 -0.69 0.00 0.00 174.62 172.80 2k23 s ILE 55 N 2.12 4.58 -0.59 1.82 -1.09 -1.05 -1.13 121.20 125.86 2k23 s ILE 55 Ca 0.08 -1.41 -0.28 0.00 -2.23 0.00 0.00 60.65 56.81 2k23 s ILE 55 Cb -0.25 -3.84 0.02 0.00 -1.58 0.00 0.00 42.46 36.80 2k23 s ILE 55 CO 0.06 -0.62 1.36 -0.31 -1.23 0.00 0.00 174.94 174.20 2k23 s TYR 56 N 1.48 2.34 -0.30 3.97 2.02 -0.60 -0.74 117.35 125.52 2k23 s TYR 56 Ca 0.04 0.40 -0.14 0.00 -0.37 0.00 0.00 57.07 57.00 2k23 s TYR 56 Cb -0.25 -4.45 -0.03 0.00 -0.40 0.00 0.00 41.96 36.84 2k23 s TYR 56 CO 0.03 -1.91 0.32 -2.00 -1.57 0.00 0.00 175.55 170.42 2k23 s GLU 57 N 5.45 3.81 0.25 -0.62 2.12 -0.92 -2.74 118.70 126.05 2k23 s GLU 57 Ca 0.48 -0.24 -0.30 0.00 0.36 0.00 0.00 54.97 55.27 2k23 s GLU 57 Cb -0.10 -3.72 -0.09 0.00 0.26 0.00 0.00 34.13 30.48 2k23 s GLU 57 CO 0.24 -0.35 1.23 -0.51 -0.54 0.00 0.00 175.26 175.32 2k23 s LEU 58 N 1.96 4.46 0.00 2.70 1.43 -1.26 0.64 118.68 128.61 2k23 s LEU 58 Ca 0.11 2.41 0.01 0.00 -1.03 0.00 0.00 54.13 55.63 2k23 s LEU 58 Cb -0.16 -3.62 0.01 0.00 0.03 0.00 0.00 46.19 42.44 2k23 s LEU 58 CO 0.11 -0.39 0.09 1.67 0.23 0.00 0.00 176.35 178.06 2k23 n GLN 59 N 1.71 1.32 -0.16 1.70 -0.06 -1.01 -4.87 117.38 116.02 2k23 n GLN 59 Ca 0.02 -1.40 0.22 0.00 -2.00 0.00 0.00 57.00 53.84 2k23 n GLN 59 Cb 0.43 0.25 0.63 0.00 -4.06 0.00 0.00 30.24 27.49 2k23 n GLN 59 CO 0.00 0.00 0.00 1.05 -0.20 0.00 0.00 177.06 177.91 2k23 h GLU 60 N 0.00 0.17 -1.67 3.69 4.11 -1.96 -2.75 114.58 116.16 2k23 h GLU 60 Ca -0.15 -0.01 -0.46 0.00 0.07 0.00 0.00 59.36 58.81 2k23 h GLU 60 Cb 0.50 -0.04 -0.40 0.00 0.50 0.00 0.00 28.75 29.31 2k23 h GLU 60 CO 0.24 0.11 -1.11 -3.47 0.07 0.00 0.00 179.01 174.85 2k23 n ASP 61 N -4.39 1.67 -0.27 3.06 2.03 -1.26 -4.96 116.55 112.42 2k23 n ASP 61 Ca 0.16 -3.03 -0.03 0.00 0.52 0.00 0.00 54.79 52.42 2k23 n ASP 61 Cb 0.75 -0.57 -0.01 0.00 -0.72 0.00 0.00 41.12 40.57 2k23 n ASP 61 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2k23 n ASN 62 N 0.06 -3.72 -4.66 1.67 0.23 -1.04 -4.90 115.26 102.91 2k23 n ASN 62 Ca 0.21 0.06 -0.43 0.00 -0.53 0.00 0.00 54.58 53.90 2k23 n ASN 62 Cb 0.68 -2.56 -0.02 0.00 -2.08 0.00 0.00 39.78 35.80 2k23 n ASN 62 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2k23 s SER 63 N -1.43 6.88 -0.06 0.53 1.04 -1.26 -4.59 113.70 114.80 2k23 s SER 63 Ca 0.00 1.69 -0.22 0.00 0.48 0.00 0.00 55.95 57.91 2k23 s SER 63 Cb 0.00 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.54 2k23 s SER 63 CO 0.00 -0.82 0.63 -0.31 0.98 0.00 0.00 173.24 173.71 2k23 s TYR 64 N 3.68 3.59 -0.67 5.02 2.02 0.36 -2.40 117.35 128.96 2k23 s TYR 64 Ca 0.57 1.16 -0.19 0.00 -0.37 0.00 0.00 57.07 58.24 2k23 s TYR 64 Cb -0.22 -2.70 0.11 0.00 -0.40 0.00 0.00 41.96 38.75 2k23 s TYR 64 CO 0.17 0.18 0.81 -0.80 -1.57 0.00 0.00 175.55 174.34 2k23 s ASN 65 N 0.49 6.29 -0.16 2.29 -0.87 0.21 0.78 114.94 123.95 2k23 s ASN 65 Ca 0.33 -1.54 -0.19 0.00 -1.57 0.00 0.00 52.86 49.89 2k23 s ASN 65 Cb -0.17 -2.33 -0.03 0.00 -0.02 0.00 0.00 41.25 38.69 2k23 s ASN 65 CO 0.16 -1.12 0.53 -0.69 -2.57 0.00 0.00 177.10 173.41 2k23 s VAL 66 N 2.73 5.12 -0.66 1.60 1.01 0.20 -2.16 120.40 128.23 2k23 s VAL 66 Ca 0.17 1.02 -0.16 0.00 0.00 0.00 0.00 61.98 63.00 2k23 s VAL 66 Cb -0.19 -3.86 0.15 0.00 0.00 0.00 0.00 36.38 32.47 2k23 s VAL 66 CO 0.04 0.22 0.68 -0.89 0.00 0.00 0.00 175.10 175.14 2k23 s THR 67 N 1.29 5.17 -0.63 3.92 2.01 0.08 -0.28 115.64 127.21 2k23 s THR 67 Ca 0.26 -1.63 -0.16 0.00 0.31 0.00 0.00 61.69 60.48 2k23 s THR 67 Cb -0.16 -4.45 0.15 0.00 0.01 0.00 0.00 72.50 68.05 2k23 s THR 67 CO 0.10 -1.03 0.62 -0.55 -0.69 0.00 0.00 174.62 173.07 2k23 s SER 68 N 3.23 6.33 -0.10 3.53 0.15 0.28 -2.54 113.70 124.58 2k23 s SER 68 Ca 0.12 -1.94 -0.30 0.00 0.70 0.00 0.00 55.95 54.53 2k23 s SER 68 Cb -0.21 -2.23 -0.01 0.00 -1.71 0.00 0.00 66.02 61.85 2k23 s SER 68 CO -0.00 -0.85 1.04 -0.51 1.20 0.00 0.00 173.24 174.11 2k23 s ILE 69 N 1.51 4.70 0.01 6.45 2.07 -1.11 -0.05 121.20 134.79 2k23 s ILE 69 Ca 0.09 1.98 0.00 0.00 -1.41 0.00 0.00 60.65 61.31 2k23 s ILE 69 Cb -0.24 -4.27 -0.01 0.00 0.13 0.00 0.00 42.46 38.07 2k23 s ILE 69 CO 0.00 -0.00 -0.03 -1.48 -1.91 0.00 0.00 174.94 171.52 2k23 s LEU 70 N 2.10 2.15 -0.37 8.50 0.05 -0.28 -3.55 118.68 127.29 2k23 s LEU 70 Ca 0.49 -0.33 -0.29 0.00 0.05 0.00 0.00 54.13 54.06 2k23 s LEU 70 Cb -0.19 0.03 0.01 0.00 -2.05 0.00 0.00 46.19 43.99 2k23 s LEU 70 CO 0.18 -0.18 1.31 -0.69 -0.55 0.00 0.00 176.35 176.42 2k23 s VAL 71 N -0.93 4.07 -1.06 1.48 1.01 -1.26 -2.58 120.40 121.13 2k23 s VAL 71 Ca -0.10 1.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.92 2k23 s VAL 71 Cb -0.06 -4.24 0.24 0.00 0.00 0.00 0.00 36.38 32.31 2k23 s VAL 71 CO -0.01 -0.66 1.10 -0.13 0.00 0.00 0.00 175.10 175.40 2k23 s ARG 72 N 4.49 4.04 5.42 2.72 1.81 -0.47 -4.89 118.95 132.06 2k23 s ARG 72 Ca 0.57 -2.89 0.00 0.00 -1.72 0.00 0.00 55.73 51.69 2k23 s ARG 72 Cb -0.14 -4.63 0.00 0.00 -0.45 0.00 0.00 34.95 29.73 2k23 s ARG 72 CO 0.28 -1.37 0.00 0.41 -0.68 0.00 0.00 175.30 173.94 2k23 n GLY 73 N 3.33 1.69 2.49 -3.53 0.00 -1.26 -3.82 105.19 104.10 2k23 n GLY 73 Ca 0.24 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 2k23 n GLY 73 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k23 n GLN 74 N 3.56 3.23 -3.79 1.61 1.13 -1.26 -5.00 117.38 116.87 2k23 n GLN 74 Ca 0.00 -4.10 -0.04 0.00 -1.94 0.00 0.00 57.00 50.92 2k23 n GLN 74 Cb 0.00 -2.26 -0.01 0.00 0.11 0.00 0.00 30.24 28.08 2k23 n GLN 74 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2k23 s GLY 75 N -2.80 -0.12 -0.14 1.08 0.00 -1.25 -5.16 107.32 98.93 2k23 s GLY 75 Ca 0.51 -0.04 -0.02 0.00 0.00 0.00 0.00 44.72 45.17 2k23 s GLY 75 CO -0.19 0.41 -0.08 0.00 0.00 0.00 0.00 173.10 173.24 2k23 s ARG 77 N 0.28 0.13 -0.24 0.00 6.06 -1.06 -4.91 118.95 119.21 2k23 s ARG 77 Ca -0.06 0.10 -0.23 0.00 -2.50 0.00 0.00 55.73 53.05 2k23 s ARG 77 Cb -0.15 0.06 -0.01 0.00 0.06 0.00 0.00 34.95 34.91 2k23 s ARG 77 CO 0.04 -0.02 0.75 0.71 -2.50 0.00 0.00 175.30 174.28 2k23 s TYR 78 N -0.02 3.31 -0.44 5.12 2.02 -1.26 -1.12 117.35 124.96 2k23 s TYR 78 Ca -0.01 1.03 -0.12 0.00 -0.37 0.00 0.00 57.07 57.59 2k23 s TYR 78 Cb -0.01 -2.96 0.07 0.00 -0.40 0.00 0.00 41.96 38.65 2k23 s TYR 78 CO 0.00 -0.35 0.32 -0.46 -1.57 0.00 0.00 175.55 173.49 2k23 s TRP 79 N 2.63 3.28 -0.23 2.71 -0.11 0.93 -4.87 118.94 123.28 2k23 s TRP 79 Ca 0.32 -1.16 -0.12 0.00 1.22 0.00 0.00 56.10 56.36 2k23 s TRP 79 Cb -0.15 -2.99 -0.05 0.00 -1.50 0.00 0.00 33.47 28.78 2k23 s TRP 79 CO 0.08 -0.80 0.22 0.42 -4.62 0.00 0.00 176.95 172.25 2k23 s ILE 80 N 1.55 5.33 0.08 5.86 1.09 -1.26 -0.56 121.20 133.29 2k23 s ILE 80 Ca 0.03 0.31 0.02 0.00 -1.10 0.00 0.00 60.65 59.91 2k23 s ILE 80 Cb -0.23 -3.55 -0.04 0.00 -1.06 0.00 0.00 42.46 37.58 2k23 s ILE 80 CO 0.05 0.33 -0.07 0.00 -0.10 0.00 0.00 174.94 175.15 2k23 s ARG 81 N 1.04 0.75 -0.06 2.79 1.70 0.61 -4.89 118.95 120.89 2k23 s ARG 81 Ca 0.10 -1.17 -0.18 0.00 -0.47 0.00 0.00 55.73 54.01 2k23 s ARG 81 Cb -0.14 -0.24 -0.05 0.00 -0.57 0.00 0.00 34.95 33.96 2k23 s ARG 81 CO 0.05 0.00 0.50 0.99 -1.08 0.00 0.00 175.30 175.76 2k23 s THR 82 N -2.98 5.07 0.14 4.99 2.01 -1.25 0.61 115.64 124.23 2k23 s THR 82 Ca 0.06 1.02 0.06 0.00 0.31 0.00 0.00 61.69 63.13 2k23 s THR 82 Cb 0.01 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 2k23 s THR 82 CO -0.03 0.40 0.03 -0.36 -0.69 0.00 0.00 174.62 173.97 2k23 s PHE 83 N 0.04 2.97 0.03 4.92 0.08 0.23 0.10 117.98 126.35 2k23 s PHE 83 Ca 0.27 -0.07 -0.18 0.00 0.12 0.00 0.00 56.93 57.07 2k23 s PHE 83 Cb -0.16 -1.47 0.03 0.00 -0.57 0.00 0.00 43.02 40.85 2k23 s PHE 83 CO 0.13 0.50 0.40 0.14 -0.10 0.00 0.00 175.22 176.29 2k23 s VAL 84 N -1.57 0.06 0.29 -0.44 -7.23 0.88 0.14 120.40 112.53 2k23 s VAL 84 Ca 0.27 -0.47 -0.30 0.00 -1.81 0.00 0.00 61.98 59.68 2k23 s VAL 84 Cb -0.10 -0.91 -0.11 0.00 0.56 0.00 0.00 36.38 35.83 2k23 s VAL 84 CO 0.19 -0.26 1.47 -2.16 -0.31 0.00 0.00 175.10 174.04 2k23 s PRO 85 N -2.26 4.21 0.00 4.82 0.04 -1.26 0.00 135.00 140.55 2k23 s PRO 85 Ca -0.07 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.38 2k23 s PRO 85 Cb -0.01 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.47 2k23 s PRO 85 CO -0.01 -0.47 0.00 0.45 0.04 0.00 0.00 177.00 177.01 2k23 n SER 86 N 1.83 0.00 0.11 6.66 2.88 0.95 -4.65 113.62 121.39 2k23 n SER 86 Ca 0.05 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.70 2k23 n SER 86 Cb 0.39 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 64.31 2k23 n SER 86 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2k23 n SER 87 N 0.00 0.53 -3.56 -3.46 7.64 -1.26 -4.74 113.62 108.77 2k23 n SER 87 Ca 0.00 0.64 -0.17 0.00 1.01 0.00 0.00 58.87 60.35 2k23 n SER 87 Cb 0.00 -0.75 -0.06 0.00 -1.01 0.00 0.00 64.21 62.39 2k23 n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k23 s ARG 88 N -3.27 0.99 0.20 1.43 3.03 -1.26 -5.11 118.95 114.97 2k23 s ARG 88 Ca 0.04 0.23 -0.33 0.00 2.03 0.00 0.00 55.73 57.71 2k23 s ARG 88 Cb 0.09 0.47 -0.13 0.00 -1.03 0.00 0.00 34.95 34.34 2k23 s ARG 88 CO 0.35 -0.30 1.57 -2.30 -1.13 0.00 0.00 175.30 173.49 2k23 n PRO 89 N 1.06 2.29 0.00 3.89 -0.02 -1.26 -1.72 135.00 139.23 2k23 n PRO 89 Ca -0.19 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2k23 n PRO 89 Cb 0.57 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 2k23 n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k23 n GLY 90 N 3.08 3.11 3.66 -1.23 0.00 -1.26 -4.80 105.19 107.74 2k23 n GLY 90 Ca 0.15 -0.94 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 2k23 n GLY 90 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k23 s GLN 91 N 0.00 4.23 0.06 1.61 0.74 -0.70 -3.36 119.66 122.24 2k23 s GLN 91 Ca 0.00 1.27 0.08 0.00 0.05 0.00 0.00 55.36 56.77 2k23 s GLN 91 Cb 0.00 -3.65 -0.03 0.00 1.10 0.00 0.00 33.01 30.43 2k23 s GLN 91 CO 0.00 -0.64 -0.21 -0.06 -0.55 0.00 0.00 175.29 173.83 2k23 s PHE 92 N 3.19 2.47 0.45 1.67 0.08 0.25 -0.03 117.98 126.06 2k23 s PHE 92 Ca 0.43 -0.31 0.03 0.00 0.12 0.00 0.00 56.93 57.19 2k23 s PHE 92 Cb -0.15 -1.42 -0.02 0.00 -0.57 0.00 0.00 43.02 40.86 2k23 s PHE 92 CO 0.07 0.23 0.06 0.95 -0.10 0.00 0.00 175.22 176.44 2k23 s THR 93 N -0.92 0.93 0.00 0.64 -4.23 0.10 0.19 115.64 112.36 2k23 s THR 93 Ca 0.14 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.54 2k23 s THR 93 Cb -0.10 -2.30 -0.05 0.00 1.34 0.00 0.00 72.50 71.38 2k23 s THR 93 CO 0.05 0.00 0.35 -0.76 -0.54 0.00 0.00 174.62 173.72 2k23 s LEU 94 N -3.73 4.42 0.63 4.79 2.01 -1.26 -0.08 118.68 125.45 2k23 s LEU 94 Ca 0.16 0.80 0.31 0.00 0.01 0.00 0.00 54.13 55.41 2k23 s LEU 94 Cb 0.03 -2.62 1.71 0.00 0.01 0.00 0.00 46.19 45.31 2k23 s LEU 94 CO 0.09 0.29 2.02 1.23 1.01 0.00 0.00 176.35 180.99 2k23 h GLY 95 N 4.40 0.00 -3.06 -3.19 0.00 0.49 -0.57 103.07 101.13 2k23 h GLY 95 Ca -0.51 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 46.64 2k23 h GLY 95 CO 0.63 0.00 -0.94 1.16 0.00 0.00 0.00 176.54 177.39 2k23 n ASN 96 N -3.30 1.44 -0.05 0.19 6.94 -1.26 -4.90 115.26 114.32 2k23 n ASN 96 Ca 0.01 -2.46 0.01 0.00 -0.02 0.00 0.00 54.58 52.11 2k23 n ASN 96 Cb 0.38 -0.38 0.31 0.00 -2.36 0.00 0.00 39.78 37.73 2k23 n ASN 96 CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 2k23 h ILE 97 N 5.37 1.18 -0.10 1.53 6.09 -1.42 -1.41 117.51 128.74 2k23 h ILE 97 Ca -0.14 -0.57 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 2k23 h ILE 97 Cb 1.60 0.66 0.00 0.00 0.47 0.00 0.00 36.82 39.55 2k23 h ILE 97 CO 0.13 0.22 0.00 1.57 -3.07 0.00 0.00 178.15 177.00 2k23 n HIS 98 N -4.35 0.12 1.02 2.19 -0.00 -1.26 -1.76 115.22 111.18 2k23 n HIS 98 Ca 0.03 -0.06 0.12 0.00 0.46 0.00 0.00 57.72 58.27 2k23 n HIS 98 Cb 0.16 0.00 0.34 0.00 -0.12 0.00 0.00 29.99 30.37 2k23 n HIS 98 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2k23 n SER 99 N -0.21 0.42 -4.70 0.26 2.88 -0.53 -4.79 113.62 106.95 2k23 n SER 99 Ca 0.13 -0.13 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 2k23 n SER 99 Cb 0.18 0.09 -0.04 0.00 -0.75 0.00 0.00 64.21 63.69 2k23 n SER 99 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2k23 s TYR 100 N -2.97 3.54 0.07 0.66 2.02 -0.72 -4.99 117.35 114.96 2k23 s TYR 100 Ca 0.12 1.34 -0.15 0.00 -0.37 0.00 0.00 57.07 58.01 2k23 s TYR 100 Cb 0.18 -2.94 -0.17 0.00 -0.40 0.00 0.00 41.96 38.63 2k23 s TYR 100 CO 0.65 -0.05 1.26 -1.00 -1.57 0.00 0.00 175.55 174.85 2k23 h PRO 101 N 6.97 0.68 0.00 -1.71 0.13 -1.87 -3.29 132.00 132.91 2k23 h PRO 101 Ca -0.37 -0.56 -0.01 0.00 -0.87 0.00 0.00 66.00 64.19 2k23 h PRO 101 Cb 1.18 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 2k23 h PRO 101 CO 0.78 1.18 -0.92 0.37 -0.23 0.00 0.00 178.00 179.18 2k23 h GLN 102 N 0.35 0.00 -6.26 0.86 4.15 -1.94 -3.46 115.11 108.82 2k23 h GLN 102 Ca -0.05 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.82 2k23 h GLN 102 Cb 1.31 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.99 2k23 h GLN 102 CO 0.14 0.02 1.16 0.42 -1.93 0.00 0.00 178.83 178.64 2k23 s ILE 103 N -3.32 3.49 -0.05 2.39 1.09 -1.24 -2.02 121.20 121.55 2k23 s ILE 103 Ca 0.00 0.58 -0.26 0.00 -1.10 0.00 0.00 60.65 59.87 2k23 s ILE 103 Cb 0.09 -3.44 -0.21 0.00 -1.06 0.00 0.00 42.46 37.83 2k23 s ILE 103 CO 0.78 -0.13 1.14 1.56 -0.10 0.00 0.00 174.94 178.19 2k23 h GLN 104 N 10.60 0.05 -2.89 2.79 1.08 -0.39 -3.47 115.11 122.87 2k23 h GLN 104 Ca -0.39 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 2k23 h GLN 104 Cb 1.18 0.01 -0.12 0.00 -0.05 0.00 0.00 27.48 28.50 2k23 h GLN 104 CO 0.97 0.68 0.25 -1.12 -0.95 0.00 0.00 178.83 178.66 2k23 s SER 105 N -5.92 -0.53 -0.22 1.46 0.01 -1.24 -5.00 113.70 102.26 2k23 s SER 105 Ca -0.16 -0.02 -0.04 0.00 1.31 0.00 0.00 55.95 57.04 2k23 s SER 105 Cb 0.01 0.57 0.11 0.00 0.21 0.00 0.00 66.02 66.92 2k23 s SER 105 CO 0.69 -0.93 0.28 -0.47 0.41 0.00 0.00 173.24 173.22 2k23 s TYR 106 N -3.66 -0.48 -0.11 2.43 6.14 -1.26 -0.96 117.35 119.45 2k23 s TYR 106 Ca 0.02 0.45 -0.00 0.00 0.64 0.00 0.00 57.07 58.18 2k23 s TYR 106 Cb -0.01 -0.22 0.02 0.00 0.42 0.00 0.00 41.96 42.18 2k23 s TYR 106 CO -0.12 -0.65 -0.08 -0.51 0.64 0.00 0.00 175.55 174.84 2k23 s ASP 107 N 2.41 2.19 -0.19 4.32 1.01 -0.55 -4.07 116.67 121.79 2k23 s ASP 107 Ca 0.09 -0.31 0.01 0.00 0.71 0.00 0.00 52.55 53.05 2k23 s ASP 107 Cb -0.16 -0.84 0.02 0.00 1.01 0.00 0.00 42.92 42.95 2k23 s ASP 107 CO -0.13 -0.12 -0.17 0.54 0.21 0.00 0.00 175.17 175.49 2k23 s VAL 108 N 1.71 2.21 -0.05 -1.27 0.11 0.13 0.10 120.40 123.34 2k23 s VAL 108 Ca 0.05 -0.95 -0.00 0.00 -2.93 0.00 0.00 61.98 58.15 2k23 s VAL 108 Cb -0.13 -1.97 0.03 0.00 -1.53 0.00 0.00 36.38 32.78 2k23 s VAL 108 CO -0.08 0.48 -0.00 0.00 -3.33 0.00 0.00 175.10 172.16 2k23 s GLN 109 N 1.30 0.46 -0.10 1.54 0.00 0.07 0.87 119.66 123.80 2k23 s GLN 109 Ca 0.04 0.08 -0.26 0.00 -0.00 0.00 0.00 55.36 55.22 2k23 s GLN 109 Cb -0.14 -0.70 -0.03 0.00 0.00 0.00 0.00 33.01 32.15 2k23 s GLN 109 CO -0.11 -0.19 0.82 0.54 0.00 0.00 0.00 175.29 176.34 2k23 s VAL 110 N 1.38 4.94 0.08 3.63 0.11 -1.21 -1.64 120.40 127.68 2k23 s VAL 110 Ca -0.04 1.65 0.01 0.00 -2.93 0.00 0.00 61.98 60.66 2k23 s VAL 110 Cb -0.13 -4.14 -0.25 0.00 -1.53 0.00 0.00 36.38 30.32 2k23 s VAL 110 CO -0.02 0.13 1.14 0.00 -3.33 0.00 0.00 175.10 173.02 2k23 h ALA 111 N 7.02 0.24 -2.45 1.54 0.00 -0.62 -2.97 119.26 122.02 2k23 h ALA 111 Ca -0.36 -0.94 -0.30 0.00 0.00 0.00 0.00 54.91 53.31 2k23 h ALA 111 Cb 1.17 -0.00 -0.35 0.00 0.00 0.00 0.00 17.79 18.61 2k23 h ALA 111 CO 0.79 1.12 -0.61 0.34 0.00 0.00 0.00 179.25 180.89 2k23 s ASP 112 N -6.93 1.26 -0.01 0.00 -1.08 -1.12 -4.34 116.67 104.47 2k23 s ASP 112 Ca -0.03 -0.19 0.01 0.00 -0.52 0.00 0.00 52.55 51.83 2k23 s ASP 112 Cb 0.08 0.46 -0.00 0.00 -1.46 0.00 0.00 42.92 42.00 2k23 s ASP 112 CO 0.85 -0.33 -0.04 0.28 0.52 0.00 0.00 175.17 176.46 2k23 s THR 113 N 2.35 0.30 0.26 1.71 -1.32 -1.26 -0.32 115.64 117.37 2k23 s THR 113 Ca 0.08 -0.15 0.02 0.00 -1.21 0.00 0.00 61.69 60.43 2k23 s THR 113 Cb -0.16 -0.27 -0.03 0.00 -1.51 0.00 0.00 72.50 70.53 2k23 s THR 113 CO -0.13 0.09 0.22 -1.81 -2.21 0.00 0.00 174.62 170.78 2k23 s ASP 114 N -0.00 0.86 -0.05 8.08 1.01 -1.26 -5.03 116.67 120.28 2k23 s ASP 114 Ca 0.00 -1.55 -0.26 0.00 0.71 0.00 0.00 52.55 51.45 2k23 s ASP 114 Cb -0.03 0.47 -0.22 0.00 1.01 0.00 0.00 42.92 44.16 2k23 s ASP 114 CO -0.00 -0.96 1.10 1.88 0.21 0.00 0.00 175.17 177.40 2k23 h TYR 115 N 2.38 0.07 0.00 4.23 -1.99 -1.97 -3.38 116.97 116.31 2k23 h TYR 115 Ca -0.31 -0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.32 2k23 h TYR 115 Cb 1.24 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.95 2k23 h TYR 115 CO 1.00 0.72 -1.66 -0.40 -0.00 0.00 0.00 178.16 177.82 2k23 n ASP 116 N -4.71 2.09 -3.79 3.88 5.75 -1.26 -4.76 116.55 113.75 2k23 n ASP 116 Ca -0.09 0.00 -0.30 0.00 -0.01 0.00 0.00 54.79 54.39 2k23 n ASP 116 Cb 0.36 1.31 0.24 0.00 -1.03 0.00 0.00 41.12 42.00 2k23 n ASP 116 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2k23 s GLN 117 N -2.68 -1.18 0.11 0.11 0.74 -1.26 -4.56 119.66 110.94 2k23 s GLN 117 Ca -0.05 -0.12 -0.02 0.00 0.05 0.00 0.00 55.36 55.23 2k23 s GLN 117 Cb 0.07 -1.61 -0.05 0.00 1.10 0.00 0.00 33.01 32.52 2k23 s GLN 117 CO 0.51 -3.67 0.29 -0.59 -0.55 0.00 0.00 175.29 171.28 2k23 s PHE 118 N -3.07 3.50 0.18 1.67 -0.71 -1.26 -4.26 117.98 114.04 2k23 s PHE 118 Ca 0.71 0.37 0.11 0.00 -1.04 0.00 0.00 56.93 57.09 2k23 s PHE 118 Cb -0.09 -1.86 -0.04 0.00 -1.21 0.00 0.00 43.02 39.82 2k23 s PHE 118 CO 0.56 0.51 -0.24 0.00 -1.34 0.00 0.00 175.22 174.71 2k23 s ALA 119 N -1.61 2.53 -0.09 1.99 0.00 0.17 -4.34 121.76 120.42 2k23 s ALA 119 Ca 0.38 -1.61 -0.01 0.00 0.00 0.00 0.00 51.96 50.71 2k23 s ALA 119 Cb -0.12 -0.35 0.03 0.00 0.00 0.00 0.00 23.12 22.67 2k23 s ALA 119 CO 0.27 0.45 -0.01 1.41 0.00 0.00 0.00 175.76 177.87 2k23 s MET 120 N -2.60 0.82 0.17 0.00 1.75 0.57 0.31 119.30 120.32 2k23 s MET 120 Ca 0.20 -0.01 0.09 0.00 -1.25 0.00 0.00 55.69 54.72 2k23 s MET 120 Cb -0.08 -1.19 -0.04 0.00 2.84 0.00 0.00 34.83 36.36 2k23 s MET 120 CO 0.10 -0.32 -0.19 0.08 -0.65 0.00 0.00 175.02 174.04 2k23 s VAL 121 N 1.90 1.90 -0.23 10.11 1.01 -0.87 -0.19 120.40 134.05 2k23 s VAL 121 Ca 0.05 -1.92 -0.02 0.00 0.00 0.00 0.00 61.98 60.08 2k23 s VAL 121 Cb -0.13 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.39 2k23 s VAL 121 CO -0.06 -0.27 -0.07 0.12 0.00 0.00 0.00 175.10 174.81 2k23 s PHE 122 N -1.95 2.99 -0.23 5.22 2.19 -0.65 0.43 117.98 125.97 2k23 s PHE 122 Ca 0.16 -1.34 -0.09 0.00 0.33 0.00 0.00 56.93 55.99 2k23 s PHE 122 Cb -0.06 -2.06 -0.05 0.00 -1.31 0.00 0.00 43.02 39.54 2k23 s PHE 122 CO 0.07 -0.67 0.13 -0.06 1.83 0.00 0.00 175.22 176.51 2k23 s PHE 123 N 1.38 3.27 -0.19 10.12 0.40 0.16 -0.75 117.98 132.37 2k23 s PHE 123 Ca 0.03 0.10 -0.02 0.00 -0.60 0.00 0.00 56.93 56.44 2k23 s PHE 123 Cb -0.15 -2.23 -0.01 0.00 0.51 0.00 0.00 43.02 41.15 2k23 s PHE 123 CO -0.05 0.02 -0.09 -1.14 0.70 0.00 0.00 175.22 174.66 2k23 s GLN 124 N 1.00 3.32 -0.19 0.44 0.74 0.11 -1.03 119.66 124.05 2k23 s GLN 124 Ca 0.06 -0.67 0.01 0.00 0.05 0.00 0.00 55.36 54.81 2k23 s GLN 124 Cb -0.14 -2.83 0.02 0.00 1.10 0.00 0.00 33.01 31.16 2k23 s GLN 124 CO 0.04 -0.08 -0.18 0.21 -0.55 0.00 0.00 175.29 174.73 2k23 s LYS 125 N 1.12 2.94 -0.07 1.67 2.20 0.19 -1.48 119.74 126.31 2k23 s LYS 125 Ca 0.01 -0.87 0.02 0.00 -0.36 0.00 0.00 55.97 54.77 2k23 s LYS 125 Cb -0.14 -2.64 -0.02 0.00 -1.51 0.00 0.00 37.83 33.51 2k23 s LYS 125 CO -0.02 -0.25 -0.13 0.99 -0.36 0.00 0.00 175.35 175.58 2k23 s THR 126 N 1.29 3.18 -0.26 3.43 2.01 -0.13 0.12 115.64 125.29 2k23 s THR 126 Ca 0.04 -0.66 -0.08 0.00 0.31 0.00 0.00 61.69 61.30 2k23 s THR 126 Cb -0.14 -2.28 0.12 0.00 0.01 0.00 0.00 72.50 70.21 2k23 s THR 126 CO -0.11 0.57 0.54 -0.94 -0.69 0.00 0.00 174.62 173.99 2k23 s SER 127 N -0.45 -0.74 -1.29 3.53 1.04 0.73 0.40 113.70 116.91 2k23 s SER 127 Ca 0.06 1.26 -0.00 0.00 0.48 0.00 0.00 55.95 57.75 2k23 s SER 127 Cb -0.12 1.87 0.00 0.00 0.10 0.00 0.00 66.02 67.87 2k23 s SER 127 CO 0.02 -0.23 0.78 1.21 0.98 0.00 0.00 173.24 176.00 2k23 n GLU 128 N 5.42 -5.35 0.00 4.02 2.13 -0.86 -1.24 120.64 124.77 2k23 n GLU 128 Ca -0.10 0.68 0.00 0.00 0.66 0.00 0.00 57.16 58.40 2k23 n GLU 128 Cb 0.49 -5.35 0.00 0.00 0.27 0.00 0.00 31.44 26.85 2k23 n GLU 128 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2k23 n ASN 129 N -3.07 0.00 -4.63 4.31 5.15 -1.26 -4.92 115.26 110.84 2k23 n ASN 129 Ca -0.29 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.26 2k23 n ASN 129 Cb 0.67 -0.41 -0.02 0.00 -0.53 0.00 0.00 39.78 39.49 2k23 n ASN 129 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2k23 s LYS 130 N 0.00 3.92 -0.23 1.20 1.02 -0.37 -4.99 119.74 120.29 2k23 s LYS 130 Ca 0.00 1.24 -0.10 0.00 0.02 0.00 0.00 55.97 57.13 2k23 s LYS 130 Cb 0.00 -3.87 -0.05 0.00 -0.52 0.00 0.00 37.83 33.39 2k23 s LYS 130 CO 0.00 -1.12 0.14 -0.65 -0.92 0.00 0.00 175.35 172.81 2k23 s GLN 131 N 4.15 4.04 -0.04 1.68 -0.21 -1.26 -0.19 119.66 127.83 2k23 s GLN 131 Ca 0.56 -0.29 0.05 0.00 0.02 0.00 0.00 55.36 55.70 2k23 s GLN 131 Cb -0.16 -3.49 -0.02 0.00 1.00 0.00 0.00 33.01 30.33 2k23 s GLN 131 CO 0.23 0.07 -0.18 0.71 -2.12 0.00 0.00 175.29 174.00 2k23 s TYR 132 N 1.00 2.58 0.02 0.91 1.51 0.33 -4.41 117.35 119.29 2k23 s TYR 132 Ca 0.07 -0.28 -0.02 0.00 -1.01 0.00 0.00 57.07 55.84 2k23 s TYR 132 Cb -0.13 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.11 2k23 s TYR 132 CO 0.04 0.09 0.01 -0.06 -1.11 0.00 0.00 175.55 174.52 2k23 s PHE 133 N -0.65 0.21 -0.14 2.71 0.40 -1.26 0.53 117.98 119.78 2k23 s PHE 133 Ca 0.10 -0.43 -0.13 0.00 -0.60 0.00 0.00 56.93 55.86 2k23 s PHE 133 Cb -0.11 -0.16 0.04 0.00 0.51 0.00 0.00 43.02 43.30 2k23 s PHE 133 CO 0.00 -0.21 0.38 -1.59 0.70 0.00 0.00 175.22 174.50 2k23 s LYS 134 N -1.43 0.45 -0.23 0.44 -2.85 -0.20 -1.97 119.74 113.94 2k23 s LYS 134 Ca -0.16 0.51 -0.06 0.00 -1.00 0.00 0.00 55.97 55.26 2k23 s LYS 134 Cb -0.09 0.22 -0.02 0.00 -2.06 0.00 0.00 37.83 35.87 2k23 s LYS 134 CO -0.00 -0.06 0.02 0.08 0.10 0.00 0.00 175.35 175.49 2k23 s VAL 135 N 0.16 3.97 0.29 1.79 1.01 0.15 0.38 120.40 128.15 2k23 s VAL 135 Ca -0.00 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 61.75 2k23 s VAL 135 Cb -0.03 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 2k23 s VAL 135 CO 0.01 0.38 0.36 0.42 0.00 0.00 0.00 175.10 176.27 2k23 s THR 136 N 1.45 4.43 -0.24 3.92 -4.23 0.17 0.62 115.64 121.76 2k23 s THR 136 Ca 0.05 -1.12 0.02 0.00 -1.18 0.00 0.00 61.69 59.46 2k23 s THR 136 Cb -0.15 -3.52 0.06 0.00 1.34 0.00 0.00 72.50 70.23 2k23 s THR 136 CO 0.01 -0.25 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.54 2k23 s LEU 137 N -4.03 2.87 0.06 4.79 1.98 0.27 -2.04 118.68 122.58 2k23 s LEU 137 Ca 0.39 -1.20 0.03 0.00 -2.89 0.00 0.00 54.13 50.46 2k23 s LEU 137 Cb -0.08 -1.35 -0.04 0.00 0.66 0.00 0.00 46.19 45.37 2k23 s LEU 137 CO 0.29 -0.19 0.02 -0.31 -1.89 0.00 0.00 176.35 174.26 2k23 s TYR 138 N 1.27 3.07 0.04 5.38 2.02 0.15 0.18 117.35 129.45 2k23 s TYR 138 Ca -0.06 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.68 2k23 s TYR 138 Cb -0.19 -1.60 -0.03 0.00 -0.40 0.00 0.00 41.96 39.74 2k23 s TYR 138 CO -0.06 0.48 -0.05 0.20 -1.57 0.00 0.00 175.55 174.55 2k23 s GLY 139 N -2.07 0.43 0.00 0.71 0.00 0.52 0.43 107.32 107.34 2k23 s GLY 139 Ca 0.24 -0.85 0.20 0.00 0.00 0.00 0.00 44.72 44.31 2k23 s GLY 139 CO 0.16 -0.93 1.64 -2.13 0.00 0.00 0.00 173.10 171.84 2k23 n ARG 140 N 1.07 0.05 -3.85 2.90 0.00 -1.26 -0.62 116.66 114.95 2k23 n ARG 140 Ca -0.20 0.15 -0.09 0.00 -0.00 0.00 0.00 57.85 57.71 2k23 n ARG 140 Cb 0.57 -1.50 0.01 0.00 0.00 0.00 0.00 32.46 31.53 2k23 n ARG 140 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 2k23 s THR 141 N -2.92 0.00 -0.90 5.15 -1.32 -1.26 -4.86 115.64 109.53 2k23 s THR 141 Ca 0.11 -1.07 0.00 0.00 -1.21 0.00 0.00 61.69 59.52 2k23 s THR 141 Cb 0.13 -2.64 0.00 0.00 -1.51 0.00 0.00 72.50 68.48 2k23 s THR 141 CO 0.35 0.00 0.51 0.29 -2.21 0.00 0.00 174.62 173.56 2k23 n LYS 142 N -0.51 0.93 -3.43 7.08 4.76 -1.26 -4.40 118.16 121.33 2k23 n LYS 142 Ca -0.06 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.11 2k23 n LYS 142 Cb 0.60 -1.42 -0.09 0.00 -1.84 0.00 0.00 35.03 32.28 2k23 n LYS 142 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k23 n GLY 143 N 0.08 3.22 3.38 0.72 0.00 -1.26 -5.07 105.19 106.26 2k23 n GLY 143 Ca 0.00 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.79 2k23 n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k23 s LEU 144 N -1.10 2.61 0.70 0.99 1.43 -1.26 -5.02 118.68 117.03 2k23 s LEU 144 Ca 0.33 -0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 2k23 s LEU 144 Cb 0.09 -1.56 0.02 0.00 0.03 0.00 0.00 46.19 44.77 2k23 s LEU 144 CO -0.13 0.22 1.17 -0.44 0.23 0.00 0.00 176.35 177.40 2k23 s SER 145 N 0.03 4.54 0.52 2.29 0.01 -1.26 -4.90 113.70 114.92 2k23 s SER 145 Ca -0.05 2.23 0.27 0.00 1.31 0.00 0.00 55.95 59.70 2k23 s SER 145 Cb -0.15 -2.58 1.41 0.00 0.21 0.00 0.00 66.02 64.92 2k23 s SER 145 CO 0.05 -2.03 2.06 -0.78 0.41 0.00 0.00 173.24 172.95 2k23 h ASP 146 N -0.16 0.00 -0.25 2.44 3.58 -1.99 -2.62 116.42 117.42 2k23 h ASP 146 Ca -0.47 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.02 2k23 h ASP 146 Cb 1.28 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.29 2k23 h ASP 146 CO 0.51 0.12 -0.02 -0.08 -2.88 0.00 0.00 179.24 176.90 2k23 h GLU 147 N 0.00 0.06 0.00 0.28 4.57 -1.99 0.16 114.58 117.66 2k23 h GLU 147 Ca -0.00 -0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.06 2k23 h GLU 147 Cb 0.35 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 2k23 h GLU 147 CO 0.02 0.04 -0.57 1.37 -1.18 0.00 0.00 179.01 178.68 2k23 h LEU 148 N 0.06 0.00 -0.13 1.64 8.10 -1.84 -1.98 115.31 121.16 2k23 h LEU 148 Ca 0.12 0.00 -0.14 0.00 0.11 0.00 0.00 57.88 57.97 2k23 h LEU 148 Cb 0.17 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.39 2k23 h LEU 148 CO -0.22 0.57 -0.47 0.11 -4.11 0.00 0.00 178.44 174.32 2k23 h LYS 149 N 0.00 0.55 -0.38 0.17 1.57 -1.39 -2.17 116.57 114.91 2k23 h LYS 149 Ca -0.01 -0.42 0.02 0.00 -1.87 0.00 0.00 60.65 58.38 2k23 h LYS 149 Cb 1.02 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 2k23 h LYS 149 CO 0.07 1.04 0.25 1.49 -0.57 0.00 0.00 179.45 181.74 2k23 h GLU 150 N 0.17 0.41 -0.11 3.15 4.22 -0.54 0.71 114.58 122.58 2k23 h GLU 150 Ca -0.02 -0.02 -0.10 0.00 0.08 0.00 0.00 59.36 59.29 2k23 h GLU 150 Cb 1.10 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 2k23 h GLU 150 CO 0.10 0.27 -0.39 0.00 -2.18 0.00 0.00 179.01 176.81 2k23 h ARG 151 N 0.42 0.24 -0.47 1.92 3.08 -1.15 -2.51 114.38 115.90 2k23 h ARG 151 Ca 0.15 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 59.97 2k23 h ARG 151 Cb 0.09 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2k23 h ARG 151 CO -0.03 0.59 -0.18 0.27 -1.07 0.00 0.00 179.97 179.55 2k23 h PHE 152 N 0.20 1.09 -0.37 3.04 -5.15 -0.23 -1.74 116.94 113.79 2k23 h PHE 152 Ca 0.02 -0.26 -0.04 0.00 -0.20 0.00 0.00 57.97 57.49 2k23 h PHE 152 Cb 0.78 -0.26 -0.02 0.00 0.22 0.00 0.00 35.95 36.67 2k23 h PHE 152 CO 0.01 1.06 0.05 -0.39 -2.00 0.00 0.00 178.31 177.04 2k23 h VAL 153 N 0.81 1.19 -0.64 0.88 -1.51 -1.26 0.30 116.25 116.01 2k23 h VAL 153 Ca 0.11 -0.71 -0.02 0.00 -1.23 0.00 0.00 66.70 64.85 2k23 h VAL 153 Cb 0.75 0.86 -0.03 0.00 -2.13 0.00 0.00 31.29 30.74 2k23 h VAL 153 CO 0.06 0.25 0.32 -1.28 -1.23 0.00 0.00 177.57 175.69 2k23 h SER 154 N 0.54 0.83 0.18 4.19 0.87 -1.10 -2.03 113.55 117.03 2k23 h SER 154 Ca 0.12 -0.12 -0.11 0.00 -1.23 0.00 0.00 61.79 60.44 2k23 h SER 154 Cb 0.28 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 2k23 h SER 154 CO 0.00 0.72 -0.40 0.15 -0.53 0.00 0.00 176.83 176.77 2k23 h PHE 155 N 0.88 0.36 -0.90 2.24 3.57 -0.37 -2.65 116.94 120.07 2k23 h PHE 155 Ca 0.22 -0.10 0.10 0.00 3.53 0.00 0.00 57.97 61.73 2k23 h PHE 155 Cb 0.10 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.70 2k23 h PHE 155 CO 0.00 0.67 0.58 0.00 -2.23 0.00 0.00 178.31 177.32 2k23 h ALA 156 N 1.32 1.66 0.00 2.41 0.00 0.24 -0.08 119.26 124.81 2k23 h ALA 156 Ca 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2k23 h ALA 156 Cb 0.83 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2k23 h ALA 156 CO 0.07 0.15 -0.27 0.87 0.00 0.00 0.00 179.25 180.06 2k23 h LYS 157 N 0.86 0.00 0.00 0.00 1.79 -1.07 -3.00 116.57 115.15 2k23 h LYS 157 Ca 0.42 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.88 2k23 h LYS 157 Cb 0.46 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.10 2k23 h LYS 157 CO -0.19 0.27 -0.05 1.03 -1.08 0.00 0.00 179.45 179.44 2k23 h SER 158 N 0.00 0.00 -0.19 0.86 0.87 -0.91 -0.09 113.55 114.10 2k23 h SER 158 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k23 h SER 158 Cb 0.88 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 2k23 h SER 158 CO 0.04 0.05 0.00 0.18 -0.53 0.00 0.00 176.83 176.57 2k23 n LEU 159 N -3.21 2.19 0.00 2.23 7.99 -1.15 -4.91 117.00 120.14 2k23 n LEU 159 Ca -0.00 -0.89 0.00 0.00 -0.01 0.00 0.00 56.01 55.11 2k23 n LEU 159 Cb 0.28 -0.12 0.00 0.00 -0.11 0.00 0.00 43.42 43.47 2k23 n LEU 159 CO 0.27 0.44 0.00 0.61 -1.51 0.00 0.00 177.39 177.21 2k23 n GLY 160 N 1.25 0.25 3.83 -0.72 0.00 -0.04 -4.53 105.19 105.22 2k23 n GLY 160 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2k23 n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k23 s LEU 161 N 0.00 2.38 0.18 0.99 1.43 -1.15 -4.69 118.68 117.82 2k23 s LEU 161 Ca 0.00 1.02 0.08 0.00 -1.03 0.00 0.00 54.13 54.20 2k23 s LEU 161 Cb 0.00 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.66 2k23 s LEU 161 CO 0.00 -2.10 -0.16 -0.54 0.23 0.00 0.00 176.35 173.77 2k23 s LYS 162 N -5.33 1.27 0.61 1.70 3.01 -1.26 -4.00 119.74 115.74 2k23 s LYS 162 Ca 0.62 -1.46 0.29 0.00 -1.01 0.00 0.00 55.97 54.41 2k23 s LYS 162 Cb -0.13 -1.22 1.53 0.00 -1.01 0.00 0.00 37.83 37.00 2k23 s LYS 162 CO 0.52 0.23 1.92 0.22 0.51 0.00 0.00 175.35 178.76 2k23 h ASP 163 N 3.03 0.00 0.21 2.83 3.58 -1.93 -0.35 116.42 123.79 2k23 h ASP 163 Ca -0.40 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.05 2k23 h ASP 163 Cb 1.21 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.26 2k23 h ASP 163 CO 0.55 0.00 -0.00 0.78 -2.88 0.00 0.00 179.24 177.69 2k23 h ASN 164 N 0.00 0.00 -0.11 2.28 4.21 -1.99 -1.49 115.58 118.48 2k23 h ASN 164 Ca 0.15 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.56 2k23 h ASN 164 Cb 0.98 0.00 -0.10 0.00 -1.12 0.00 0.00 38.32 38.08 2k23 h ASN 164 CO -0.00 0.00 -0.61 0.59 -1.29 0.00 0.00 177.43 176.12 2k23 n ASN 165 N -3.12 2.08 -3.94 5.81 4.13 -0.14 -4.81 115.26 115.27 2k23 n ASN 165 Ca -0.02 -3.67 -0.29 0.00 1.68 0.00 0.00 54.58 52.28 2k23 n ASN 165 Cb 0.12 -0.48 -0.16 0.00 -1.54 0.00 0.00 39.78 37.72 2k23 n ASN 165 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2k23 s ILE 166 N -3.12 1.39 0.51 2.41 1.01 -0.56 0.17 121.20 123.01 2k23 s ILE 166 Ca 0.39 -0.89 0.07 0.00 0.00 0.00 0.00 60.65 60.22 2k23 s ILE 166 Cb 0.38 -1.55 0.03 0.00 0.01 0.00 0.00 42.46 41.33 2k23 s ILE 166 CO -0.06 0.10 0.47 0.68 0.00 0.00 0.00 174.94 176.13 2k23 s VAL 167 N 1.50 2.06 0.21 2.92 -7.23 0.18 -4.95 120.40 115.09 2k23 s VAL 167 Ca -0.01 -1.35 0.09 0.00 -1.81 0.00 0.00 61.98 58.89 2k23 s VAL 167 Cb -0.16 -2.40 -0.05 0.00 0.56 0.00 0.00 36.38 34.33 2k23 s VAL 167 CO -0.08 0.00 -0.16 -0.36 -0.31 0.00 0.00 175.10 174.19 2k23 s PHE 168 N -2.66 1.83 0.25 2.82 0.08 -1.25 -1.93 117.98 117.12 2k23 s PHE 168 Ca 0.44 -0.51 -0.31 0.00 0.12 0.00 0.00 56.93 56.66 2k23 s PHE 168 Cb -0.03 -0.84 -0.12 0.00 -0.57 0.00 0.00 43.02 41.46 2k23 s PHE 168 CO 0.27 0.43 1.65 -1.13 -0.10 0.00 0.00 175.22 176.33 2k23 n SER 169 N -0.35 3.89 -4.62 1.36 3.41 -1.05 -4.78 113.62 111.48 2k23 n SER 169 Ca -0.08 1.11 -0.36 0.00 -0.26 0.00 0.00 58.87 59.27 2k23 n SER 169 Cb 0.60 -1.58 -0.10 0.00 -0.26 0.00 0.00 64.21 62.87 2k23 n SER 169 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2k23 s VAL 170 N 0.53 5.14 -0.62 -3.33 1.01 -1.26 -4.92 120.40 116.94 2k23 s VAL 170 Ca 0.69 0.10 -0.26 0.00 0.00 0.00 0.00 61.98 62.52 2k23 s VAL 170 Cb -0.51 -3.39 -0.11 0.00 0.00 0.00 0.00 36.38 32.37 2k23 s VAL 170 CO 0.41 0.35 2.43 -2.65 0.00 0.00 0.00 175.10 175.64 2k23 n PRO 171 N 4.39 0.82 -2.13 2.72 -0.02 -1.26 -2.64 135.00 136.87 2k23 n PRO 171 Ca -0.15 -0.24 -0.42 0.00 -2.02 0.00 0.00 63.50 60.67 2k23 n PRO 171 Cb 0.52 -3.34 -0.03 0.00 -0.02 0.00 0.00 33.50 30.63 2k23 n PRO 171 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2k23 s THR 172 N 12.49 3.09 -0.97 3.45 2.01 -1.26 -4.95 115.64 129.50 2k23 s THR 172 Ca 1.00 0.83 -0.14 0.00 0.31 0.00 0.00 61.69 63.68 2k23 s THR 172 Cb -0.25 -3.53 0.20 0.00 0.01 0.00 0.00 72.50 68.93 2k23 s THR 172 CO 0.23 0.09 1.04 -0.62 -0.69 0.00 0.00 174.62 174.67 2k23 s ASP 173 N 0.82 6.89 0.03 3.53 2.15 -1.26 -4.82 116.67 124.01 2k23 s ASP 173 Ca 0.63 -2.74 -0.03 0.00 0.43 0.00 0.00 52.55 50.84 2k23 s ASP 173 Cb -0.38 -2.29 0.01 0.00 -0.30 0.00 0.00 42.92 39.96 2k23 s ASP 173 CO 0.34 -0.68 0.15 0.00 -0.17 0.00 0.00 175.17 174.81 2k23 n GLN 174 N 4.69 0.11 -0.14 4.34 1.13 -1.26 -5.02 117.38 121.24 2k23 n GLN 174 Ca 0.22 -0.24 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 2k23 n GLN 174 Cb 0.45 0.33 0.00 0.00 0.11 0.00 0.00 30.24 31.13 2k23 n GLN 174 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k23 s ILE 176 N 0.16 3.93 0.01 0.00 2.07 -1.26 -4.33 121.20 121.78 2k23 s ILE 176 Ca 0.00 -0.52 0.00 0.00 -1.41 0.00 0.00 60.65 58.72 2k23 s ILE 176 Cb 0.00 -5.00 0.00 0.00 0.13 0.00 0.00 42.46 37.59 2k23 s ILE 176 CO 0.00 -1.88 0.00 -0.67 -1.91 0.00 0.00 174.94 170.48 2k23 n ASP 177 N 8.84 -0.05 0.00 4.50 2.03 -1.26 -5.04 116.55 125.56 2k23 n ASP 177 Ca 0.24 0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.57 2k23 n ASP 177 Cb 0.50 0.24 0.00 0.00 -0.72 0.00 0.00 41.12 41.14 2k23 n ASP 177 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87