#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 8.55 -1.30 1.69 8.00 -1.26 -4.44 116.55 127.79 2k23 n ASP 2 Ca 0.00 -2.75 0.07 0.00 0.71 0.00 0.00 54.79 52.82 2k23 n ASP 2 Cb 0.00 -1.50 0.27 0.00 -0.02 0.00 0.00 41.12 39.88 2k23 n ASP 2 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2k23 n SER 3 N 3.00 3.81 0.00 -2.24 7.64 -1.26 -4.68 113.62 119.90 2k23 n SER 3 Ca 0.74 -2.38 0.00 0.00 1.01 0.00 0.00 58.87 58.23 2k23 n SER 3 Cb 0.24 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 2k23 n SER 3 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2k23 n THR 4 N 0.75 0.00 -1.39 0.44 -2.24 -1.26 -4.42 114.28 106.15 2k23 n THR 4 Ca 0.20 0.20 -0.35 0.00 -2.27 0.00 0.00 64.05 61.83 2k23 n THR 4 Cb 0.74 -0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 68.49 2k23 n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k23 n GLN 5 N -0.41 3.59 0.16 -0.78 1.13 -1.26 -4.20 117.38 115.61 2k23 n GLN 5 Ca 0.00 -2.27 0.12 0.00 -1.94 0.00 0.00 57.00 52.92 2k23 n GLN 5 Cb 0.00 -2.64 0.19 0.00 0.11 0.00 0.00 30.24 27.90 2k23 n GLN 5 CO 0.00 0.00 0.00 -0.97 -1.44 0.00 0.00 177.06 174.65 2k23 h ASN 6 N 4.59 0.00 -3.44 1.08 -0.73 -1.90 -3.46 115.58 111.71 2k23 h ASN 6 Ca 0.74 -0.02 -0.54 0.00 1.87 0.00 0.00 56.30 58.35 2k23 h ASN 6 Cb 0.47 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.02 2k23 h ASN 6 CO 1.49 0.01 0.18 -0.76 -0.37 0.00 0.00 177.43 177.98 2k23 s LEU 7 N -5.52 4.46 0.03 0.34 2.01 -1.26 -5.03 118.68 113.70 2k23 s LEU 7 Ca 0.06 1.49 -0.30 0.00 0.01 0.00 0.00 54.13 55.39 2k23 s LEU 7 Cb 0.08 -3.27 -0.04 0.00 0.01 0.00 0.00 46.19 42.98 2k23 s LEU 7 CO 0.68 0.01 0.98 -0.63 1.01 0.00 0.00 176.35 178.41 2k23 s ILE 8 N -0.08 4.75 0.00 -0.59 1.01 -1.26 -4.71 121.20 120.31 2k23 s ILE 8 Ca 0.39 2.04 0.00 0.00 0.00 0.00 0.00 60.65 63.08 2k23 s ILE 8 Cb -0.21 -4.31 0.00 0.00 0.01 0.00 0.00 42.46 37.95 2k23 s ILE 8 CO 0.24 0.20 0.00 -2.65 0.00 0.00 0.00 174.94 172.72 2k23 n PRO 9 N 3.63 0.00 -2.70 2.79 -0.02 -1.26 -4.78 135.00 132.66 2k23 n PRO 9 Ca 0.05 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.11 2k23 n PRO 9 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.95 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 3.08 0.20 3.55 0.00 -1.26 -4.63 121.76 122.70 2k23 s ALA 10 Ca 0.00 -0.97 -0.20 0.00 0.00 0.00 0.00 51.96 50.78 2k23 s ALA 10 Cb 0.00 -3.88 -0.08 0.00 0.00 0.00 0.00 23.12 19.15 2k23 s ALA 10 CO 0.00 -2.50 0.72 -2.14 0.00 0.00 0.00 175.76 171.84 2k23 s PRO 11 N 4.45 4.30 0.96 0.00 0.02 -1.26 -5.02 135.00 138.46 2k23 s PRO 11 Ca 0.38 0.90 -0.12 0.00 0.02 0.00 0.00 61.00 62.18 2k23 s PRO 11 Cb -0.10 -2.97 0.17 0.00 0.02 0.00 0.00 34.50 31.62 2k23 s PRO 11 CO 0.23 0.45 1.09 -1.25 -0.33 0.00 0.00 177.00 177.18 2k23 s PRO 12 N -1.76 0.70 0.33 5.54 0.04 -1.26 -4.89 135.00 133.70 2k23 s PRO 12 Ca 0.40 0.86 0.12 0.00 0.04 0.00 0.00 61.00 62.43 2k23 s PRO 12 Cb -0.18 -1.74 1.02 0.00 0.04 0.00 0.00 34.50 33.64 2k23 s PRO 12 CO 0.22 -2.64 1.66 1.25 0.04 0.00 0.00 177.00 177.54 2k23 h LEU 13 N -1.84 0.44 0.00 -3.56 7.12 -1.95 0.31 115.31 115.83 2k23 h LEU 13 Ca -0.52 0.19 0.00 0.00 0.13 0.00 0.00 57.88 57.68 2k23 h LEU 13 Cb 1.30 0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.58 2k23 h LEU 13 CO 0.53 -0.12 0.00 2.30 -0.13 0.00 0.00 178.44 181.01 2k23 n ILE 14 N -5.07 0.13 0.80 4.05 -5.35 -1.26 -0.60 119.36 112.06 2k23 n ILE 14 Ca 0.30 0.03 0.11 0.00 -0.27 0.00 0.00 62.75 62.92 2k23 n ILE 14 Cb 0.92 -0.85 0.08 0.00 -1.74 0.00 0.00 39.64 38.05 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 -1.05 0.65 -4.44 7.28 7.64 0.10 -4.90 113.62 118.90 2k23 n SER 15 Ca 0.08 -0.37 -0.33 0.00 1.01 0.00 0.00 58.87 59.26 2k23 n SER 15 Cb 0.05 0.63 -0.13 0.00 -1.01 0.00 0.00 64.21 63.75 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 -3.09 3.23 1.00 0.44 0.11 0.24 -5.03 120.40 117.31 2k23 s VAL 16 Ca 0.07 -0.62 -0.12 0.00 -2.93 0.00 0.00 61.98 58.38 2k23 s VAL 16 Cb 0.16 -2.34 0.19 0.00 -1.53 0.00 0.00 36.38 32.86 2k23 s VAL 16 CO 0.78 0.55 1.08 -2.16 -3.33 0.00 0.00 175.10 172.02 2k23 s PRO 17 N -0.09 0.37 0.15 1.54 0.04 -1.26 -5.00 135.00 130.74 2k23 s PRO 17 Ca -0.01 0.72 0.08 0.00 0.04 0.00 0.00 61.00 61.83 2k23 s PRO 17 Cb -0.14 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.65 2k23 s PRO 17 CO 0.03 -2.82 -0.10 -1.17 0.04 0.00 0.00 177.00 172.98 2k23 s LEU 18 N -6.57 2.98 -0.02 -3.56 0.20 -1.26 -4.10 118.68 106.35 2k23 s LEU 18 Ca 0.66 -0.50 -0.30 0.00 0.69 0.00 0.00 54.13 54.67 2k23 s LEU 18 Cb -0.20 -1.72 -0.04 0.00 -0.43 0.00 0.00 46.19 43.80 2k23 s LEU 18 CO 0.59 0.14 1.22 0.00 -0.29 0.00 0.00 176.35 178.00 2k23 s GLN 19 N -2.54 4.37 0.35 1.98 0.00 -0.80 -4.89 119.66 118.12 2k23 s GLN 19 Ca 0.23 1.72 -0.26 0.00 -0.00 0.00 0.00 55.36 57.04 2k23 s GLN 19 Cb -0.10 -3.51 -0.09 0.00 0.00 0.00 0.00 33.01 29.31 2k23 s GLN 19 CO 0.14 -0.41 1.07 -2.14 0.00 0.00 0.00 175.29 173.95 2k23 s PRO 20 N 1.97 4.37 -0.97 9.60 0.02 -1.26 -3.96 135.00 144.77 2k23 s PRO 20 Ca 0.57 1.63 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 2k23 s PRO 20 Cb -0.26 -2.82 0.00 0.00 0.02 0.00 0.00 34.50 31.44 2k23 s PRO 20 CO 0.24 0.02 0.82 0.41 -0.33 0.00 0.00 177.00 178.16 2k23 n GLY 21 N 0.72 -0.18 3.79 0.52 0.00 -1.26 -4.98 105.19 103.80 2k23 n GLY 21 Ca 0.02 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.26 3.75 0.10 1.61 5.36 -1.25 -5.05 117.98 119.23 2k23 s PHE 22 Ca 0.19 1.22 0.03 0.00 -0.96 0.00 0.00 56.93 57.40 2k23 s PHE 22 Cb -0.08 -2.53 -0.04 0.00 -0.34 0.00 0.00 43.02 40.03 2k23 s PHE 22 CO 0.56 0.49 -0.08 -0.46 -1.46 0.00 0.00 175.22 174.26 2k23 s TRP 23 N -0.69 0.99 0.19 10.12 -0.00 -1.26 -5.01 118.94 123.28 2k23 s TRP 23 Ca 0.29 -0.80 -0.14 0.00 -0.00 0.00 0.00 56.10 55.45 2k23 s TRP 23 Cb -0.19 -0.55 0.20 0.00 -0.00 0.00 0.00 33.47 32.93 2k23 s TRP 23 CO 0.18 -0.07 1.67 1.79 -0.00 0.00 0.00 176.95 180.52 2k23 h THR 24 N 3.14 0.54 0.00 5.86 1.35 -2.00 -0.20 112.91 121.61 2k23 h THR 24 Ca -0.36 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 2k23 h THR 24 Cb 1.18 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 2k23 h THR 24 CO 0.61 0.01 0.00 -0.08 -0.25 0.00 0.00 175.52 175.81 2k23 h GLU 25 N 0.07 0.00 0.00 4.72 4.81 -1.97 -2.97 114.58 119.24 2k23 h GLU 25 Ca 0.26 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 2k23 h GLU 25 Cb 0.41 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2k23 h GLU 25 CO -0.48 0.00 0.00 0.54 -0.73 0.00 0.00 179.01 178.34 2k23 n ARG 26 N -2.99 0.30 -0.56 1.92 5.12 -0.09 -1.71 116.66 118.65 2k23 n ARG 26 Ca 0.01 0.10 0.05 0.00 -1.93 0.00 0.00 57.85 56.08 2k23 n ARG 26 Cb 0.31 -1.50 0.09 0.00 -1.16 0.00 0.00 32.46 30.20 2k23 n ARG 26 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2k23 n PHE 27 N -1.25 0.00 -3.88 -1.55 -0.00 -1.12 -4.60 117.46 105.07 2k23 n PHE 27 Ca 0.09 -0.71 -0.31 0.00 -0.00 0.00 0.00 57.45 56.52 2k23 n PHE 27 Cb 0.13 -0.14 -0.04 0.00 -0.00 0.00 0.00 39.48 39.43 2k23 n PHE 27 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 2k23 s GLN 28 N -1.59 3.47 0.00 -4.13 0.74 -0.70 -4.72 119.66 112.74 2k23 s GLN 28 Ca 0.24 -0.37 0.00 0.00 0.05 0.00 0.00 55.36 55.28 2k23 s GLN 28 Cb 0.23 -3.01 0.00 0.00 1.10 0.00 0.00 33.01 31.34 2k23 s GLN 28 CO -0.03 0.59 0.00 0.41 -0.55 0.00 0.00 175.29 175.70 2k23 n GLY 29 N 0.28 0.36 3.53 2.59 0.00 0.42 -4.94 105.19 107.43 2k23 n GLY 29 Ca -0.05 -2.27 -0.43 0.00 0.00 0.00 0.00 46.02 43.27 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 0.00 3.36 -0.42 1.61 3.00 -1.26 -1.39 118.95 123.84 2k23 s ARG 30 Ca 0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 55.73 55.34 2k23 s ARG 30 Cb 0.00 -4.01 0.02 0.00 0.00 0.00 0.00 34.95 30.96 2k23 s ARG 30 CO 0.00 -1.33 0.38 -1.58 0.00 0.00 0.00 175.30 172.76 2k23 s TRP 31 N 3.64 3.20 -0.12 -0.53 0.52 -0.89 -4.71 118.94 120.05 2k23 s TRP 31 Ca 0.30 -0.47 -0.19 0.00 0.02 0.00 0.00 56.10 55.76 2k23 s TRP 31 Cb -0.13 -2.76 -0.04 0.00 -1.15 0.00 0.00 33.47 29.39 2k23 s TRP 31 CO 0.20 -0.65 0.51 -0.06 0.02 0.00 0.00 176.95 176.97 2k23 s PHE 32 N 1.94 3.50 -0.22 -1.98 0.40 -0.81 -1.64 117.98 119.17 2k23 s PHE 32 Ca 0.09 0.92 -0.29 0.00 -0.60 0.00 0.00 56.93 57.04 2k23 s PHE 32 Cb -0.18 -2.60 0.00 0.00 0.51 0.00 0.00 43.02 40.75 2k23 s PHE 32 CO 0.12 0.12 1.15 0.08 0.70 0.00 0.00 175.22 177.39 2k23 s VAL 33 N 0.78 4.46 -0.70 -0.44 1.01 -1.15 -0.27 120.40 124.10 2k23 s VAL 33 Ca 0.27 1.75 0.06 0.00 0.00 0.00 0.00 61.98 64.07 2k23 s VAL 33 Cb -0.15 -4.19 0.08 0.00 0.00 0.00 0.00 36.38 32.12 2k23 s VAL 33 CO 0.11 -0.22 0.82 0.52 0.00 0.00 0.00 175.10 176.33 2k23 n VAL 34 N 5.47 0.28 -3.61 2.92 0.31 0.17 -4.59 118.33 119.27 2k23 n VAL 34 Ca 0.13 -0.64 -0.02 0.00 -0.01 0.00 0.00 64.34 63.80 2k23 n VAL 34 Cb 0.46 0.95 -0.01 0.00 -0.91 0.00 0.00 33.84 34.33 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 -0.65 -0.35 -0.26 2.92 0.00 -0.96 -3.22 107.32 104.81 2k23 s GLY 35 Ca 0.09 1.16 -0.19 0.00 0.00 0.00 0.00 44.72 45.78 2k23 s GLY 35 CO 0.08 0.34 0.66 -2.27 0.00 0.00 0.00 173.10 171.91 2k23 s LEU 36 N -2.54 -0.70 -0.11 0.66 2.96 -0.95 -1.04 118.68 116.96 2k23 s LEU 36 Ca 0.11 1.39 -0.05 0.00 -0.22 0.00 0.00 54.13 55.36 2k23 s LEU 36 Cb 0.01 2.26 0.05 0.00 0.50 0.00 0.00 46.19 49.01 2k23 s LEU 36 CO -0.04 -0.23 0.24 0.00 -1.32 0.00 0.00 176.35 175.00 2k23 s ALA 37 N 1.06 -0.54 0.00 5.97 0.00 0.37 -0.06 121.76 128.55 2k23 s ALA 37 Ca -0.06 0.97 0.00 0.00 0.00 0.00 0.00 51.96 52.88 2k23 s ALA 37 Cb -0.05 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.37 2k23 s ALA 37 CO -0.10 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 175.79 2k23 n GLY 38 N 4.43 2.89 0.18 0.00 0.00 0.12 0.14 105.19 112.96 2k23 n GLY 38 Ca -0.22 -0.87 0.03 0.00 0.00 0.00 0.00 46.02 44.97 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 0.05 1.61 -0.00 -1.73 -0.58 115.58 114.92 2k23 h ASN 39 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 2k23 h ASN 39 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 2k23 h ASN 39 CO 0.00 0.40 -0.03 0.00 -0.00 0.00 0.00 177.43 177.80 2k23 n ALA 40 N -2.40 2.66 -2.29 1.57 0.00 -1.22 -4.79 120.51 114.04 2k23 n ALA 40 Ca -0.01 -0.35 -0.42 0.00 0.00 0.00 0.00 53.44 52.65 2k23 n ALA 40 Cb 0.46 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 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 -2.09 3.91 -1.18 0.00 1.01 -0.23 -4.93 120.40 116.89 2k23 s VAL 41 Ca 0.39 1.25 -0.21 0.00 0.00 0.00 0.00 61.98 63.41 2k23 s VAL 41 Cb 0.21 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 2k23 s VAL 41 CO 0.37 -0.02 1.90 0.00 0.00 0.00 0.00 175.10 177.35 2k23 n GLN 42 N 5.57 2.10 -3.44 2.72 6.02 -1.26 -4.87 117.38 124.21 2k23 n GLN 42 Ca 0.13 -2.62 -0.41 0.00 -0.01 0.00 0.00 57.00 54.09 2k23 n GLN 42 Cb 0.44 -3.53 -0.10 0.00 1.02 0.00 0.00 30.24 28.07 2k23 n GLN 42 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2k23 s LYS 43 N 5.46 3.33 0.05 -1.09 2.20 -1.26 -3.86 119.74 124.57 2k23 s LYS 43 Ca 0.62 -0.69 -0.30 0.00 -0.36 0.00 0.00 55.97 55.24 2k23 s LYS 43 Cb 0.04 -3.87 -0.18 0.00 -1.51 0.00 0.00 37.83 32.30 2k23 s LYS 43 CO 0.11 -0.60 1.52 1.05 -0.36 0.00 0.00 175.35 177.06 2k23 h GLU 44 N 8.55 -0.73 0.00 4.03 4.11 -1.90 -3.48 114.58 125.17 2k23 h GLU 44 Ca -0.29 0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.19 2k23 h GLU 44 Cb 1.14 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2k23 h GLU 44 CO 0.70 -0.45 0.00 -2.13 0.07 0.00 0.00 179.01 177.20 2k23 n ARG 45 N -5.38 0.00 0.00 1.06 0.63 -1.26 -5.06 116.66 106.65 2k23 n ARG 45 Ca -0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 2k23 n ARG 45 Cb 0.32 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.23 2k23 n ARG 45 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2k23 n GLN 46 N -1.17 0.00 -3.20 -0.14 10.64 -1.26 -4.97 117.38 117.28 2k23 n GLN 46 Ca 0.00 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.09 2k23 n GLN 46 Cb 0.00 -0.13 -0.04 0.00 -0.86 0.00 0.00 30.24 29.21 2k23 n GLN 46 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 2k23 s SER 47 N -1.00 -0.33 0.00 2.61 0.01 -1.26 -4.74 113.70 108.99 2k23 s SER 47 Ca 0.00 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 55.85 2k23 s SER 47 Cb 0.00 1.27 0.00 0.00 0.21 0.00 0.00 66.02 67.50 2k23 s SER 47 CO 0.00 -0.18 0.00 -1.14 0.41 0.00 0.00 173.24 172.33 2k23 n ARG 48 N 3.98 2.66 -1.24 12.44 0.63 -1.26 -4.87 116.66 128.99 2k23 n ARG 48 Ca 0.14 0.00 0.16 0.00 -0.92 0.00 0.00 57.85 57.23 2k23 n ARG 48 Cb 0.52 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.38 2k23 n ARG 48 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2k23 n PHE 49 N 0.00 -3.17 -3.64 -0.14 7.35 -1.25 -4.48 117.46 112.13 2k23 n PHE 49 Ca 0.00 1.62 -0.08 0.00 -0.76 0.00 0.00 57.45 58.23 2k23 n PHE 49 Cb 0.00 -2.88 -0.07 0.00 0.35 0.00 0.00 39.48 36.88 2k23 n PHE 49 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2k23 s THR 50 N -2.53 0.00 0.35 -2.13 -4.23 -1.26 -4.43 115.64 101.41 2k23 s THR 50 Ca 0.00 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.23 2k23 s THR 50 Cb 0.00 -1.00 -0.11 0.00 1.34 0.00 0.00 72.50 72.73 2k23 s THR 50 CO 0.00 0.00 1.43 0.00 -0.54 0.00 0.00 174.62 175.51 2k23 s MET 51 N 1.16 4.19 0.25 3.99 0.23 -0.69 -4.85 119.30 123.58 2k23 s MET 51 Ca -0.06 2.45 0.01 0.00 -1.03 0.00 0.00 55.69 57.06 2k23 s MET 51 Cb -0.05 -3.01 -0.05 0.00 -1.53 0.00 0.00 34.83 30.19 2k23 s MET 51 CO -0.13 -0.42 0.10 1.52 -2.03 0.00 0.00 175.02 174.06 2k23 s TYR 52 N -1.04 1.49 -0.26 3.16 -0.85 -1.26 -4.70 117.35 113.89 2k23 s TYR 52 Ca 0.52 -1.21 -0.08 0.00 -0.52 0.00 0.00 57.07 55.78 2k23 s TYR 52 Cb -0.44 -0.85 -0.03 0.00 0.38 0.00 0.00 41.96 41.01 2k23 s TYR 52 CO 0.58 -0.38 0.10 -1.12 -1.52 0.00 0.00 175.55 173.22 2k23 s SER 53 N -3.29 5.36 -0.48 -0.18 0.01 -1.26 -2.92 113.70 110.94 2k23 s SER 53 Ca 0.38 -0.16 -0.14 0.00 1.31 0.00 0.00 55.95 57.34 2k23 s SER 53 Cb 0.08 -1.97 0.09 0.00 0.21 0.00 0.00 66.02 64.43 2k23 s SER 53 CO 0.13 -0.04 0.40 -0.89 0.41 0.00 0.00 173.24 173.26 2k23 s THR 54 N 1.65 4.98 -0.69 1.44 2.01 -0.65 -1.73 115.64 122.65 2k23 s THR 54 Ca 0.07 -1.31 -0.18 0.00 0.31 0.00 0.00 61.69 60.58 2k23 s THR 54 Cb -0.15 -4.07 0.13 0.00 0.01 0.00 0.00 72.50 68.42 2k23 s THR 54 CO 0.05 -0.67 0.78 -0.63 -0.69 0.00 0.00 174.62 173.46 2k23 s ILE 55 N 1.57 4.98 -0.47 1.82 -1.09 0.24 -2.09 121.20 126.17 2k23 s ILE 55 Ca 0.04 -1.42 -0.28 0.00 -2.23 0.00 0.00 60.65 56.76 2k23 s ILE 55 Cb -0.26 -4.53 0.00 0.00 -1.58 0.00 0.00 42.46 36.09 2k23 s ILE 55 CO 0.04 -1.16 1.53 -0.31 -1.23 0.00 0.00 174.94 173.81 2k23 s TYR 56 N 2.13 2.18 -0.12 3.97 1.51 -0.49 -0.53 117.35 126.00 2k23 s TYR 56 Ca 0.16 0.61 -0.01 0.00 -1.01 0.00 0.00 57.07 56.82 2k23 s TYR 56 Cb -0.18 -4.28 -0.02 0.00 -0.11 0.00 0.00 41.96 37.36 2k23 s TYR 56 CO 0.00 -2.19 -0.08 -1.21 -1.11 0.00 0.00 175.55 170.96 2k23 s GLU 57 N 5.48 3.28 0.05 -0.62 2.02 -0.91 -0.43 118.70 127.57 2k23 s GLU 57 Ca 0.62 -0.59 -0.26 0.00 0.02 0.00 0.00 54.97 54.77 2k23 s GLU 57 Cb -0.14 -2.71 -0.06 0.00 0.10 0.00 0.00 34.13 31.32 2k23 s GLU 57 CO 0.29 0.37 0.79 -0.51 0.02 0.00 0.00 175.26 176.22 2k23 s LEU 58 N -0.01 4.46 0.00 1.80 1.43 -1.26 0.57 118.68 125.67 2k23 s LEU 58 Ca -0.01 1.50 0.06 0.00 -1.03 0.00 0.00 54.13 54.65 2k23 s LEU 58 Cb -0.14 -3.28 0.06 0.00 0.03 0.00 0.00 46.19 42.86 2k23 s LEU 58 CO 0.03 0.00 0.49 0.00 0.23 0.00 0.00 176.35 177.10 2k23 n GLN 59 N 2.80 0.76 0.00 1.70 1.13 -0.88 -4.89 117.38 118.00 2k23 n GLN 59 Ca -0.02 -1.94 0.14 0.00 -1.94 0.00 0.00 57.00 53.25 2k23 n GLN 59 Cb 0.50 -0.14 0.66 0.00 0.11 0.00 0.00 30.24 31.38 2k23 n GLN 59 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2k23 n GLU 60 N -1.76 0.15 -0.58 -1.09 0.00 -1.26 -3.08 120.64 113.01 2k23 n GLU 60 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.28 2k23 n GLU 60 Cb 0.37 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.52 2k23 n GLU 60 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2k23 n ASP 61 N -1.43 2.57 -0.11 -1.84 2.03 -1.26 -4.93 116.55 111.57 2k23 n ASP 61 Ca 0.09 -3.55 -0.01 0.00 0.52 0.00 0.00 54.79 51.84 2k23 n ASP 61 Cb 0.30 -0.57 -0.00 0.00 -0.72 0.00 0.00 41.12 40.14 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 -1.06 -2.36 -4.66 1.67 6.94 -1.18 -4.90 115.26 109.72 2k23 n ASN 62 Ca 0.25 0.02 -0.43 0.00 -0.02 0.00 0.00 54.58 54.40 2k23 n ASN 62 Cb 0.88 -1.74 -0.02 0.00 -2.36 0.00 0.00 39.78 36.54 2k23 n ASN 62 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2k23 s SER 63 N -0.88 7.05 -0.04 0.53 1.04 -1.26 -4.16 113.70 115.99 2k23 s SER 63 Ca 0.00 1.52 -0.20 0.00 0.48 0.00 0.00 55.95 57.75 2k23 s SER 63 Cb 0.00 -2.54 -0.05 0.00 0.10 0.00 0.00 66.02 63.53 2k23 s SER 63 CO 0.00 -0.68 0.56 -0.31 0.98 0.00 0.00 173.24 173.79 2k23 s TYR 64 N 3.18 3.63 -0.63 5.02 2.02 0.15 -2.08 117.35 128.64 2k23 s TYR 64 Ca 0.49 1.11 -0.23 0.00 -0.37 0.00 0.00 57.07 58.06 2k23 s TYR 64 Cb -0.18 -2.60 0.06 0.00 -0.40 0.00 0.00 41.96 38.84 2k23 s TYR 64 CO 0.11 0.29 0.97 0.54 -1.57 0.00 0.00 175.55 175.89 2k23 s ASN 65 N 0.09 6.22 -0.48 2.29 4.22 0.19 -1.59 114.94 125.87 2k23 s ASN 65 Ca 0.30 -0.78 -0.13 0.00 -2.14 0.00 0.00 52.86 50.10 2k23 s ASN 65 Cb -0.17 -2.43 0.10 0.00 1.28 0.00 0.00 41.25 40.03 2k23 s ASN 65 CO 0.15 -1.40 0.39 -0.69 -2.04 0.00 0.00 177.10 173.51 2k23 s VAL 66 N 4.13 4.84 -0.68 3.54 1.01 0.23 -2.14 120.40 131.32 2k23 s VAL 66 Ca 0.25 -1.41 -0.27 0.00 0.00 0.00 0.00 61.98 60.55 2k23 s VAL 66 Cb -0.15 -4.02 0.01 0.00 0.00 0.00 0.00 36.38 32.21 2k23 s VAL 66 CO 0.13 -0.70 1.51 -0.89 0.00 0.00 0.00 175.10 175.15 2k23 s THR 67 N 1.53 3.58 -0.54 3.92 2.01 0.31 0.50 115.64 126.95 2k23 s THR 67 Ca 0.04 0.34 -0.13 0.00 0.31 0.00 0.00 61.69 62.25 2k23 s THR 67 Cb -0.26 -4.53 0.14 0.00 0.01 0.00 0.00 72.50 67.85 2k23 s THR 67 CO 0.03 -1.47 0.47 -0.44 -0.69 0.00 0.00 174.62 172.52 2k23 s SER 68 N 5.42 6.05 0.01 3.53 0.01 0.42 -0.59 113.70 128.55 2k23 s SER 68 Ca 0.48 -1.95 -0.28 0.00 1.31 0.00 0.00 55.95 55.51 2k23 s SER 68 Cb -0.10 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 2k23 s SER 68 CO 0.18 -0.76 0.90 -0.51 0.41 0.00 0.00 173.24 173.45 2k23 s ILE 69 N 1.34 4.82 0.08 1.44 2.07 -0.70 -0.94 121.20 129.30 2k23 s ILE 69 Ca 0.06 1.89 -0.08 0.00 -1.41 0.00 0.00 60.65 61.11 2k23 s ILE 69 Cb -0.27 -4.24 -0.01 0.00 0.13 0.00 0.00 42.46 38.08 2k23 s ILE 69 CO 0.00 0.23 0.16 -1.48 -1.91 0.00 0.00 174.94 171.95 2k23 s LEU 70 N 0.66 1.56 0.02 8.50 0.05 -0.94 -4.03 118.68 124.50 2k23 s LEU 70 Ca 0.47 -0.68 -0.30 0.00 0.05 0.00 0.00 54.13 53.66 2k23 s LEU 70 Cb -0.21 0.93 -0.05 0.00 -2.05 0.00 0.00 46.19 44.81 2k23 s LEU 70 CO 0.26 -0.71 1.23 -0.69 -0.55 0.00 0.00 176.35 175.89 2k23 s VAL 71 N -3.82 4.03 -0.64 1.48 1.01 -1.26 -2.39 120.40 118.80 2k23 s VAL 71 Ca 0.05 1.43 0.04 0.00 0.00 0.00 0.00 61.98 63.49 2k23 s VAL 71 Cb 0.05 -3.91 0.16 0.00 0.00 0.00 0.00 36.38 32.67 2k23 s VAL 71 CO -0.11 0.07 0.42 -0.13 0.00 0.00 0.00 175.10 175.35 2k23 s ARG 72 N 1.55 2.35 0.00 2.72 1.81 0.15 -4.94 118.95 122.59 2k23 s ARG 72 Ca 0.59 -3.02 0.00 0.00 -1.72 0.00 0.00 55.73 51.58 2k23 s ARG 72 Cb -0.29 -3.45 0.00 0.00 -0.45 0.00 0.00 34.95 30.77 2k23 s ARG 72 CO 0.27 -1.21 0.00 0.41 -0.68 0.00 0.00 175.30 174.09 2k23 n GLY 73 N 2.52 2.12 2.71 -3.53 0.00 -1.26 -3.79 105.19 103.97 2k23 n GLY 73 Ca 0.13 -0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 2k23 n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k23 n GLN 74 N 0.00 1.79 -2.68 1.61 10.64 -1.26 -5.10 117.38 122.39 2k23 n GLN 74 Ca 0.00 -3.53 0.00 0.00 -1.83 0.00 0.00 57.00 51.64 2k23 n GLN 74 Cb 0.00 -1.59 0.00 0.00 -0.86 0.00 0.00 30.24 27.79 2k23 n GLN 74 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2k23 n GLY 75 N -0.46 -0.02 3.64 2.61 0.00 -1.25 -5.13 105.19 104.57 2k23 n GLY 75 Ca 0.12 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 44.47 2k23 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k23 s ARG 77 N -1.91 0.93 -0.34 0.00 3.52 -1.01 -4.81 118.95 115.33 2k23 s ARG 77 Ca 0.21 0.53 -0.27 0.00 -0.13 0.00 0.00 55.73 56.07 2k23 s ARG 77 Cb -0.11 0.44 0.01 0.00 -1.56 0.00 0.00 34.95 33.73 2k23 s ARG 77 CO 0.13 -0.22 0.98 0.71 -0.81 0.00 0.00 175.30 176.09 2k23 s TYR 78 N -0.54 3.12 -0.48 5.12 2.02 -1.26 -2.22 117.35 123.10 2k23 s TYR 78 Ca -0.06 0.96 -0.17 0.00 -0.37 0.00 0.00 57.07 57.43 2k23 s TYR 78 Cb -0.02 -3.64 0.07 0.00 -0.40 0.00 0.00 41.96 37.96 2k23 s TYR 78 CO 0.06 -0.78 0.46 -0.46 -1.57 0.00 0.00 175.55 173.26 2k23 s TRP 79 N 3.53 3.19 -0.09 2.71 -0.11 -0.12 -4.88 118.94 123.16 2k23 s TRP 79 Ca 0.41 -0.81 -0.19 0.00 1.22 0.00 0.00 56.10 56.73 2k23 s TRP 79 Cb -0.12 -3.27 -0.04 0.00 -1.50 0.00 0.00 33.47 28.53 2k23 s TRP 79 CO 0.17 -0.86 0.53 0.42 -4.62 0.00 0.00 176.95 172.59 2k23 s ILE 80 N 1.93 5.13 0.22 5.86 1.09 -1.26 -0.44 121.20 133.73 2k23 s ILE 80 Ca 0.07 1.08 0.00 0.00 -1.10 0.00 0.00 60.65 60.70 2k23 s ILE 80 Cb -0.23 -3.87 0.00 0.00 -1.06 0.00 0.00 42.46 37.31 2k23 s ILE 80 CO 0.08 0.33 0.01 -1.14 -0.10 0.00 0.00 174.94 174.12 2k23 n ARG 81 N 3.53 1.45 -4.05 2.79 0.63 0.18 -4.86 116.66 116.33 2k23 n ARG 81 Ca -0.06 -1.60 -0.23 0.00 -0.92 0.00 0.00 57.85 55.04 2k23 n ARG 81 Cb 0.52 0.41 -0.17 0.00 0.45 0.00 0.00 32.46 33.67 2k23 n ARG 81 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2k23 s THR 82 N -1.76 0.69 -0.16 5.15 2.01 -1.26 0.78 115.64 121.09 2k23 s THR 82 Ca 0.01 -0.14 -0.01 0.00 0.31 0.00 0.00 61.69 61.86 2k23 s THR 82 Cb -0.00 -0.73 -0.00 0.00 0.01 0.00 0.00 72.50 71.77 2k23 s THR 82 CO 0.00 0.29 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.73 2k23 s PHE 83 N 1.36 2.82 -0.13 4.92 0.08 -0.62 0.37 117.98 126.78 2k23 s PHE 83 Ca -0.03 -1.01 0.00 0.00 0.12 0.00 0.00 56.93 56.01 2k23 s PHE 83 Cb -0.14 -1.92 0.02 0.00 -0.57 0.00 0.00 43.02 40.41 2k23 s PHE 83 CO -0.03 -0.47 -0.11 0.14 -0.10 0.00 0.00 175.22 174.65 2k23 s VAL 84 N 0.90 1.31 0.24 -0.44 -7.23 0.64 0.33 120.40 116.15 2k23 s VAL 84 Ca -0.03 -0.48 -0.30 0.00 -1.81 0.00 0.00 61.98 59.36 2k23 s VAL 84 Cb -0.15 -1.26 -0.15 0.00 0.56 0.00 0.00 36.38 35.38 2k23 s VAL 84 CO -0.01 0.41 1.04 -2.65 -0.31 0.00 0.00 175.10 173.58 2k23 n PRO 85 N 4.76 1.20 0.00 4.82 -0.02 -1.26 0.18 135.00 144.68 2k23 n PRO 85 Ca -0.15 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2k23 n PRO 85 Cb 0.50 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2k23 n PRO 85 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2k23 n SER 86 N 1.59 0.00 0.04 2.55 3.41 0.11 -4.74 113.62 116.58 2k23 n SER 86 Ca 0.12 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.87 2k23 n SER 86 Cb 0.29 0.00 0.51 0.00 -0.26 0.00 0.00 64.21 64.74 2k23 n SER 86 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2k23 n SER 87 N 0.00 0.35 -3.77 4.04 7.64 -1.26 -4.75 113.62 115.87 2k23 n SER 87 Ca 0.00 0.48 -0.14 0.00 1.01 0.00 0.00 58.87 60.22 2k23 n SER 87 Cb 0.00 -0.55 -0.15 0.00 -1.01 0.00 0.00 64.21 62.50 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 -3.04 0.04 0.17 1.43 3.03 -1.26 -5.13 118.95 114.18 2k23 s ARG 88 Ca 0.12 0.27 -0.34 0.00 2.03 0.00 0.00 55.73 57.81 2k23 s ARG 88 Cb 0.16 -0.19 -0.14 0.00 -1.03 0.00 0.00 34.95 33.75 2k23 s ARG 88 CO 0.57 -0.15 1.46 -2.30 -1.13 0.00 0.00 175.30 173.75 2k23 n PRO 89 N 4.07 1.87 0.00 3.89 -0.02 -1.26 -2.27 135.00 141.29 2k23 n PRO 89 Ca -0.26 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2k23 n PRO 89 Cb 0.52 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 2.82 3.39 3.59 -1.23 0.00 -1.26 -4.93 105.19 107.57 2k23 n GLY 90 Ca 0.16 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 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 3.76 -0.06 1.61 0.74 -0.96 -3.87 119.66 120.88 2k23 s GLN 91 Ca 0.00 0.40 0.00 0.00 0.05 0.00 0.00 55.36 55.81 2k23 s GLN 91 Cb 0.00 -3.82 -0.03 0.00 1.10 0.00 0.00 33.01 30.26 2k23 s GLN 91 CO 0.00 -0.94 -0.03 -0.06 -0.55 0.00 0.00 175.29 173.71 2k23 s PHE 92 N 3.34 3.04 0.51 1.67 0.08 0.90 0.04 117.98 127.56 2k23 s PHE 92 Ca 0.35 0.09 0.02 0.00 0.12 0.00 0.00 56.93 57.51 2k23 s PHE 92 Cb -0.12 -1.72 -0.00 0.00 -0.57 0.00 0.00 43.02 40.60 2k23 s PHE 92 CO 0.19 0.41 0.09 0.95 -0.10 0.00 0.00 175.22 176.75 2k23 s THR 93 N -0.90 1.30 0.02 0.64 -4.23 0.13 -1.30 115.64 111.30 2k23 s THR 93 Ca 0.14 -1.89 -0.13 0.00 -1.18 0.00 0.00 61.69 58.64 2k23 s THR 93 Cb -0.11 -2.18 -0.06 0.00 1.34 0.00 0.00 72.50 71.49 2k23 s THR 93 CO 0.04 0.00 0.39 -0.76 -0.54 0.00 0.00 174.62 173.75 2k23 s LEU 94 N -3.96 4.43 0.61 4.79 2.01 -1.26 -0.26 118.68 125.03 2k23 s LEU 94 Ca 0.13 0.88 0.29 0.00 0.01 0.00 0.00 54.13 55.44 2k23 s LEU 94 Cb 0.01 -2.70 1.52 0.00 0.01 0.00 0.00 46.19 45.03 2k23 s LEU 94 CO 0.07 0.28 1.91 1.23 1.01 0.00 0.00 176.35 180.85 2k23 h GLY 95 N 4.37 0.00 -3.39 -3.19 0.00 -0.38 0.77 103.07 101.25 2k23 h GLY 95 Ca -0.51 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.60 2k23 h GLY 95 CO 0.63 0.00 -0.92 0.70 0.00 0.00 0.00 176.54 176.95 2k23 n ASN 96 N -3.47 1.91 0.10 0.19 3.02 -1.26 -4.85 115.26 110.89 2k23 n ASN 96 Ca 0.05 -2.66 -0.04 0.00 -0.03 0.00 0.00 54.58 51.89 2k23 n ASN 96 Cb 0.57 -0.40 0.02 0.00 -0.61 0.00 0.00 39.78 39.35 2k23 n ASN 96 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2k23 h ILE 97 N 4.65 1.58 -0.05 2.41 6.09 -1.20 -3.31 117.51 127.68 2k23 h ILE 97 Ca -0.07 -2.81 0.00 0.00 -1.37 0.00 0.00 64.86 60.62 2k23 h ILE 97 Cb 1.49 2.52 0.00 0.00 0.47 0.00 0.00 36.82 41.29 2k23 h ILE 97 CO 0.20 0.80 0.00 1.57 -3.07 0.00 0.00 178.15 177.65 2k23 n HIS 98 N -3.56 0.06 0.96 2.19 -0.00 -1.26 -2.01 115.22 111.60 2k23 n HIS 98 Ca -0.01 -0.03 0.10 0.00 0.46 0.00 0.00 57.72 58.25 2k23 n HIS 98 Cb 0.79 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.63 2k23 n HIS 98 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2k23 n SER 99 N -0.47 1.78 -4.71 0.26 3.41 -1.25 -4.93 113.62 107.73 2k23 n SER 99 Ca 0.15 -1.39 -0.41 0.00 -0.26 0.00 0.00 58.87 56.96 2k23 n SER 99 Cb 0.14 0.58 -0.04 0.00 -0.26 0.00 0.00 64.21 64.63 2k23 n SER 99 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2k23 s TYR 100 N -2.51 3.59 0.03 7.33 2.02 -0.85 -4.98 117.35 121.98 2k23 s TYR 100 Ca 0.16 1.42 -0.17 0.00 -0.37 0.00 0.00 57.07 58.11 2k23 s TYR 100 Cb 0.17 -2.95 -0.30 0.00 -0.40 0.00 0.00 41.96 38.47 2k23 s TYR 100 CO 0.61 0.00 1.05 -1.00 -1.57 0.00 0.00 175.55 174.64 2k23 h PRO 101 N 6.85 0.54 0.00 -1.71 0.13 -1.91 -3.32 132.00 132.57 2k23 h PRO 101 Ca -0.39 -0.77 -0.12 0.00 -0.87 0.00 0.00 66.00 63.85 2k23 h PRO 101 Cb 1.20 0.26 -0.02 0.00 0.13 0.00 0.00 31.00 32.57 2k23 h PRO 101 CO 0.77 1.35 -0.56 0.37 -0.23 0.00 0.00 178.00 179.69 2k23 h GLN 102 N 0.11 0.00 -6.25 0.86 4.15 -1.94 -3.44 115.11 108.60 2k23 h GLN 102 Ca -0.19 0.00 -0.55 0.00 0.77 0.00 0.00 58.65 58.68 2k23 h GLN 102 Cb 1.87 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 29.52 2k23 h GLN 102 CO 0.22 0.56 1.25 0.42 -1.93 0.00 0.00 178.83 179.35 2k23 s ILE 103 N -2.94 3.54 0.22 2.39 1.09 -1.25 -2.17 121.20 122.09 2k23 s ILE 103 Ca 0.04 0.50 -0.08 0.00 -1.10 0.00 0.00 60.65 60.01 2k23 s ILE 103 Cb 0.08 -3.88 0.19 0.00 -1.06 0.00 0.00 42.46 37.78 2k23 s ILE 103 CO 0.75 -0.66 1.85 1.56 -0.10 0.00 0.00 174.94 178.34 2k23 h GLN 104 N 12.90 1.19 -1.06 2.79 1.08 -0.85 -3.46 115.11 127.70 2k23 h GLN 104 Ca -0.30 -0.13 0.26 0.00 -1.45 0.00 0.00 58.65 57.03 2k23 h GLN 104 Cb 1.15 -0.23 -0.26 0.00 -0.05 0.00 0.00 27.48 28.08 2k23 h GLN 104 CO 1.10 0.87 0.96 -1.54 -0.95 0.00 0.00 178.83 179.27 2k23 s SER 105 N -6.17 -0.03 -0.24 1.46 1.04 -1.24 -5.01 113.70 103.51 2k23 s SER 105 Ca -0.13 0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.34 2k23 s SER 105 Cb 0.16 0.03 0.06 0.00 0.10 0.00 0.00 66.02 66.37 2k23 s SER 105 CO 0.82 -0.03 -0.04 -0.47 0.98 0.00 0.00 173.24 174.50 2k23 s TYR 106 N -1.22 2.36 -0.07 5.02 6.14 -1.26 -1.81 117.35 126.51 2k23 s TYR 106 Ca 0.09 -1.77 0.02 0.00 0.64 0.00 0.00 57.07 56.06 2k23 s TYR 106 Cb -0.01 -1.61 0.02 0.00 0.42 0.00 0.00 41.96 40.77 2k23 s TYR 106 CO -0.07 -0.78 -0.11 -0.51 0.64 0.00 0.00 175.55 174.72 2k23 s ASP 107 N 1.41 1.75 -0.04 4.32 1.01 -0.89 -4.28 116.67 119.94 2k23 s ASP 107 Ca -0.04 -0.28 0.05 0.00 0.71 0.00 0.00 52.55 52.98 2k23 s ASP 107 Cb -0.19 -0.79 -0.01 0.00 1.01 0.00 0.00 42.92 42.94 2k23 s ASP 107 CO -0.07 0.01 -0.20 0.68 0.21 0.00 0.00 175.17 175.80 2k23 s VAL 108 N 0.81 1.64 0.13 -1.27 -7.23 -0.42 0.30 120.40 114.36 2k23 s VAL 108 Ca -0.12 -0.84 0.10 0.00 -1.81 0.00 0.00 61.98 59.31 2k23 s VAL 108 Cb -0.15 -1.39 -0.04 0.00 0.56 0.00 0.00 36.38 35.35 2k23 s VAL 108 CO 0.02 0.47 -0.25 -1.10 -0.31 0.00 0.00 175.10 173.92 2k23 s GLN 109 N -0.11 1.36 -0.17 4.82 -1.52 0.40 -0.07 119.66 124.37 2k23 s GLN 109 Ca -0.02 -1.33 -0.05 0.00 -1.95 0.00 0.00 55.36 52.01 2k23 s GLN 109 Cb -0.11 -1.79 -0.03 0.00 -0.22 0.00 0.00 33.01 30.86 2k23 s GLN 109 CO 0.02 0.42 -0.00 0.08 -0.25 0.00 0.00 175.29 175.56 2k23 s VAL 110 N -1.16 4.18 -0.02 1.09 1.01 -1.25 0.66 120.40 124.91 2k23 s VAL 110 Ca 0.13 -0.25 -0.24 0.00 0.00 0.00 0.00 61.98 61.62 2k23 s VAL 110 Cb -0.10 -2.86 -0.18 0.00 0.00 0.00 0.00 36.38 33.25 2k23 s VAL 110 CO 0.06 0.48 1.15 0.00 0.00 0.00 0.00 175.10 176.78 2k23 h ALA 111 N 6.75 -0.20 -2.89 5.51 0.00 -0.61 -2.13 119.26 125.68 2k23 h ALA 111 Ca -0.33 -0.22 -0.23 0.00 0.00 0.00 0.00 54.91 54.13 2k23 h ALA 111 Cb 1.18 0.08 -0.33 0.00 0.00 0.00 0.00 17.79 18.72 2k23 h ALA 111 CO 0.65 -0.37 -0.55 -0.51 0.00 0.00 0.00 179.25 178.46 2k23 s ASP 112 N -5.42 0.45 -0.01 0.00 1.01 -1.24 -4.15 116.67 107.32 2k23 s ASP 112 Ca -0.14 0.52 0.07 0.00 0.71 0.00 0.00 52.55 53.70 2k23 s ASP 112 Cb 0.02 0.62 -0.02 0.00 1.01 0.00 0.00 42.92 44.54 2k23 s ASP 112 CO 0.57 -0.24 -0.21 0.28 0.21 0.00 0.00 175.17 175.78 2k23 s THR 113 N 2.40 1.63 0.07 -1.27 -1.32 -1.26 -1.90 115.64 113.98 2k23 s THR 113 Ca 0.02 -0.93 -0.03 0.00 -1.21 0.00 0.00 61.69 59.53 2k23 s THR 113 Cb -0.12 -1.37 -0.03 0.00 -1.51 0.00 0.00 72.50 69.47 2k23 s THR 113 CO -0.08 0.42 0.04 -0.62 -2.21 0.00 0.00 174.62 172.17 2k23 s ASP 114 N -0.60 0.37 0.39 8.08 2.15 -1.26 -4.99 116.67 120.82 2k23 s ASP 114 Ca 0.08 -0.93 0.20 0.00 0.43 0.00 0.00 52.55 52.33 2k23 s ASP 114 Cb -0.08 0.25 0.71 0.00 -0.30 0.00 0.00 42.92 43.50 2k23 s ASP 114 CO -0.00 -0.65 1.74 0.10 -0.17 0.00 0.00 175.17 176.18 2k23 h TYR 115 N 3.01 0.00 0.00 -5.34 -0.00 -1.98 -3.36 116.97 109.31 2k23 h TYR 115 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.39 2k23 h TYR 115 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.89 2k23 h TYR 115 CO 0.49 0.33 -0.90 -3.47 -0.00 0.00 0.00 178.16 174.61 2k23 n ASP 116 N -3.46 4.06 -3.76 0.10 2.03 -1.26 -4.84 116.55 109.42 2k23 n ASP 116 Ca 0.00 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 2k23 n ASP 116 Cb 0.50 0.23 0.24 0.00 -0.72 0.00 0.00 41.12 41.37 2k23 n ASP 116 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2k23 s GLN 117 N -1.90 -1.21 0.11 -0.67 2.00 -1.26 -4.40 119.66 112.33 2k23 s GLN 117 Ca 0.00 -0.15 -0.00 0.00 -2.00 0.00 0.00 55.36 53.20 2k23 s GLN 117 Cb 0.00 -1.61 -0.04 0.00 0.80 0.00 0.00 33.01 32.16 2k23 s GLN 117 CO 0.00 -3.69 0.28 -0.59 -0.50 0.00 0.00 175.29 170.79 2k23 s PHE 118 N -3.09 3.50 -0.05 1.67 -0.71 -1.26 -4.33 117.98 113.71 2k23 s PHE 118 Ca 0.72 0.29 0.06 0.00 -1.04 0.00 0.00 56.93 56.96 2k23 s PHE 118 Cb -0.08 -1.80 -0.01 0.00 -1.21 0.00 0.00 43.02 39.92 2k23 s PHE 118 CO 0.56 0.52 -0.24 0.00 -1.34 0.00 0.00 175.22 174.72 2k23 s ALA 119 N -1.63 2.04 -0.21 1.99 0.00 0.87 -4.35 121.76 120.46 2k23 s ALA 119 Ca 0.36 -0.99 -0.05 0.00 0.00 0.00 0.00 51.96 51.28 2k23 s ALA 119 Cb -0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 2k23 s ALA 119 CO 0.28 0.41 -0.01 -1.64 0.00 0.00 0.00 175.76 174.80 2k23 s MET 120 N -0.21 3.56 -0.07 0.00 -1.94 -0.80 -0.39 119.30 119.45 2k23 s MET 120 Ca -0.01 -0.54 0.04 0.00 -1.71 0.00 0.00 55.69 53.46 2k23 s MET 120 Cb -0.13 -3.08 0.00 0.00 2.01 0.00 0.00 34.83 33.64 2k23 s MET 120 CO 0.03 -0.05 -0.20 0.08 -0.01 0.00 0.00 175.02 174.87 2k23 s VAL 121 N 1.15 1.69 -0.29 -6.03 1.01 -0.75 -0.05 120.40 117.13 2k23 s VAL 121 Ca 0.03 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.02 2k23 s VAL 121 Cb -0.14 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2k23 s VAL 121 CO 0.01 0.48 0.42 0.12 0.00 0.00 0.00 175.10 176.13 2k23 s PHE 122 N 0.27 3.23 -0.24 5.22 2.19 0.21 1.00 117.98 129.86 2k23 s PHE 122 Ca -0.12 0.36 -0.07 0.00 0.33 0.00 0.00 56.93 57.43 2k23 s PHE 122 Cb -0.15 -2.67 -0.03 0.00 -1.31 0.00 0.00 43.02 38.86 2k23 s PHE 122 CO 0.05 -0.31 0.05 -0.06 1.83 0.00 0.00 175.22 176.78 2k23 s PHE 123 N 2.16 3.07 -0.18 10.12 0.40 0.19 -0.45 117.98 133.28 2k23 s PHE 123 Ca 0.16 -0.47 -0.06 0.00 -0.60 0.00 0.00 56.93 55.96 2k23 s PHE 123 Cb -0.16 -2.21 -0.03 0.00 0.51 0.00 0.00 43.02 41.13 2k23 s PHE 123 CO 0.11 -0.36 0.03 -1.14 0.70 0.00 0.00 175.22 174.56 2k23 s GLN 124 N 1.52 3.83 -0.20 0.44 0.74 0.15 -1.30 119.66 124.83 2k23 s GLN 124 Ca 0.06 -0.42 0.01 0.00 0.05 0.00 0.00 55.36 55.06 2k23 s GLN 124 Cb -0.15 -3.13 0.05 0.00 1.10 0.00 0.00 33.01 30.87 2k23 s GLN 124 CO 0.03 0.20 -0.09 0.21 -0.55 0.00 0.00 175.29 175.09 2k23 s LYS 125 N 0.55 1.87 -0.09 1.67 2.20 0.16 -2.10 119.74 123.99 2k23 s LYS 125 Ca 0.01 -0.83 0.02 0.00 -0.36 0.00 0.00 55.97 54.82 2k23 s LYS 125 Cb -0.13 -2.39 -0.01 0.00 -1.51 0.00 0.00 37.83 33.78 2k23 s LYS 125 CO 0.02 -0.46 -0.17 0.99 -0.36 0.00 0.00 175.35 175.36 2k23 s THR 126 N 1.43 2.72 -0.21 3.43 2.01 -0.75 0.02 115.64 124.29 2k23 s THR 126 Ca -0.02 -0.81 -0.09 0.00 0.31 0.00 0.00 61.69 61.09 2k23 s THR 126 Cb -0.17 -2.09 0.08 0.00 0.01 0.00 0.00 72.50 70.34 2k23 s THR 126 CO -0.08 0.55 0.47 -0.44 -0.69 0.00 0.00 174.62 174.44 2k23 s SER 127 N 0.01 -0.51 -1.47 3.53 0.01 -0.73 -0.17 113.70 114.37 2k23 s SER 127 Ca -0.06 1.08 -0.07 0.00 1.31 0.00 0.00 55.95 58.21 2k23 s SER 127 Cb -0.15 1.28 0.02 0.00 0.21 0.00 0.00 66.02 67.38 2k23 s SER 127 CO 0.05 -0.22 0.87 1.21 0.41 0.00 0.00 173.24 175.56 2k23 n GLU 128 N 4.94 -6.17 -0.55 12.44 4.07 -0.92 -0.21 120.64 134.24 2k23 n GLU 128 Ca -0.15 0.84 0.00 0.00 -0.06 0.00 0.00 57.16 57.79 2k23 n GLU 128 Cb 0.52 -5.78 0.00 0.00 -0.06 0.00 0.00 31.44 26.12 2k23 n GLU 128 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2k23 n ASN 129 N -2.74 0.00 -4.55 4.31 5.03 -1.26 -4.92 115.26 111.13 2k23 n ASN 129 Ca -0.05 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 54.99 2k23 n ASN 129 Cb 0.59 -1.74 -0.03 0.00 -1.02 0.00 0.00 39.78 37.57 2k23 n ASN 129 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2k23 s LYS 130 N -0.64 3.28 -0.28 3.52 -0.14 0.70 -4.98 119.74 121.20 2k23 s LYS 130 Ca 0.00 -0.14 -0.21 0.00 -1.36 0.00 0.00 55.97 54.26 2k23 s LYS 130 Cb 0.00 -4.13 -0.01 0.00 -1.68 0.00 0.00 37.83 32.00 2k23 s LYS 130 CO 0.00 -1.99 0.65 -0.65 -0.76 0.00 0.00 175.35 172.60 2k23 s GLN 131 N 5.39 3.99 0.01 1.68 -0.21 -1.26 -1.78 119.66 127.49 2k23 s GLN 131 Ca 0.36 0.44 0.08 0.00 0.02 0.00 0.00 55.36 56.26 2k23 s GLN 131 Cb -0.08 -3.70 -0.02 0.00 1.00 0.00 0.00 33.01 30.21 2k23 s GLN 131 CO 0.18 -0.52 -0.24 0.71 -2.12 0.00 0.00 175.29 173.29 2k23 s TYR 132 N 2.61 2.14 0.12 0.91 1.51 0.10 -4.69 117.35 120.05 2k23 s TYR 132 Ca 0.26 -0.40 -0.10 0.00 -1.01 0.00 0.00 57.07 55.82 2k23 s TYR 132 Cb -0.15 -1.33 0.01 0.00 -0.11 0.00 0.00 41.96 40.38 2k23 s TYR 132 CO 0.10 0.04 0.26 -0.59 -1.11 0.00 0.00 175.55 174.26 2k23 s PHE 133 N -0.68 0.12 0.13 2.71 -0.71 -1.26 0.39 117.98 118.68 2k23 s PHE 133 Ca 0.10 -0.52 -0.16 0.00 -1.04 0.00 0.00 56.93 55.31 2k23 s PHE 133 Cb -0.09 0.02 0.04 0.00 -1.21 0.00 0.00 43.02 41.77 2k23 s PHE 133 CO 0.01 -0.63 0.41 -1.59 -1.34 0.00 0.00 175.22 172.08 2k23 s LYS 134 N -3.87 1.09 -0.08 1.99 -2.85 -0.42 -2.68 119.74 112.91 2k23 s LYS 134 Ca 0.07 -0.71 0.02 0.00 -1.00 0.00 0.00 55.97 54.36 2k23 s LYS 134 Cb 0.04 0.48 -0.02 0.00 -2.06 0.00 0.00 37.83 36.26 2k23 s LYS 134 CO -0.09 -0.43 -0.14 0.54 0.10 0.00 0.00 175.35 175.33 2k23 s VAL 135 N -3.81 3.05 0.28 1.79 0.11 0.37 0.53 120.40 122.72 2k23 s VAL 135 Ca 0.03 -0.70 0.08 0.00 -2.93 0.00 0.00 61.98 58.46 2k23 s VAL 135 Cb 0.02 -2.22 -0.04 0.00 -1.53 0.00 0.00 36.38 32.61 2k23 s VAL 135 CO -0.12 0.57 0.16 0.42 -3.33 0.00 0.00 175.10 172.80 2k23 s THR 136 N -0.33 3.83 -0.23 5.04 -4.23 0.28 -0.48 115.64 119.51 2k23 s THR 136 Ca 0.03 -1.56 0.01 0.00 -1.18 0.00 0.00 61.69 58.99 2k23 s THR 136 Cb -0.13 -3.17 0.06 0.00 1.34 0.00 0.00 72.50 70.60 2k23 s THR 136 CO 0.02 -0.30 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.50 2k23 s LEU 137 N -3.83 2.77 0.11 4.79 1.98 -0.21 -1.82 118.68 122.47 2k23 s LEU 137 Ca 0.35 -1.17 0.06 0.00 -2.89 0.00 0.00 54.13 50.47 2k23 s LEU 137 Cb -0.06 -1.31 -0.04 0.00 0.66 0.00 0.00 46.19 45.44 2k23 s LEU 137 CO 0.24 -0.20 -0.01 -0.31 -1.89 0.00 0.00 176.35 174.18 2k23 s TYR 138 N 1.30 2.94 0.19 5.38 2.02 0.48 0.44 117.35 130.10 2k23 s TYR 138 Ca -0.06 -0.06 -0.06 0.00 -0.37 0.00 0.00 57.07 56.52 2k23 s TYR 138 Cb -0.19 -1.50 -0.02 0.00 -0.40 0.00 0.00 41.96 39.86 2k23 s TYR 138 CO -0.06 0.48 0.24 0.20 -1.57 0.00 0.00 175.55 174.84 2k23 s GLY 139 N -2.42 0.89 0.38 0.71 0.00 0.63 -0.09 107.32 107.42 2k23 s GLY 139 Ca 0.26 -1.25 0.05 0.00 0.00 0.00 0.00 44.72 43.78 2k23 s GLY 139 CO 0.18 -1.06 2.01 0.07 0.00 0.00 0.00 173.10 174.30 2k23 h ARG 140 N 2.55 0.64 0.00 2.90 0.11 -1.77 -2.15 114.38 116.67 2k23 h ARG 140 Ca -0.32 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 59.70 2k23 h ARG 140 Cb 1.24 -0.14 0.00 0.00 1.11 0.00 0.00 29.97 32.18 2k23 h ARG 140 CO 0.49 0.46 0.00 -2.37 0.10 0.00 0.00 179.97 178.64 2k23 n THR 141 N -4.43 0.00 1.66 0.08 5.66 -1.26 -4.69 114.28 111.30 2k23 n THR 141 Ca 0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 2k23 n THR 141 Cb 0.08 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.86 2k23 n THR 141 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2k23 n LYS 142 N 0.00 0.84 -2.86 1.09 4.76 -1.26 -4.27 118.16 116.46 2k23 n LYS 142 Ca 0.00 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.09 2k23 n LYS 142 Cb 0.00 -1.01 -0.01 0.00 -1.84 0.00 0.00 35.03 32.17 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 0.33 5.73 3.39 0.72 0.00 -1.26 -4.98 105.19 109.13 2k23 n GLY 143 Ca 0.00 -2.68 -0.33 0.00 0.00 0.00 0.00 46.02 43.01 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 -3.69 2.76 0.70 0.99 1.43 -1.26 -4.95 118.68 114.66 2k23 s LEU 144 Ca 0.42 -0.30 -0.16 0.00 -1.03 0.00 0.00 54.13 53.06 2k23 s LEU 144 Cb 0.20 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 2k23 s LEU 144 CO -0.09 0.19 0.85 -1.20 0.23 0.00 0.00 176.35 176.32 2k23 n SER 145 N 3.39 0.06 0.24 2.29 7.64 -1.26 -4.88 113.62 121.10 2k23 n SER 145 Ca -0.18 0.67 0.11 0.00 1.01 0.00 0.00 58.87 60.48 2k23 n SER 145 Cb 0.53 -1.35 0.60 0.00 -1.01 0.00 0.00 64.21 62.98 2k23 n SER 145 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2k23 h ASP 146 N -0.18 0.00 -0.38 6.43 3.58 -2.00 -2.77 116.42 121.10 2k23 h ASP 146 Ca -0.47 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 56.97 2k23 h ASP 146 Cb 1.34 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.38 2k23 h ASP 146 CO 0.46 0.18 0.20 -0.08 -2.88 0.00 0.00 179.24 177.12 2k23 h GLU 147 N 0.00 0.54 -0.01 0.28 4.57 -2.00 -2.47 114.58 115.49 2k23 h GLU 147 Ca -0.00 -0.07 -0.15 0.00 -1.18 0.00 0.00 59.36 57.96 2k23 h GLU 147 Cb 0.53 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2k23 h GLU 147 CO 0.02 0.45 -0.68 1.37 -1.18 0.00 0.00 179.01 178.99 2k23 h LEU 148 N 0.48 0.09 -0.00 1.64 8.10 -1.85 -1.89 115.31 121.88 2k23 h LEU 148 Ca 0.13 -0.06 -0.03 0.00 0.11 0.00 0.00 57.88 58.03 2k23 h LEU 148 Cb 0.07 -0.03 0.00 0.00 -0.44 0.00 0.00 40.66 40.27 2k23 h LEU 148 CO -0.02 0.74 -0.12 0.07 -4.11 0.00 0.00 178.44 175.01 2k23 h LYS 149 N 0.05 0.09 -0.57 0.17 2.10 -1.49 -2.16 116.57 114.76 2k23 h LYS 149 Ca -0.01 -0.09 0.11 0.00 -2.00 0.00 0.00 60.65 58.66 2k23 h LYS 149 Cb 1.21 0.02 -0.03 0.00 -0.90 0.00 0.00 32.23 32.53 2k23 h LYS 149 CO 0.09 0.84 0.39 1.49 -2.00 0.00 0.00 179.45 180.26 2k23 h GLU 150 N -0.63 0.28 -0.56 0.07 4.81 -1.49 0.48 114.58 117.54 2k23 h GLU 150 Ca -0.01 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 2k23 h GLU 150 Cb 0.87 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 2k23 h GLU 150 CO 0.02 0.19 0.14 -0.09 -0.73 0.00 0.00 179.01 178.54 2k23 h ARG 151 N 0.29 0.85 -0.35 1.92 2.43 -1.15 -1.92 114.38 116.45 2k23 h ARG 151 Ca 0.27 -0.17 -0.09 0.00 -0.81 0.00 0.00 59.98 59.17 2k23 h ARG 151 Cb 0.66 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 2k23 h ARG 151 CO -0.06 0.76 -0.14 0.27 -1.51 0.00 0.00 179.97 179.29 2k23 h PHE 152 N 0.82 0.81 -0.86 2.20 -5.15 -0.26 -1.91 116.94 112.60 2k23 h PHE 152 Ca 0.18 -0.19 0.01 0.00 -0.20 0.00 0.00 57.97 57.77 2k23 h PHE 152 Cb 0.29 -0.19 -0.04 0.00 0.22 0.00 0.00 35.95 36.23 2k23 h PHE 152 CO 0.02 0.90 0.56 -0.39 -2.00 0.00 0.00 178.31 177.40 2k23 h VAL 153 N 0.49 1.22 -0.77 0.88 -1.51 -1.18 0.91 116.25 116.29 2k23 h VAL 153 Ca 0.08 -0.41 -0.03 0.00 -1.23 0.00 0.00 66.70 65.10 2k23 h VAL 153 Cb 0.67 -0.04 -0.04 0.00 -2.13 0.00 0.00 31.29 29.75 2k23 h VAL 153 CO 0.05 0.22 0.35 0.28 -1.23 0.00 0.00 177.57 177.23 2k23 h SER 154 N 1.17 1.02 0.32 4.19 0.02 -1.15 -0.37 113.55 118.74 2k23 h SER 154 Ca 0.31 -0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 2k23 h SER 154 Cb -0.13 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.14 2k23 h SER 154 CO -0.07 0.87 -0.32 0.15 -1.14 0.00 0.00 176.83 176.32 2k23 h PHE 155 N 1.10 0.01 -0.76 3.45 3.57 -0.28 -2.08 116.94 121.96 2k23 h PHE 155 Ca 0.26 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.81 2k23 h PHE 155 Cb 0.14 -0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.82 2k23 h PHE 155 CO 0.01 0.33 0.46 0.00 -2.23 0.00 0.00 178.31 176.89 2k23 h ALA 156 N 1.67 1.01 0.00 2.41 0.00 0.86 -0.97 119.26 124.24 2k23 h ALA 156 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2k23 h ALA 156 Cb 0.58 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k23 h ALA 156 CO 0.04 0.21 -0.08 0.87 0.00 0.00 0.00 179.25 180.28 2k23 h LYS 157 N 0.87 0.00 -0.30 0.00 6.56 -1.06 -2.25 116.57 120.39 2k23 h LYS 157 Ca 0.32 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.86 2k23 h LYS 157 Cb 0.11 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.75 2k23 h LYS 157 CO -0.15 0.08 -0.05 1.03 -2.06 0.00 0.00 179.45 178.30 2k23 h SER 158 N 0.00 0.45 1.68 0.86 0.87 -0.54 -0.72 113.55 116.16 2k23 h SER 158 Ca -0.00 -0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.40 2k23 h SER 158 Cb 0.78 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2k23 h SER 158 CO 0.01 0.56 -0.32 -0.07 -0.53 0.00 0.00 176.83 176.49 2k23 h LEU 159 N 0.46 0.00 0.00 2.23 -0.00 -1.37 -3.48 115.31 113.15 2k23 h LEU 159 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2k23 h LEU 159 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.04 2k23 h LEU 159 CO 0.02 0.30 0.00 0.61 -0.00 0.00 0.00 178.44 179.36 2k23 n GLY 160 N 1.18 1.15 3.78 0.83 0.00 -0.28 -4.67 105.19 107.19 2k23 n GLY 160 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 2.52 0.16 0.99 1.43 -0.86 -4.28 118.68 118.64 2k23 s LEU 161 Ca 0.00 -1.47 0.09 0.00 -1.03 0.00 0.00 54.13 51.72 2k23 s LEU 161 Cb 0.00 -0.93 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 2k23 s LEU 161 CO 0.00 -0.85 -0.20 -1.59 0.23 0.00 0.00 176.35 173.94 2k23 s LYS 162 N -3.97 1.29 0.56 1.70 -2.85 -1.26 -3.99 119.74 111.22 2k23 s LYS 162 Ca 0.19 -1.38 0.36 0.00 -1.00 0.00 0.00 55.97 54.14 2k23 s LYS 162 Cb 0.02 -1.44 1.50 0.00 -2.06 0.00 0.00 37.83 35.85 2k23 s LYS 162 CO 0.11 0.31 1.74 -0.44 0.10 0.00 0.00 175.35 177.16 2k23 h ASP 163 N 3.41 0.00 0.30 0.03 3.32 -1.93 -0.69 116.42 120.87 2k23 h ASP 163 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2k23 h ASP 163 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2k23 h ASP 163 CO 0.48 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.59 2k23 n ASN 164 N -3.99 0.16 -0.77 6.45 3.02 -1.26 -1.43 115.26 117.44 2k23 n ASN 164 Ca 0.25 0.55 0.05 0.00 -0.03 0.00 0.00 54.58 55.40 2k23 n ASN 164 Cb 1.28 -0.58 0.10 0.00 -0.61 0.00 0.00 39.78 39.97 2k23 n ASN 164 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2k23 n ASN 165 N -1.69 1.28 -4.02 6.41 4.13 -0.27 -4.82 115.26 116.29 2k23 n ASN 165 Ca 0.02 -2.79 -0.31 0.00 1.68 0.00 0.00 54.58 53.17 2k23 n ASN 165 Cb 0.10 -0.38 -0.15 0.00 -1.54 0.00 0.00 39.78 37.82 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 -1.53 2.11 0.50 2.41 1.01 -0.52 0.13 121.20 125.31 2k23 s ILE 166 Ca 0.28 -1.91 0.09 0.00 0.00 0.00 0.00 60.65 59.12 2k23 s ILE 166 Cb 0.29 -2.39 0.05 0.00 0.01 0.00 0.00 42.46 40.42 2k23 s ILE 166 CO -0.07 -0.32 0.68 0.68 0.00 0.00 0.00 174.94 175.92 2k23 s VAL 167 N 1.06 2.56 0.26 2.92 -7.23 0.91 -4.94 120.40 115.95 2k23 s VAL 167 Ca 0.01 -1.00 0.11 0.00 -1.81 0.00 0.00 61.98 59.29 2k23 s VAL 167 Cb -0.19 -2.56 -0.05 0.00 0.56 0.00 0.00 36.38 34.14 2k23 s VAL 167 CO -0.07 0.00 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.18 2k23 s PHE 168 N -2.51 2.14 -0.32 2.82 0.08 -1.26 -2.23 117.98 116.69 2k23 s PHE 168 Ca 0.59 -0.41 -0.31 0.00 0.12 0.00 0.00 56.93 56.91 2k23 s PHE 168 Cb -0.08 -0.96 -0.09 0.00 -0.57 0.00 0.00 43.02 41.32 2k23 s PHE 168 CO 0.36 0.61 2.24 -1.13 -0.10 0.00 0.00 175.22 177.20 2k23 n SER 169 N -0.57 2.57 -4.61 1.36 3.41 -1.20 -4.78 113.62 109.81 2k23 n SER 169 Ca -0.06 0.24 -0.41 0.00 -0.26 0.00 0.00 58.87 58.38 2k23 n SER 169 Cb 0.60 -1.40 -0.06 0.00 -0.26 0.00 0.00 64.21 63.09 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 8.18 4.90 -0.84 -3.33 1.01 -1.26 -4.85 120.40 124.21 2k23 s VAL 170 Ca 1.06 1.03 -0.25 0.00 0.00 0.00 0.00 61.98 63.81 2k23 s VAL 170 Cb -0.60 -4.04 -0.10 0.00 0.00 0.00 0.00 36.38 31.65 2k23 s VAL 170 CO 0.41 -0.15 2.21 -2.84 0.00 0.00 0.00 175.10 174.74 2k23 s PRO 171 N 2.71 2.02 0.53 2.72 0.02 -1.26 -1.71 135.00 140.03 2k23 s PRO 171 Ca 0.28 0.15 -0.13 0.00 0.02 0.00 0.00 61.00 61.32 2k23 s PRO 171 Cb -0.15 -4.91 -0.06 0.00 0.02 0.00 0.00 34.50 29.41 2k23 s PRO 171 CO 0.11 -3.98 0.95 -0.08 -0.33 0.00 0.00 177.00 173.67 2k23 s THR 172 N 12.73 4.67 -1.10 0.99 -1.32 -1.26 -4.97 115.64 125.39 2k23 s THR 172 Ca 0.83 0.91 -0.22 0.00 -1.21 0.00 0.00 61.69 62.00 2k23 s THR 172 Cb -0.10 -3.79 0.05 0.00 -1.51 0.00 0.00 72.50 67.15 2k23 s THR 172 CO 0.04 -0.83 1.54 -0.62 -2.21 0.00 0.00 174.62 172.54 2k23 s ASP 173 N -3.56 6.56 -0.01 8.08 2.15 -1.26 -4.89 116.67 123.74 2k23 s ASP 173 Ca 0.55 -1.71 -0.16 0.00 0.43 0.00 0.00 52.55 51.66 2k23 s ASP 173 Cb -0.10 -2.57 0.03 0.00 -0.30 0.00 0.00 42.92 39.97 2k23 s ASP 173 CO 0.40 -1.45 0.34 -1.58 -0.17 0.00 0.00 175.17 172.71 2k23 s GLN 174 N 4.82 0.72 -0.96 4.34 0.74 -1.26 -5.01 119.66 123.04 2k23 s GLN 174 Ca 0.49 -0.19 -0.08 0.00 0.05 0.00 0.00 55.36 55.62 2k23 s GLN 174 Cb 0.01 0.32 -0.16 0.00 1.10 0.00 0.00 33.01 34.28 2k23 s GLN 174 CO -0.05 -0.20 3.21 0.00 -0.55 0.00 0.00 175.29 177.69 2k23 n ILE 176 N 3.16 4.12 -3.47 0.00 3.06 -1.26 -4.70 119.36 120.27 2k23 n ILE 176 Ca 0.64 -2.90 -0.29 0.00 -2.50 0.00 0.00 62.75 57.70 2k23 n ILE 176 Cb 0.50 -2.57 -0.12 0.00 0.54 0.00 0.00 39.64 37.99 2k23 n ILE 176 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2k23 s ASP 177 N 2.32 2.82 0.00 9.51 -1.08 -1.26 -4.93 116.67 124.05 2k23 s ASP 177 Ca 0.61 -2.34 0.21 0.00 -0.52 0.00 0.00 52.55 50.50 2k23 s ASP 177 Cb 0.16 -0.46 0.16 0.00 -1.46 0.00 0.00 42.92 41.33 2k23 s ASP 177 CO -0.07 -0.29 1.16 -3.20 0.52 0.00 0.00 175.17 173.29