#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k23 s ASP 2 N 0.00 5.98 -0.33 1.08 1.01 -1.26 -4.23 116.67 118.92 2k23 s ASP 2 Ca 0.00 -0.92 -0.09 0.00 0.71 0.00 0.00 52.55 52.25 2k23 s ASP 2 Cb 0.00 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.38 2k23 s ASP 2 CO 0.00 -1.96 0.26 -1.54 0.21 0.00 0.00 175.17 172.14 2k23 n SER 3 N 10.63 -7.69 -4.51 0.27 3.41 -1.26 -5.00 113.62 109.47 2k23 n SER 3 Ca 0.29 0.90 -0.34 0.00 -0.26 0.00 0.00 58.87 59.46 2k23 n SER 3 Cb 0.50 -4.72 -0.12 0.00 -0.26 0.00 0.00 64.21 59.61 2k23 n SER 3 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2k23 s THR 4 N -1.90 4.11 -1.36 6.66 2.01 -1.26 -4.66 115.64 119.24 2k23 s THR 4 Ca 0.12 -0.27 -0.03 0.00 0.31 0.00 0.00 61.69 61.82 2k23 s THR 4 Cb -0.03 -2.83 0.03 0.00 0.01 0.00 0.00 72.50 69.67 2k23 s THR 4 CO 0.71 0.46 0.07 0.00 -0.69 0.00 0.00 174.62 175.17 2k23 n GLN 5 N 3.78 -0.92 -4.67 4.92 10.64 -1.26 -4.91 117.38 124.95 2k23 n GLN 5 Ca -0.17 0.08 -0.32 0.00 -1.83 0.00 0.00 57.00 54.77 2k23 n GLN 5 Cb 0.52 -3.18 -0.08 0.00 -0.86 0.00 0.00 30.24 26.65 2k23 n GLN 5 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 2k23 s ASN 6 N -4.02 4.13 0.14 2.61 2.47 -1.26 -5.12 114.94 113.88 2k23 s ASN 6 Ca 0.09 -1.57 -0.20 0.00 0.42 0.00 0.00 52.86 51.60 2k23 s ASN 6 Cb -0.05 0.35 -0.07 0.00 -1.45 0.00 0.00 41.25 40.03 2k23 s ASN 6 CO 0.86 -0.80 0.65 -1.48 -3.72 0.00 0.00 177.10 172.61 2k23 s LEU 7 N -3.88 4.48 0.80 3.21 0.05 -1.26 -5.08 118.68 117.01 2k23 s LEU 7 Ca 0.13 1.37 -0.12 0.00 0.05 0.00 0.00 54.13 55.56 2k23 s LEU 7 Cb 0.03 -3.19 0.07 0.00 -2.05 0.00 0.00 46.19 41.05 2k23 s LEU 7 CO 0.07 0.19 1.12 -0.63 -0.55 0.00 0.00 176.35 176.54 2k23 s ILE 8 N -1.25 2.75 -0.11 1.48 1.01 -1.26 -4.84 121.20 118.98 2k23 s ILE 8 Ca 0.35 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 61.23 2k23 s ILE 8 Cb -0.19 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 2k23 s ILE 8 CO 0.21 -0.32 0.50 -2.65 0.00 0.00 0.00 174.94 172.68 2k23 n PRO 9 N -3.39 0.00 -2.58 2.79 -0.02 -1.26 -4.82 135.00 125.72 2k23 n PRO 9 Ca 0.07 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.12 2k23 n PRO 9 Cb 0.58 -0.37 -0.02 0.00 -0.02 0.00 0.00 33.50 33.67 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 3.22 0.03 3.55 0.00 -1.26 -4.55 121.76 122.75 2k23 s ALA 10 Ca 0.14 -0.34 -0.08 0.00 0.00 0.00 0.00 51.96 51.68 2k23 s ALA 10 Cb -0.09 -3.85 -0.05 0.00 0.00 0.00 0.00 23.12 19.13 2k23 s ALA 10 CO 0.06 -2.09 0.31 -1.25 0.00 0.00 0.00 175.76 172.79 2k23 s PRO 11 N 4.32 3.65 0.70 0.00 0.04 -1.26 -5.11 135.00 137.33 2k23 s PRO 11 Ca 0.49 0.02 -0.09 0.00 0.04 0.00 0.00 61.00 61.46 2k23 s PRO 11 Cb -0.09 -3.06 0.04 0.00 0.04 0.00 0.00 34.50 31.43 2k23 s PRO 11 CO 0.28 0.63 1.04 -1.25 0.04 0.00 0.00 177.00 177.74 2k23 s PRO 12 N -1.75 2.50 0.33 0.56 0.05 -1.26 -4.95 135.00 130.48 2k23 s PRO 12 Ca 0.29 0.06 0.12 0.00 0.05 0.00 0.00 61.00 61.52 2k23 s PRO 12 Cb -0.14 -2.12 1.00 0.00 0.05 0.00 0.00 34.50 33.30 2k23 s PRO 12 CO 0.16 -1.12 1.67 1.25 0.05 0.00 0.00 177.00 179.01 2k23 h LEU 13 N -0.59 0.44 0.00 -3.56 7.12 -1.95 0.38 115.31 117.14 2k23 h LEU 13 Ca -0.45 0.19 0.00 0.00 0.13 0.00 0.00 57.88 57.75 2k23 h LEU 13 Cb 1.29 0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.57 2k23 h LEU 13 CO 0.62 -0.12 0.00 2.30 -0.13 0.00 0.00 178.44 181.12 2k23 n ILE 14 N -5.07 0.86 0.58 4.05 -5.35 -1.26 -0.38 119.36 112.79 2k23 n ILE 14 Ca 0.29 0.21 0.12 0.00 -0.27 0.00 0.00 62.75 63.11 2k23 n ILE 14 Cb 0.91 -1.09 0.14 0.00 -1.74 0.00 0.00 39.64 37.86 2k23 n ILE 14 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2k23 n SER 15 N -1.29 0.67 -4.66 7.28 2.88 0.12 -4.86 113.62 113.77 2k23 n SER 15 Ca 0.04 0.03 -0.35 0.00 -1.33 0.00 0.00 58.87 57.26 2k23 n SER 15 Cb 0.06 0.31 -0.10 0.00 -0.75 0.00 0.00 64.21 63.74 2k23 n SER 15 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2k23 s VAL 16 N -3.17 4.38 0.90 2.46 0.11 0.49 -5.00 120.40 120.58 2k23 s VAL 16 Ca 0.06 -0.21 -0.12 0.00 -2.93 0.00 0.00 61.98 58.78 2k23 s VAL 16 Cb 0.14 -2.88 0.13 0.00 -1.53 0.00 0.00 36.38 32.24 2k23 s VAL 16 CO 0.74 0.57 1.11 -2.16 -3.33 0.00 0.00 175.10 172.02 2k23 s PRO 17 N -0.50 1.22 0.15 1.54 0.04 -1.26 -4.99 135.00 131.20 2k23 s PRO 17 Ca 0.09 0.51 0.09 0.00 0.04 0.00 0.00 61.00 61.73 2k23 s PRO 17 Cb -0.12 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2k23 s PRO 17 CO 0.02 -2.19 -0.21 -1.17 0.04 0.00 0.00 177.00 173.49 2k23 s LEU 18 N -6.10 2.38 -0.39 -3.56 2.96 -1.25 -3.29 118.68 109.43 2k23 s LEU 18 Ca 0.63 -0.80 -0.29 0.00 -0.22 0.00 0.00 54.13 53.46 2k23 s LEU 18 Cb -0.16 -0.94 0.01 0.00 0.50 0.00 0.00 46.19 45.60 2k23 s LEU 18 CO 0.55 0.04 1.42 -1.58 -1.32 0.00 0.00 176.35 175.46 2k23 s GLN 19 N -2.43 3.61 0.16 1.98 -0.44 -1.08 -4.84 119.66 116.62 2k23 s GLN 19 Ca 0.14 1.01 -0.30 0.00 -2.50 0.00 0.00 55.36 53.71 2k23 s GLN 19 Cb -0.08 -4.01 -0.07 0.00 -1.64 0.00 0.00 33.01 27.21 2k23 s GLN 19 CO 0.06 -1.52 1.03 -2.14 0.50 0.00 0.00 175.29 173.23 2k23 s PRO 20 N 4.87 4.66 -0.21 1.67 0.02 -1.26 -3.46 135.00 141.28 2k23 s PRO 20 Ca 0.62 1.60 -0.01 0.00 0.02 0.00 0.00 61.00 63.22 2k23 s PRO 20 Cb -0.15 -3.31 0.00 0.00 0.02 0.00 0.00 34.50 31.06 2k23 s PRO 20 CO 0.31 0.17 0.18 0.41 -0.33 0.00 0.00 177.00 177.75 2k23 n GLY 21 N 2.05 0.66 3.78 0.52 0.00 -1.26 -5.03 105.19 105.91 2k23 n GLY 21 Ca 0.02 -0.51 -0.38 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 -3.05 3.77 0.03 1.61 5.36 -1.23 -5.07 117.98 119.40 2k23 s PHE 22 Ca 0.08 1.74 0.04 0.00 -0.96 0.00 0.00 56.93 57.82 2k23 s PHE 22 Cb -0.03 -2.87 -0.02 0.00 -0.34 0.00 0.00 43.02 39.75 2k23 s PHE 22 CO 0.11 0.31 -0.12 -1.58 -1.46 0.00 0.00 175.22 172.49 2k23 s TRP 23 N -1.47 1.05 0.18 10.12 0.52 -1.26 -4.98 118.94 123.09 2k23 s TRP 23 Ca 0.46 -0.34 -0.20 0.00 0.02 0.00 0.00 56.10 56.05 2k23 s TRP 23 Cb -0.20 -0.63 0.11 0.00 -1.15 0.00 0.00 33.47 31.60 2k23 s TRP 23 CO 0.25 0.01 1.62 1.79 0.02 0.00 0.00 176.95 180.64 2k23 h THR 24 N 4.58 0.33 0.00 2.01 1.35 -1.99 -1.98 112.91 117.21 2k23 h THR 24 Ca -0.36 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.45 2k23 h THR 24 Cb 1.18 0.33 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 2k23 h THR 24 CO 0.44 0.00 -0.22 -0.08 -0.25 0.00 0.00 175.52 175.42 2k23 h GLU 25 N -0.15 0.00 0.00 4.72 4.81 -1.98 -3.19 114.58 118.79 2k23 h GLU 25 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2k23 h GLU 25 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2k23 h GLU 25 CO -0.54 0.22 0.00 -2.13 -0.73 0.00 0.00 179.01 175.83 2k23 n ARG 26 N -3.26 0.05 -0.65 1.92 3.00 -0.76 -2.36 116.66 114.61 2k23 n ARG 26 Ca 0.01 0.10 0.01 0.00 -0.00 0.00 0.00 57.85 57.98 2k23 n ARG 26 Cb 0.50 -1.57 0.20 0.00 0.00 0.00 0.00 32.46 31.59 2k23 n ARG 26 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2k23 n PHE 27 N -1.66 0.67 -4.24 -0.14 7.35 -1.15 -4.70 117.46 113.59 2k23 n PHE 27 Ca 0.06 -1.45 -0.35 0.00 -0.76 0.00 0.00 57.45 54.95 2k23 n PHE 27 Cb 0.32 -0.38 -0.08 0.00 0.35 0.00 0.00 39.48 39.69 2k23 n PHE 27 CO 0.00 0.00 0.00 -1.14 -0.76 0.00 0.00 176.76 174.86 2k23 s GLN 28 N -3.17 3.06 0.00 -4.13 0.74 -1.00 -4.72 119.66 110.45 2k23 s GLN 28 Ca 0.41 -0.38 0.00 0.00 0.05 0.00 0.00 55.36 55.44 2k23 s GLN 28 Cb 0.38 -2.86 0.00 0.00 1.10 0.00 0.00 33.01 31.62 2k23 s GLN 28 CO -0.01 0.70 0.00 0.41 -0.55 0.00 0.00 175.29 175.84 2k23 n GLY 29 N 1.91 0.68 3.62 2.59 0.00 0.71 -4.97 105.19 109.74 2k23 n GLY 29 Ca -0.18 -2.13 -0.41 0.00 0.00 0.00 0.00 46.02 43.30 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 -0.79 4.06 -0.14 1.61 3.00 -1.26 -1.59 118.95 123.84 2k23 s ARG 30 Ca 0.00 0.51 0.02 0.00 0.00 0.00 0.00 55.73 56.26 2k23 s ARG 30 Cb 0.00 -3.67 0.02 0.00 0.00 0.00 0.00 34.95 31.30 2k23 s ARG 30 CO 0.00 -0.46 -0.18 -1.58 0.00 0.00 0.00 175.30 173.07 2k23 s TRP 31 N 2.56 2.42 -0.05 -0.53 0.51 -1.04 -4.44 118.94 118.38 2k23 s TRP 31 Ca 0.27 -1.27 -0.11 0.00 -2.12 0.00 0.00 56.10 52.86 2k23 s TRP 31 Cb -0.15 -1.69 -0.05 0.00 -0.81 0.00 0.00 33.47 30.77 2k23 s TRP 31 CO 0.09 -0.63 0.30 -0.06 -0.51 0.00 0.00 176.95 176.14 2k23 s PHE 32 N 1.08 3.68 -0.09 -1.98 0.40 0.13 -1.74 117.98 119.45 2k23 s PHE 32 Ca -0.02 0.80 -0.30 0.00 -0.60 0.00 0.00 56.93 56.81 2k23 s PHE 32 Cb -0.14 -2.14 -0.03 0.00 0.51 0.00 0.00 43.02 41.21 2k23 s PHE 32 CO -0.06 0.68 1.34 0.08 0.70 0.00 0.00 175.22 177.97 2k23 s VAL 33 N -1.06 4.04 -0.27 -0.44 1.01 -1.10 -0.75 120.40 121.83 2k23 s VAL 33 Ca 0.20 1.32 0.07 0.00 0.00 0.00 0.00 61.98 63.57 2k23 s VAL 33 Cb -0.15 -3.85 -0.09 0.00 0.00 0.00 0.00 36.38 32.30 2k23 s VAL 33 CO 0.10 -0.07 0.28 0.52 0.00 0.00 0.00 175.10 175.92 2k23 n VAL 34 N 5.08 0.00 -3.60 2.92 0.31 0.15 -4.67 118.33 118.52 2k23 n VAL 34 Ca 0.14 -0.30 -0.08 0.00 -0.01 0.00 0.00 64.34 64.09 2k23 n VAL 34 Cb 0.44 0.86 -0.02 0.00 -0.91 0.00 0.00 33.84 34.22 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 -1.93 -0.38 -0.19 2.92 0.00 -1.08 -3.51 107.32 103.14 2k23 s GLY 35 Ca 0.02 0.48 -0.15 0.00 0.00 0.00 0.00 44.72 45.06 2k23 s GLY 35 CO 0.30 0.15 0.50 -2.27 0.00 0.00 0.00 173.10 171.77 2k23 s LEU 36 N -2.73 -0.05 -0.09 0.66 2.96 -0.70 -0.62 118.68 118.12 2k23 s LEU 36 Ca 0.07 1.03 -0.04 0.00 -0.22 0.00 0.00 54.13 54.96 2k23 s LEU 36 Cb -0.02 1.69 0.05 0.00 0.50 0.00 0.00 46.19 48.41 2k23 s LEU 36 CO -0.05 -0.18 0.21 0.00 -1.32 0.00 0.00 176.35 175.01 2k23 s ALA 37 N 0.66 -0.43 0.00 5.97 0.00 0.28 0.46 121.76 128.70 2k23 s ALA 37 Ca -0.03 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.79 2k23 s ALA 37 Cb -0.05 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.45 2k23 s ALA 37 CO -0.04 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2k23 n GLY 38 N 4.39 2.44 0.23 0.00 0.00 0.99 0.94 105.19 114.18 2k23 n GLY 38 Ca -0.23 -0.75 0.15 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.12 1.61 -1.24 -1.71 -1.55 115.58 112.57 2k23 h ASN 39 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2k23 h ASN 39 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2k23 h ASN 39 CO 0.00 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.14 2k23 n ALA 40 N -2.04 2.48 -1.93 1.57 0.00 -1.25 -4.92 120.51 114.43 2k23 n ALA 40 Ca 0.02 -0.68 -0.41 0.00 0.00 0.00 0.00 53.44 52.37 2k23 n ALA 40 Cb 0.39 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.87 3.28 -1.20 0.00 1.01 -0.58 -4.93 120.40 116.10 2k23 s VAL 41 Ca 0.33 1.14 -0.22 0.00 0.00 0.00 0.00 61.98 63.23 2k23 s VAL 41 Cb 0.21 -3.73 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 2k23 s VAL 41 CO 0.31 0.21 1.89 -1.10 0.00 0.00 0.00 175.10 176.41 2k23 s GLN 42 N -0.73 2.82 -0.75 2.72 -1.52 -1.26 -4.85 119.66 116.09 2k23 s GLN 42 Ca 0.52 -1.33 -0.02 0.00 -1.95 0.00 0.00 55.36 52.58 2k23 s GLN 42 Cb -0.35 -5.30 0.19 0.00 -0.22 0.00 0.00 33.01 27.32 2k23 s GLN 42 CO 0.41 -3.60 0.59 0.21 -0.25 0.00 0.00 175.29 172.65 2k23 s LYS 43 N 6.00 2.88 -0.00 2.91 2.36 -1.26 -3.05 119.74 129.58 2k23 s LYS 43 Ca 0.65 -2.89 -0.23 0.00 -2.55 0.00 0.00 55.97 50.95 2k23 s LYS 43 Cb 0.00 -3.83 -0.13 0.00 -1.05 0.00 0.00 37.83 32.83 2k23 s LYS 43 CO 0.12 -1.22 0.97 0.93 1.55 0.00 0.00 175.35 177.70 2k23 h GLU 44 N 6.53 -0.77 0.00 4.03 4.39 -1.89 -3.46 114.58 123.40 2k23 h GLU 44 Ca 0.07 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2k23 h GLU 44 Cb 0.89 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 2k23 h GLU 44 CO 0.77 -0.50 0.00 -2.13 -1.16 0.00 0.00 179.01 175.99 2k23 n ARG 45 N -5.31 0.00 0.00 2.33 0.00 -1.26 -5.03 116.66 107.39 2k23 n ARG 45 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 2k23 n ARG 45 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 32.46 32.71 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 -1.48 0.00 -2.95 -0.14 -0.00 -1.26 -5.08 117.38 106.47 2k23 n GLN 46 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.00 57.04 2k23 n GLN 46 Cb 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 30.24 30.13 2k23 n GLN 46 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2k23 s SER 47 N -4.40 -0.11 0.23 2.61 0.01 -1.26 -4.49 113.70 106.28 2k23 s SER 47 Ca 0.00 -0.02 0.23 0.00 1.31 0.00 0.00 55.95 57.47 2k23 s SER 47 Cb 0.00 0.67 0.07 0.00 0.21 0.00 0.00 66.02 66.97 2k23 s SER 47 CO 0.00 -0.02 1.14 -0.09 0.41 0.00 0.00 173.24 174.68 2k23 h ARG 48 N 6.24 0.00 -7.22 12.44 2.43 -1.89 -3.47 114.38 122.92 2k23 h ARG 48 Ca -0.09 0.00 -0.52 0.00 -0.81 0.00 0.00 59.98 58.56 2k23 h ARG 48 Cb 1.20 0.00 0.14 0.00 -0.42 0.00 0.00 29.97 30.89 2k23 h ARG 48 CO -0.13 0.00 0.35 0.12 -1.51 0.00 0.00 179.97 178.80 2k23 s PHE 49 N -3.33 2.26 -0.01 2.20 5.36 -1.23 -4.98 117.98 118.24 2k23 s PHE 49 Ca 0.01 1.61 -0.03 0.00 -0.96 0.00 0.00 56.93 57.56 2k23 s PHE 49 Cb 0.09 -3.29 0.00 0.00 -0.34 0.00 0.00 43.02 39.49 2k23 s PHE 49 CO 0.77 -2.20 0.06 0.95 -1.46 0.00 0.00 175.22 173.34 2k23 s THR 50 N -2.34 0.03 0.40 0.12 -4.23 -1.26 -2.72 115.64 105.63 2k23 s THR 50 Ca 0.69 -0.22 -0.26 0.00 -1.18 0.00 0.00 61.69 60.71 2k23 s THR 50 Cb -0.23 -0.17 -0.09 0.00 1.34 0.00 0.00 72.50 73.35 2k23 s THR 50 CO 0.47 -0.12 1.26 0.00 -0.54 0.00 0.00 174.62 175.69 2k23 s MET 51 N -0.36 4.02 0.30 3.99 0.23 0.19 -4.68 119.30 122.98 2k23 s MET 51 Ca -0.04 2.05 0.03 0.00 -1.03 0.00 0.00 55.69 56.70 2k23 s MET 51 Cb -0.03 -2.75 -0.04 0.00 -1.53 0.00 0.00 34.83 30.48 2k23 s MET 51 CO 0.00 -0.41 0.16 1.52 -2.03 0.00 0.00 175.02 174.26 2k23 s TYR 52 N -1.30 1.58 -0.22 3.16 -0.85 -1.26 -4.74 117.35 113.71 2k23 s TYR 52 Ca 0.56 -1.39 -0.07 0.00 -0.52 0.00 0.00 57.07 55.66 2k23 s TYR 52 Cb -0.36 -0.83 -0.03 0.00 0.38 0.00 0.00 41.96 41.12 2k23 s TYR 52 CO 0.46 -0.55 0.06 -1.12 -1.52 0.00 0.00 175.55 172.88 2k23 s SER 53 N -3.36 5.28 -0.49 -0.18 0.01 -1.26 -2.69 113.70 111.01 2k23 s SER 53 Ca 0.36 -0.11 -0.15 0.00 1.31 0.00 0.00 55.95 57.37 2k23 s SER 53 Cb 0.05 -1.93 0.10 0.00 0.21 0.00 0.00 66.02 64.45 2k23 s SER 53 CO 0.18 0.05 0.42 -0.89 0.41 0.00 0.00 173.24 173.41 2k23 s THR 54 N 1.12 5.09 -0.58 1.44 2.01 -0.71 -2.59 115.64 121.42 2k23 s THR 54 Ca 0.04 -1.29 -0.16 0.00 0.31 0.00 0.00 61.69 60.59 2k23 s THR 54 Cb -0.14 -4.14 0.13 0.00 0.01 0.00 0.00 72.50 68.36 2k23 s THR 54 CO 0.03 -0.69 0.57 -0.63 -0.69 0.00 0.00 174.62 173.21 2k23 s ILE 55 N 1.59 5.18 -0.54 1.82 -1.09 -0.90 -2.49 121.20 124.78 2k23 s ILE 55 Ca 0.04 -1.52 -0.27 0.00 -2.23 0.00 0.00 60.65 56.67 2k23 s ILE 55 Cb -0.26 -4.38 0.03 0.00 -1.58 0.00 0.00 42.46 36.27 2k23 s ILE 55 CO 0.05 -0.93 1.11 -0.31 -1.23 0.00 0.00 174.94 173.62 2k23 s TYR 56 N 1.64 2.71 -0.20 3.97 2.02 -0.62 -0.86 117.35 126.01 2k23 s TYR 56 Ca 0.06 0.38 -0.04 0.00 -0.37 0.00 0.00 57.07 57.11 2k23 s TYR 56 Cb -0.27 -4.37 -0.01 0.00 -0.40 0.00 0.00 41.96 36.91 2k23 s TYR 56 CO 0.02 -1.44 -0.04 -2.00 -1.57 0.00 0.00 175.55 170.52 2k23 s GLU 57 N 4.56 3.45 -0.10 -0.62 2.12 -0.94 -0.21 118.70 126.97 2k23 s GLU 57 Ca 0.41 -0.60 -0.30 0.00 0.36 0.00 0.00 54.97 54.84 2k23 s GLU 57 Cb -0.09 -2.97 -0.02 0.00 0.26 0.00 0.00 34.13 31.31 2k23 s GLU 57 CO 0.26 -0.07 1.10 -1.17 -0.54 0.00 0.00 175.26 174.83 2k23 s LEU 58 N 1.16 4.24 0.51 2.70 2.96 -1.26 0.29 118.68 129.30 2k23 s LEU 58 Ca 0.02 1.64 0.06 0.00 -0.22 0.00 0.00 54.13 55.64 2k23 s LEU 58 Cb -0.14 -3.55 0.05 0.00 0.50 0.00 0.00 46.19 43.04 2k23 s LEU 58 CO -0.01 -0.54 0.71 -1.58 -1.32 0.00 0.00 176.35 173.61 2k23 s GLN 59 N 2.27 2.52 0.61 1.98 0.74 -0.82 -4.92 119.66 122.04 2k23 s GLN 59 Ca 0.51 -1.25 0.31 0.00 0.05 0.00 0.00 55.36 54.98 2k23 s GLN 59 Cb -0.21 -2.64 1.70 0.00 1.10 0.00 0.00 33.01 32.96 2k23 s GLN 59 CO 0.18 -0.62 2.06 1.05 -0.55 0.00 0.00 175.29 177.41 2k23 h GLU 60 N 0.30 0.00 -0.49 1.67 4.11 -1.96 -1.88 114.58 116.32 2k23 h GLU 60 Ca -0.37 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.99 2k23 h GLU 60 Cb 1.28 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.49 2k23 h GLU 60 CO 0.45 0.00 0.07 -3.47 0.07 0.00 0.00 179.01 176.12 2k23 n ASP 61 N -3.54 4.64 -0.73 3.06 2.03 -1.26 -4.89 116.55 115.86 2k23 n ASP 61 Ca 0.02 -3.10 -0.05 0.00 0.52 0.00 0.00 54.79 52.18 2k23 n ASP 61 Cb 0.37 -0.65 -0.02 0.00 -0.72 0.00 0.00 41.12 40.10 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 -0.10 -2.08 -4.70 1.67 0.23 -0.71 -4.92 115.26 104.65 2k23 n ASN 62 Ca 0.29 0.11 -0.40 0.00 -0.53 0.00 0.00 54.58 54.06 2k23 n ASN 62 Cb 1.13 -1.89 -0.05 0.00 -2.08 0.00 0.00 39.78 36.90 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 -1.28 6.93 -0.07 0.53 1.04 -1.26 -4.34 113.70 115.26 2k23 s SER 63 Ca 0.00 1.12 -0.20 0.00 0.48 0.00 0.00 55.95 57.35 2k23 s SER 63 Cb 0.00 -2.41 -0.04 0.00 0.10 0.00 0.00 66.02 63.67 2k23 s SER 63 CO 0.00 -0.18 0.56 -0.31 0.98 0.00 0.00 173.24 174.29 2k23 s TYR 64 N 1.17 3.59 -0.64 5.02 2.02 0.32 -1.95 117.35 126.87 2k23 s TYR 64 Ca 0.36 1.07 -0.21 0.00 -0.37 0.00 0.00 57.07 57.91 2k23 s TYR 64 Cb -0.17 -2.62 0.08 0.00 -0.40 0.00 0.00 41.96 38.85 2k23 s TYR 64 CO 0.16 0.22 0.89 0.54 -1.57 0.00 0.00 175.55 175.80 2k23 s ASN 65 N 0.35 6.18 -0.27 2.29 4.22 0.15 -0.79 114.94 127.07 2k23 s ASN 65 Ca 0.30 -1.13 -0.14 0.00 -2.14 0.00 0.00 52.86 49.76 2k23 s ASN 65 Cb -0.17 -2.39 -0.04 0.00 1.28 0.00 0.00 41.25 39.94 2k23 s ASN 65 CO 0.14 -1.35 0.33 -0.69 -2.04 0.00 0.00 177.10 173.49 2k23 s VAL 66 N 3.67 5.21 -0.67 3.54 1.01 0.22 -2.22 120.40 131.17 2k23 s VAL 66 Ca 0.19 0.48 -0.17 0.00 0.00 0.00 0.00 61.98 62.48 2k23 s VAL 66 Cb -0.19 -3.66 0.14 0.00 0.00 0.00 0.00 36.38 32.68 2k23 s VAL 66 CO 0.09 0.19 0.70 -0.89 0.00 0.00 0.00 175.10 175.19 2k23 s THR 67 N 1.91 5.13 -0.52 3.92 2.01 -0.04 -0.24 115.64 127.80 2k23 s THR 67 Ca 0.13 -1.57 -0.17 0.00 0.31 0.00 0.00 61.69 60.39 2k23 s THR 67 Cb -0.16 -4.47 0.10 0.00 0.01 0.00 0.00 72.50 67.98 2k23 s THR 67 CO 0.10 -1.06 0.51 -0.44 -0.69 0.00 0.00 174.62 173.04 2k23 s SER 68 N 3.26 6.18 0.14 3.53 0.01 0.13 -2.12 113.70 124.83 2k23 s SER 68 Ca 0.12 -1.47 -0.30 0.00 1.31 0.00 0.00 55.95 55.62 2k23 s SER 68 Cb -0.21 -2.22 -0.06 0.00 0.21 0.00 0.00 66.02 63.73 2k23 s SER 68 CO -0.00 -0.83 0.98 -0.51 0.41 0.00 0.00 173.24 173.29 2k23 s ILE 69 N 1.90 4.34 0.34 1.44 2.07 -1.07 0.08 121.20 130.31 2k23 s ILE 69 Ca 0.06 2.00 0.04 0.00 -1.41 0.00 0.00 60.65 61.34 2k23 s ILE 69 Cb -0.26 -4.28 -0.03 0.00 0.13 0.00 0.00 42.46 38.02 2k23 s ILE 69 CO 0.06 0.33 0.16 -0.76 -1.91 0.00 0.00 174.94 172.82 2k23 s LEU 70 N -0.20 1.80 -0.52 8.50 1.02 0.64 -4.29 118.68 125.63 2k23 s LEU 70 Ca 0.47 -1.60 -0.17 0.00 0.02 0.00 0.00 54.13 52.85 2k23 s LEU 70 Cb -0.25 0.12 0.10 0.00 0.02 0.00 0.00 46.19 46.18 2k23 s LEU 70 CO 0.31 -0.90 0.52 -0.69 0.02 0.00 0.00 176.35 175.61 2k23 s VAL 71 N -3.46 5.11 -0.19 -1.59 1.01 -1.26 -0.12 120.40 119.89 2k23 s VAL 71 Ca 0.33 -1.15 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2k23 s VAL 71 Cb 0.04 -4.30 0.03 0.00 0.00 0.00 0.00 36.38 32.15 2k23 s VAL 71 CO 0.18 -0.82 -0.18 -0.13 0.00 0.00 0.00 175.10 174.14 2k23 s ARG 72 N 1.94 2.82 -0.68 2.72 0.52 0.38 -4.71 118.95 121.94 2k23 s ARG 72 Ca 0.06 -0.87 -0.02 0.00 -0.52 0.00 0.00 55.73 54.38 2k23 s ARG 72 Cb -0.26 -2.57 0.00 0.00 0.52 0.00 0.00 34.95 32.64 2k23 s ARG 72 CO 0.06 -0.26 0.58 0.41 0.02 0.00 0.00 175.30 176.10 2k23 n GLY 73 N 4.61 0.06 3.61 -3.53 0.00 -1.26 -3.34 105.19 105.33 2k23 n GLY 73 Ca -0.20 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 2k23 n GLY 73 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k23 n GLN 74 N -2.78 -7.25 -2.40 1.61 -0.06 -1.26 -4.94 117.38 100.30 2k23 n GLN 74 Ca -0.10 0.79 -0.01 0.00 -2.00 0.00 0.00 57.00 55.68 2k23 n GLN 74 Cb 0.57 -5.80 0.01 0.00 -4.06 0.00 0.00 30.24 20.96 2k23 n GLN 74 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2k23 n GLY 75 N -1.77 1.07 3.45 1.69 0.00 -1.21 -5.15 105.19 103.27 2k23 n GLY 75 Ca -0.06 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.60 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 0.46 0.24 -0.03 0.00 3.52 0.82 -4.86 118.95 119.10 2k23 s ARG 77 Ca -0.05 0.19 -0.21 0.00 -0.13 0.00 0.00 55.73 55.54 2k23 s ARG 77 Cb -0.15 0.11 -0.05 0.00 -1.56 0.00 0.00 34.95 33.31 2k23 s ARG 77 CO 0.03 -0.03 0.59 0.71 -0.81 0.00 0.00 175.30 175.79 2k23 s TYR 78 N -0.04 3.64 -0.42 5.12 2.02 -1.26 -0.26 117.35 126.15 2k23 s TYR 78 Ca -0.01 1.16 -0.11 0.00 -0.37 0.00 0.00 57.07 57.74 2k23 s TYR 78 Cb -0.02 -2.63 0.07 0.00 -0.40 0.00 0.00 41.96 38.98 2k23 s TYR 78 CO 0.00 0.28 0.28 -0.46 -1.57 0.00 0.00 175.55 174.09 2k23 s TRP 79 N 0.09 3.30 -0.28 2.71 -0.11 0.11 -4.92 118.94 119.84 2k23 s TRP 79 Ca 0.31 -1.27 -0.11 0.00 1.22 0.00 0.00 56.10 56.25 2k23 s TRP 79 Cb -0.18 -2.90 -0.05 0.00 -1.50 0.00 0.00 33.47 28.84 2k23 s TRP 79 CO 0.16 -0.80 0.19 0.42 -4.62 0.00 0.00 176.95 172.30 2k23 s ILE 80 N 1.50 5.27 0.40 5.86 1.09 -1.26 0.21 121.20 134.28 2k23 s ILE 80 Ca 0.03 0.14 0.03 0.00 -1.10 0.00 0.00 60.65 59.75 2k23 s ILE 80 Cb -0.23 -3.52 -0.01 0.00 -1.06 0.00 0.00 42.46 37.64 2k23 s ILE 80 CO 0.04 0.24 0.12 -2.11 -0.10 0.00 0.00 174.94 173.13 2k23 n ARG 81 N 5.06 0.63 -4.47 2.79 1.85 0.66 -4.89 116.66 118.29 2k23 n ARG 81 Ca -0.14 -3.31 -0.34 0.00 -1.00 0.00 0.00 57.85 53.07 2k23 n ARG 81 Cb 0.52 1.67 -0.14 0.00 -1.05 0.00 0.00 32.46 33.46 2k23 n ARG 81 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2k23 s THR 82 N -2.97 3.28 -0.12 8.89 2.01 -1.26 0.70 115.64 126.18 2k23 s THR 82 Ca 0.17 -0.56 -0.01 0.00 0.31 0.00 0.00 61.69 61.60 2k23 s THR 82 Cb 0.01 -2.42 -0.02 0.00 0.01 0.00 0.00 72.50 70.08 2k23 s THR 82 CO 0.12 0.49 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.09 2k23 s PHE 83 N 0.65 2.87 0.03 4.92 0.08 0.03 0.47 117.98 127.04 2k23 s PHE 83 Ca -0.05 -0.39 0.03 0.00 0.12 0.00 0.00 56.93 56.64 2k23 s PHE 83 Cb -0.15 -1.83 -0.02 0.00 -0.57 0.00 0.00 43.02 40.45 2k23 s PHE 83 CO 0.02 -0.03 -0.10 0.14 -0.10 0.00 0.00 175.22 175.15 2k23 s VAL 84 N 0.05 0.76 0.31 -0.44 -7.23 0.28 0.12 120.40 114.24 2k23 s VAL 84 Ca -0.03 -0.90 -0.29 0.00 -1.81 0.00 0.00 61.98 58.95 2k23 s VAL 84 Cb -0.14 -0.73 -0.11 0.00 0.56 0.00 0.00 36.38 35.96 2k23 s VAL 84 CO 0.04 -0.13 1.44 -2.84 -0.31 0.00 0.00 175.10 173.30 2k23 s PRO 85 N -1.15 4.22 0.00 4.82 0.02 -1.26 0.39 135.00 142.05 2k23 s PRO 85 Ca -0.03 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.39 2k23 s PRO 85 Cb -0.08 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.39 2k23 s PRO 85 CO 0.01 -0.43 0.00 0.45 -0.33 0.00 0.00 177.00 176.70 2k23 n SER 86 N 1.45 0.00 0.23 2.53 2.88 0.16 -4.72 113.62 116.15 2k23 n SER 86 Ca 0.04 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.73 2k23 n SER 86 Cb 0.40 0.00 0.56 0.00 -0.75 0.00 0.00 64.21 64.42 2k23 n SER 86 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2k23 h SER 87 N 0.00 0.00 -3.77 -3.46 0.02 -1.96 -3.44 113.55 100.94 2k23 h SER 87 Ca 0.00 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.76 2k23 h SER 87 Cb 0.00 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 62.27 2k23 h SER 87 CO 0.00 0.00 -0.54 0.00 -1.14 0.00 0.00 176.83 175.15 2k23 s ARG 88 N -3.50 0.17 0.08 3.45 3.03 -1.26 -5.13 118.95 115.80 2k23 s ARG 88 Ca 0.03 0.22 -0.33 0.00 2.03 0.00 0.00 55.73 57.68 2k23 s ARG 88 Cb 0.09 0.07 -0.12 0.00 -1.03 0.00 0.00 34.95 33.95 2k23 s ARG 88 CO 0.53 -0.03 1.73 -2.30 -1.13 0.00 0.00 175.30 174.10 2k23 n PRO 89 N 3.06 2.33 0.00 3.89 -0.02 -1.26 -2.27 135.00 140.74 2k23 n PRO 89 Ca -0.13 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2k23 n PRO 89 Cb 0.59 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 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 3.91 3.44 3.65 -1.23 0.00 -1.26 -4.88 105.19 108.82 2k23 n GLY 90 Ca 0.19 -1.01 -0.43 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 4.14 0.04 1.61 0.74 -0.96 -4.00 119.66 121.23 2k23 s GLN 91 Ca 0.00 1.20 0.02 0.00 0.05 0.00 0.00 55.36 56.62 2k23 s GLN 91 Cb 0.00 -3.70 -0.04 0.00 1.10 0.00 0.00 33.01 30.37 2k23 s GLN 91 CO 0.00 -0.80 0.07 -0.06 -0.55 0.00 0.00 175.29 173.95 2k23 s PHE 92 N 3.50 3.21 0.43 1.67 0.08 0.41 0.37 117.98 127.65 2k23 s PHE 92 Ca 0.45 0.12 0.03 0.00 0.12 0.00 0.00 56.93 57.66 2k23 s PHE 92 Cb -0.13 -1.67 -0.02 0.00 -0.57 0.00 0.00 43.02 40.63 2k23 s PHE 92 CO 0.12 0.53 0.12 0.95 -0.10 0.00 0.00 175.22 176.83 2k23 s THR 93 N -1.28 0.65 0.01 0.64 -4.23 0.16 -1.63 115.64 109.96 2k23 s THR 93 Ca 0.26 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.64 2k23 s THR 93 Cb -0.12 -2.31 -0.06 0.00 1.34 0.00 0.00 72.50 71.36 2k23 s THR 93 CO 0.18 0.00 0.39 -0.76 -0.54 0.00 0.00 174.62 173.89 2k23 s LEU 94 N -3.65 4.44 0.50 4.79 2.01 -1.26 -0.56 118.68 124.95 2k23 s LEU 94 Ca 0.21 0.90 0.25 0.00 0.01 0.00 0.00 54.13 55.50 2k23 s LEU 94 Cb 0.02 -2.64 1.35 0.00 0.01 0.00 0.00 46.19 44.93 2k23 s LEU 94 CO 0.13 0.30 1.73 1.23 1.01 0.00 0.00 176.35 180.75 2k23 h GLY 95 N 4.52 0.00 -2.81 -3.19 0.00 -0.26 0.87 103.07 102.20 2k23 h GLY 95 Ca -0.51 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.65 2k23 h GLY 95 CO 0.62 0.00 -0.98 -2.01 0.00 0.00 0.00 176.54 174.17 2k23 n ASN 96 N -2.53 0.89 0.11 0.19 4.05 -1.26 -4.91 115.26 111.79 2k23 n ASN 96 Ca -0.02 -2.00 0.06 0.00 0.45 0.00 0.00 54.58 53.07 2k23 n ASN 96 Cb 0.27 -0.28 0.51 0.00 1.23 0.00 0.00 39.78 41.51 2k23 n ASN 96 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 177.26 173.92 2k23 h ILE 97 N 6.97 1.06 0.00 -1.44 6.09 -1.17 -1.85 117.51 127.17 2k23 h ILE 97 Ca -0.21 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 2k23 h ILE 97 Cb 1.85 0.73 0.00 0.00 0.47 0.00 0.00 36.82 39.87 2k23 h ILE 97 CO 0.09 0.06 0.00 0.00 -3.07 0.00 0.00 178.15 175.23 2k23 n HIS 98 N -4.50 0.00 0.49 2.19 1.44 -1.26 -1.54 115.22 112.05 2k23 n HIS 98 Ca 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.77 2k23 n HIS 98 Cb 0.08 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.21 2k23 n HIS 98 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 2k23 n SER 99 N -0.76 1.63 -4.68 4.39 7.64 -0.70 -4.94 113.62 116.21 2k23 n SER 99 Ca 0.11 -1.32 -0.41 0.00 1.01 0.00 0.00 58.87 58.26 2k23 n SER 99 Cb 0.05 0.23 -0.04 0.00 -1.01 0.00 0.00 64.21 63.45 2k23 n SER 99 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2k23 s TYR 100 N -1.21 3.45 -0.01 1.43 2.02 -0.59 -4.99 117.35 117.46 2k23 s TYR 100 Ca 0.11 1.31 -0.25 0.00 -0.37 0.00 0.00 57.07 57.87 2k23 s TYR 100 Cb 0.09 -3.02 -0.20 0.00 -0.40 0.00 0.00 41.96 38.44 2k23 s TYR 100 CO 0.21 -0.20 1.31 -1.00 -1.57 0.00 0.00 175.55 174.30 2k23 h PRO 101 N 7.23 0.01 -0.01 -1.71 0.13 -1.92 -3.25 132.00 132.48 2k23 h PRO 101 Ca -0.31 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2k23 h PRO 101 Cb 1.14 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2k23 h PRO 101 CO 0.83 0.46 -0.22 0.00 -0.23 0.00 0.00 178.00 178.83 2k23 n GLN 102 N -4.87 1.30 -2.13 0.86 10.64 -1.26 -4.83 117.38 117.10 2k23 n GLN 102 Ca -0.08 -0.90 -0.43 0.00 -1.83 0.00 0.00 57.00 53.76 2k23 n GLN 102 Cb 0.23 -1.48 -0.03 0.00 -0.86 0.00 0.00 30.24 28.11 2k23 n GLN 102 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2k23 s ILE 103 N -2.32 3.62 0.06 -0.39 1.09 -1.23 -2.51 121.20 119.51 2k23 s ILE 103 Ca 0.26 0.62 -0.19 0.00 -1.10 0.00 0.00 60.65 60.24 2k23 s ILE 103 Cb 0.19 -3.87 -0.11 0.00 -1.06 0.00 0.00 42.46 37.61 2k23 s ILE 103 CO 0.46 -0.58 1.43 1.56 -0.10 0.00 0.00 174.94 177.71 2k23 h GLN 104 N 12.21 0.41 -2.31 2.79 1.08 -0.68 -3.47 115.11 125.14 2k23 h GLN 104 Ca -0.31 -0.17 -0.03 0.00 -1.45 0.00 0.00 58.65 56.69 2k23 h GLN 104 Cb 1.14 -0.01 -0.17 0.00 -0.05 0.00 0.00 27.48 28.39 2k23 h GLN 104 CO 1.06 0.69 0.24 -1.12 -0.95 0.00 0.00 178.83 178.76 2k23 s SER 105 N -6.06 -0.59 -0.17 1.46 0.01 -1.24 -4.98 113.70 102.13 2k23 s SER 105 Ca -0.14 0.42 -0.05 0.00 1.31 0.00 0.00 55.95 57.49 2k23 s SER 105 Cb 0.06 0.53 0.06 0.00 0.21 0.00 0.00 66.02 66.88 2k23 s SER 105 CO 0.75 -0.71 0.08 -0.47 0.41 0.00 0.00 173.24 173.31 2k23 s TYR 106 N -2.13 0.28 -0.04 2.43 6.14 -1.26 -0.53 117.35 122.24 2k23 s TYR 106 Ca -0.05 -0.37 0.01 0.00 0.64 0.00 0.00 57.07 57.29 2k23 s TYR 106 Cb -0.00 -0.73 0.02 0.00 0.42 0.00 0.00 41.96 41.67 2k23 s TYR 106 CO 0.01 -0.52 -0.03 0.16 0.64 0.00 0.00 175.55 175.80 2k23 s ASP 107 N 2.11 0.72 -0.03 4.32 1.47 -0.85 -4.41 116.67 120.00 2k23 s ASP 107 Ca 0.02 -0.09 -0.01 0.00 1.18 0.00 0.00 52.55 53.65 2k23 s ASP 107 Cb -0.16 -0.34 0.03 0.00 -0.34 0.00 0.00 42.92 42.11 2k23 s ASP 107 CO -0.09 -0.06 0.05 0.54 0.68 0.00 0.00 175.17 176.29 2k23 s VAL 108 N 0.86 -0.06 0.02 2.11 0.11 -0.65 -0.93 120.40 121.85 2k23 s VAL 108 Ca -0.10 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.17 2k23 s VAL 108 Cb -0.13 -0.11 -0.02 0.00 -1.53 0.00 0.00 36.38 34.59 2k23 s VAL 108 CO -0.00 0.09 -0.03 0.00 -3.33 0.00 0.00 175.10 171.82 2k23 s GLN 109 N 1.13 0.30 0.08 1.54 -2.07 -0.66 0.16 119.66 120.14 2k23 s GLN 109 Ca -0.09 -0.51 -0.27 0.00 -1.82 0.00 0.00 55.36 52.67 2k23 s GLN 109 Cb -0.13 -0.01 -0.06 0.00 -1.09 0.00 0.00 33.01 31.73 2k23 s GLN 109 CO -0.04 -0.02 0.84 0.54 -1.32 0.00 0.00 175.29 175.29 2k23 s VAL 110 N -1.14 4.60 0.19 3.63 0.11 -1.26 -1.94 120.40 124.60 2k23 s VAL 110 Ca -0.11 1.79 -0.03 0.00 -2.93 0.00 0.00 61.98 60.70 2k23 s VAL 110 Cb -0.08 -4.19 -0.06 0.00 -1.53 0.00 0.00 36.38 30.52 2k23 s VAL 110 CO -0.01 0.37 1.49 0.00 -3.33 0.00 0.00 175.10 173.63 2k23 h ALA 111 N 5.46 0.68 -1.91 1.54 0.00 0.20 -2.87 119.26 122.37 2k23 h ALA 111 Ca -0.44 -0.53 0.05 0.00 0.00 0.00 0.00 54.91 53.99 2k23 h ALA 111 Cb 1.21 -0.08 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 2k23 h ALA 111 CO 0.71 0.70 0.04 0.34 0.00 0.00 0.00 179.25 181.03 2k23 s ASP 112 N -6.93 -0.92 -0.01 0.00 2.15 -1.24 -4.20 116.67 105.51 2k23 s ASP 112 Ca -0.07 1.42 0.02 0.00 0.43 0.00 0.00 52.55 54.35 2k23 s ASP 112 Cb 0.11 1.56 0.00 0.00 -0.30 0.00 0.00 42.92 44.29 2k23 s ASP 112 CO 0.84 -0.22 -0.05 0.28 -0.17 0.00 0.00 175.17 175.85 2k23 s THR 113 N 1.88 0.47 0.06 1.71 -1.32 -1.26 -2.02 115.64 115.15 2k23 s THR 113 Ca -0.09 -0.20 -0.02 0.00 -1.21 0.00 0.00 61.69 60.17 2k23 s THR 113 Cb -0.06 -0.43 -0.03 0.00 -1.51 0.00 0.00 72.50 70.47 2k23 s THR 113 CO -0.19 0.15 0.01 -0.62 -2.21 0.00 0.00 174.62 171.76 2k23 s ASP 114 N 0.17 0.42 0.12 8.08 2.15 -1.26 -5.03 116.67 121.32 2k23 s ASP 114 Ca -0.02 -0.94 -0.10 0.00 0.43 0.00 0.00 52.55 51.92 2k23 s ASP 114 Cb -0.06 0.23 -0.10 0.00 -0.30 0.00 0.00 42.92 42.68 2k23 s ASP 114 CO -0.00 -0.62 1.33 0.10 -0.17 0.00 0.00 175.17 175.81 2k23 h TYR 115 N 3.08 0.95 0.02 -5.34 -0.00 -1.96 -3.35 116.97 110.36 2k23 h TYR 115 Ca -0.34 -0.42 -0.38 0.00 -0.00 0.00 0.00 58.73 57.58 2k23 h TYR 115 Cb 1.15 -0.14 -0.06 0.00 -0.00 0.00 0.00 36.73 37.68 2k23 h TYR 115 CO 0.51 1.24 -2.38 -3.47 -0.00 0.00 0.00 178.16 174.06 2k23 n ASP 116 N -3.91 1.92 -3.83 0.10 2.03 -1.26 -4.33 116.55 107.27 2k23 n ASP 116 Ca -0.07 -0.07 -0.30 0.00 0.52 0.00 0.00 54.79 54.88 2k23 n ASP 116 Cb 0.74 -0.44 0.24 0.00 -0.72 0.00 0.00 41.12 40.95 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 -2.53 -1.36 0.16 -0.67 0.74 -1.26 -4.35 119.66 110.40 2k23 s GLN 117 Ca -0.31 0.01 0.01 0.00 0.05 0.00 0.00 55.36 55.11 2k23 s GLN 117 Cb 0.08 -1.57 -0.04 0.00 1.10 0.00 0.00 33.01 32.58 2k23 s GLN 117 CO 0.64 -3.82 0.31 -0.59 -0.55 0.00 0.00 175.29 171.29 2k23 s PHE 118 N -2.90 3.49 -0.02 1.67 -0.71 -1.26 -4.17 117.98 114.08 2k23 s PHE 118 Ca 0.70 0.22 0.06 0.00 -1.04 0.00 0.00 56.93 56.87 2k23 s PHE 118 Cb -0.11 -1.75 -0.01 0.00 -1.21 0.00 0.00 43.02 39.94 2k23 s PHE 118 CO 0.57 0.48 -0.20 0.00 -1.34 0.00 0.00 175.22 174.72 2k23 s ALA 119 N -1.76 1.70 -0.31 1.99 0.00 0.97 -4.29 121.76 120.07 2k23 s ALA 119 Ca 0.36 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.42 2k23 s ALA 119 Cb -0.11 -0.46 0.04 0.00 0.00 0.00 0.00 23.12 22.59 2k23 s ALA 119 CO 0.28 0.39 0.04 -1.64 0.00 0.00 0.00 175.76 174.84 2k23 s MET 120 N -0.37 2.55 -0.09 0.00 -1.94 -0.86 -0.45 119.30 118.14 2k23 s MET 120 Ca 0.05 -1.20 0.02 0.00 -1.71 0.00 0.00 55.69 52.85 2k23 s MET 120 Cb -0.09 -3.29 -0.02 0.00 2.01 0.00 0.00 34.83 33.45 2k23 s MET 120 CO 0.00 -0.62 -0.16 0.08 -0.01 0.00 0.00 175.02 174.31 2k23 s VAL 121 N 1.32 2.85 -0.26 -6.03 1.01 -0.14 0.62 120.40 119.79 2k23 s VAL 121 Ca -0.03 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 2k23 s VAL 121 Cb -0.19 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 2k23 s VAL 121 CO 0.00 0.56 0.21 0.12 0.00 0.00 0.00 175.10 175.99 2k23 s PHE 122 N -0.14 3.27 -0.11 5.22 2.19 -0.82 0.43 117.98 128.03 2k23 s PHE 122 Ca -0.02 0.22 0.01 0.00 0.33 0.00 0.00 56.93 57.48 2k23 s PHE 122 Cb -0.14 -2.36 -0.02 0.00 -1.31 0.00 0.00 43.02 39.20 2k23 s PHE 122 CO 0.04 -0.05 -0.14 -0.06 1.83 0.00 0.00 175.22 176.83 2k23 s PHE 123 N 1.44 2.77 -0.05 10.12 0.40 0.59 -1.65 117.98 131.60 2k23 s PHE 123 Ca 0.09 -0.54 0.03 0.00 -0.60 0.00 0.00 56.93 55.91 2k23 s PHE 123 Cb -0.15 -1.78 0.00 0.00 0.51 0.00 0.00 43.02 41.60 2k23 s PHE 123 CO 0.08 -0.12 -0.14 -1.14 0.70 0.00 0.00 175.22 174.60 2k23 s GLN 124 N 0.07 1.57 -0.12 0.44 0.74 -0.11 -0.97 119.66 121.28 2k23 s GLN 124 Ca -0.06 -0.47 0.00 0.00 0.05 0.00 0.00 55.36 54.89 2k23 s GLN 124 Cb -0.15 -1.35 0.02 0.00 1.10 0.00 0.00 33.01 32.63 2k23 s GLN 124 CO 0.05 0.13 -0.12 -1.59 -0.55 0.00 0.00 175.29 173.21 2k23 s LYS 125 N 0.30 1.99 -0.15 1.67 -2.85 0.15 -2.02 119.74 118.83 2k23 s LYS 125 Ca -0.08 -0.45 -0.08 0.00 -1.00 0.00 0.00 55.97 54.36 2k23 s LYS 125 Cb -0.12 -1.85 -0.04 0.00 -2.06 0.00 0.00 37.83 33.75 2k23 s LYS 125 CO 0.02 -0.19 0.12 0.99 0.10 0.00 0.00 175.35 176.39 2k23 s THR 126 N 1.40 5.34 -0.09 3.79 2.01 0.31 0.29 115.64 128.69 2k23 s THR 126 Ca 0.01 0.16 -0.22 0.00 0.31 0.00 0.00 61.69 61.95 2k23 s THR 126 Cb -0.13 -3.37 0.05 0.00 0.01 0.00 0.00 72.50 69.05 2k23 s THR 126 CO -0.07 0.54 0.53 -0.44 -0.69 0.00 0.00 174.62 174.49 2k23 s SER 127 N -0.37 -0.50 -0.89 3.53 0.01 -0.32 0.08 113.70 115.24 2k23 s SER 127 Ca 0.11 0.67 0.00 0.00 1.31 0.00 0.00 55.95 58.04 2k23 s SER 127 Cb -0.12 0.68 0.00 0.00 0.21 0.00 0.00 66.02 66.79 2k23 s SER 127 CO 0.01 -0.42 0.00 -1.84 0.41 0.00 0.00 173.24 171.40 2k23 n GLU 128 N 1.65 -2.23 0.00 12.44 0.28 -1.05 0.62 120.64 132.37 2k23 n GLU 128 Ca -0.18 0.50 0.00 0.00 -0.16 0.00 0.00 57.16 57.32 2k23 n GLU 128 Cb 0.56 -5.04 0.00 0.00 1.43 0.00 0.00 31.44 28.40 2k23 n GLU 128 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2k23 n ASN 129 N -1.55 0.00 -4.79 -1.84 3.02 -1.26 -4.97 115.26 103.87 2k23 n ASN 129 Ca -0.12 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.07 2k23 n ASN 129 Cb 0.56 -0.47 -0.07 0.00 -0.61 0.00 0.00 39.78 39.20 2k23 n ASN 129 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2k23 s LYS 130 N 0.00 3.97 0.01 3.52 2.20 0.20 -5.07 119.74 124.57 2k23 s LYS 130 Ca 0.00 0.04 -0.12 0.00 -0.36 0.00 0.00 55.97 55.53 2k23 s LYS 130 Cb 0.00 -3.33 -0.05 0.00 -1.51 0.00 0.00 37.83 32.94 2k23 s LYS 130 CO 0.00 0.47 0.37 -0.65 -0.36 0.00 0.00 175.35 175.18 2k23 s GLN 131 N -0.22 3.79 -0.04 4.03 -0.21 -1.26 -1.18 119.66 124.57 2k23 s GLN 131 Ca 0.16 0.25 0.05 0.00 0.02 0.00 0.00 55.36 55.84 2k23 s GLN 131 Cb -0.13 -3.14 -0.01 0.00 1.00 0.00 0.00 33.01 30.73 2k23 s GLN 131 CO 0.05 0.66 -0.20 0.71 -2.12 0.00 0.00 175.29 174.39 2k23 s TYR 132 N -1.18 1.92 -0.15 0.91 1.51 0.15 -4.77 117.35 115.74 2k23 s TYR 132 Ca 0.26 -0.53 -0.18 0.00 -1.01 0.00 0.00 57.07 55.61 2k23 s TYR 132 Cb -0.15 -1.28 0.05 0.00 -0.11 0.00 0.00 41.96 40.47 2k23 s TYR 132 CO 0.14 -0.16 0.48 -0.59 -1.11 0.00 0.00 175.55 174.31 2k23 s PHE 133 N -0.09 -0.50 0.10 2.71 -0.71 -1.26 0.31 117.98 118.54 2k23 s PHE 133 Ca -0.02 1.15 -0.16 0.00 -1.04 0.00 0.00 56.93 56.86 2k23 s PHE 133 Cb -0.12 0.19 0.03 0.00 -1.21 0.00 0.00 43.02 41.92 2k23 s PHE 133 CO 0.02 -0.30 0.39 -1.59 -1.34 0.00 0.00 175.22 172.40 2k23 s LYS 134 N -0.07 1.02 -0.11 1.99 -2.85 -0.14 -2.47 119.74 117.11 2k23 s LYS 134 Ca -0.03 -0.63 0.00 0.00 -1.00 0.00 0.00 55.97 54.32 2k23 s LYS 134 Cb -0.03 0.45 -0.02 0.00 -2.06 0.00 0.00 37.83 36.17 2k23 s LYS 134 CO 0.02 -0.38 -0.12 0.54 0.10 0.00 0.00 175.35 175.50 2k23 s VAL 135 N -3.46 3.17 0.10 1.79 0.11 0.27 -0.30 120.40 122.08 2k23 s VAL 135 Ca 0.01 -0.63 0.10 0.00 -2.93 0.00 0.00 61.98 58.53 2k23 s VAL 135 Cb 0.01 -2.32 -0.04 0.00 -1.53 0.00 0.00 36.38 32.51 2k23 s VAL 135 CO -0.09 0.54 -0.26 0.28 -3.33 0.00 0.00 175.10 172.23 2k23 s THR 136 N 0.07 2.15 -0.24 5.04 -1.32 0.17 -0.55 115.64 120.96 2k23 s THR 136 Ca -0.05 -1.63 -0.06 0.00 -1.21 0.00 0.00 61.69 58.74 2k23 s THR 136 Cb -0.14 -1.89 -0.02 0.00 -1.51 0.00 0.00 72.50 68.93 2k23 s THR 136 CO 0.04 0.14 0.04 -0.22 -2.21 0.00 0.00 174.62 172.41 2k23 s LEU 137 N -1.82 3.29 0.22 9.08 1.98 0.21 -0.96 118.68 130.68 2k23 s LEU 137 Ca 0.12 -0.26 0.10 0.00 -2.89 0.00 0.00 54.13 51.21 2k23 s LEU 137 Cb -0.10 -1.87 -0.04 0.00 0.66 0.00 0.00 46.19 44.83 2k23 s LEU 137 CO 0.05 -0.03 -0.14 -0.31 -1.89 0.00 0.00 176.35 174.02 2k23 s TYR 138 N 1.58 2.48 0.11 5.38 2.02 0.41 0.34 117.35 129.65 2k23 s TYR 138 Ca 0.06 -0.28 -0.10 0.00 -0.37 0.00 0.00 57.07 56.38 2k23 s TYR 138 Cb -0.15 -1.17 0.01 0.00 -0.40 0.00 0.00 41.96 40.25 2k23 s TYR 138 CO 0.02 0.57 0.25 0.20 -1.57 0.00 0.00 175.55 175.02 2k23 s GLY 139 N -3.07 0.05 0.41 0.71 0.00 0.07 -0.02 107.32 105.47 2k23 s GLY 139 Ca 0.26 -0.52 0.10 0.00 0.00 0.00 0.00 44.72 44.57 2k23 s GLY 139 CO 0.14 -0.69 1.97 -0.09 0.00 0.00 0.00 173.10 174.43 2k23 h ARG 140 N 2.63 0.23 -4.48 2.90 2.43 -1.76 0.36 114.38 116.69 2k23 h ARG 140 Ca -0.34 -0.04 -0.27 0.00 -0.81 0.00 0.00 59.98 58.53 2k23 h ARG 140 Cb 1.22 -0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 30.60 2k23 h ARG 140 CO 0.53 0.31 -0.48 -0.08 -1.51 0.00 0.00 179.97 178.73 2k23 s THR 141 N -4.87 0.00 -2.01 0.20 -1.32 -1.26 -4.59 115.64 101.79 2k23 s THR 141 Ca -0.06 -1.88 0.10 0.00 -1.21 0.00 0.00 61.69 58.65 2k23 s THR 141 Cb 0.16 -2.47 0.29 0.00 -1.51 0.00 0.00 72.50 68.97 2k23 s THR 141 CO 0.72 0.00 1.39 0.29 -2.21 0.00 0.00 174.62 174.82 2k23 n LYS 142 N -0.39 1.03 -2.01 7.08 5.02 -1.26 -4.18 118.16 123.45 2k23 n LYS 142 Ca 0.03 -0.04 -0.37 0.00 -2.02 0.00 0.00 58.31 55.90 2k23 n LYS 142 Cb 0.64 -1.17 -0.00 0.00 -0.02 0.00 0.00 35.03 34.48 2k23 n LYS 142 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k23 n GLY 143 N 0.68 5.30 3.58 0.72 0.00 -1.26 -4.94 105.19 109.27 2k23 n GLY 143 Ca 0.08 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.52 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 -3.13 3.54 0.64 0.99 1.43 -1.26 -5.09 118.68 115.80 2k23 s LEU 144 Ca 0.51 -0.00 -0.16 0.00 -1.03 0.00 0.00 54.13 53.44 2k23 s LEU 144 Cb 0.29 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 2k23 s LEU 144 CO -0.21 0.20 1.15 -0.44 0.23 0.00 0.00 176.35 177.28 2k23 s SER 145 N 0.22 5.04 0.58 2.29 0.01 -1.26 -4.91 113.70 115.67 2k23 s SER 145 Ca 0.01 2.17 0.31 0.00 1.31 0.00 0.00 55.95 59.74 2k23 s SER 145 Cb -0.13 -2.57 1.80 0.00 0.21 0.00 0.00 66.02 65.33 2k23 s SER 145 CO 0.02 -1.68 2.22 0.44 0.41 0.00 0.00 173.24 174.65 2k23 h ASP 146 N 0.31 0.00 -0.26 2.44 5.19 -1.99 -2.40 116.42 119.71 2k23 h ASP 146 Ca -0.48 0.00 0.05 0.00 -0.62 0.00 0.00 57.03 55.98 2k23 h ASP 146 Cb 1.27 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.73 2k23 h ASP 146 CO 0.54 0.03 -0.03 -0.08 -3.12 0.00 0.00 179.24 176.58 2k23 h GLU 147 N 0.00 0.05 0.00 3.56 4.81 -1.99 0.29 114.58 121.30 2k23 h GLU 147 Ca -0.00 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.11 2k23 h GLU 147 Cb 0.09 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2k23 h GLU 147 CO 0.00 0.03 -0.57 1.37 -0.73 0.00 0.00 179.01 179.11 2k23 h LEU 148 N 0.05 0.00 -0.17 1.64 8.10 -1.80 -1.99 115.31 121.13 2k23 h LEU 148 Ca 0.12 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.04 2k23 h LEU 148 Cb 0.17 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.39 2k23 h LEU 148 CO -0.23 0.57 -0.20 0.11 -4.11 0.00 0.00 178.44 174.58 2k23 h LYS 149 N 0.00 0.43 -0.30 0.17 1.57 -1.34 -2.77 116.57 114.32 2k23 h LYS 149 Ca -0.01 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2k23 h LYS 149 Cb 1.01 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 2k23 h LYS 149 CO 0.07 0.81 0.20 0.93 -0.57 0.00 0.00 179.45 180.90 2k23 h GLU 150 N 0.07 0.40 -0.39 3.15 5.08 -0.28 -0.44 114.58 122.18 2k23 h GLU 150 Ca 0.02 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 2k23 h GLU 150 Cb 0.75 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.85 2k23 h GLU 150 CO 0.05 0.26 0.04 0.00 -1.00 0.00 0.00 179.01 178.36 2k23 h ARG 151 N 0.41 0.14 -0.38 2.33 3.08 -1.10 0.07 114.38 118.93 2k23 h ARG 151 Ca 0.11 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.08 2k23 h ARG 151 Cb -0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2k23 h ARG 151 CO -0.02 0.10 -0.03 0.27 -1.07 0.00 0.00 179.97 179.21 2k23 h PHE 152 N 0.15 0.77 -0.89 3.04 -5.15 -0.87 -0.80 116.94 113.19 2k23 h PHE 152 Ca 0.19 -0.15 -0.02 0.00 -0.20 0.00 0.00 57.97 57.79 2k23 h PHE 152 Cb 0.25 -0.20 -0.04 0.00 0.22 0.00 0.00 35.95 36.18 2k23 h PHE 152 CO -0.23 0.80 0.49 -0.39 -2.00 0.00 0.00 178.31 176.98 2k23 h VAL 153 N 0.51 1.26 -0.66 0.88 -1.51 -0.97 0.45 116.25 116.21 2k23 h VAL 153 Ca 0.10 -0.65 -0.06 0.00 -1.23 0.00 0.00 66.70 64.87 2k23 h VAL 153 Cb 0.52 0.05 -0.03 0.00 -2.13 0.00 0.00 31.29 29.70 2k23 h VAL 153 CO 0.03 0.29 0.17 0.28 -1.23 0.00 0.00 177.57 177.11 2k23 h SER 154 N 1.25 1.00 0.27 4.19 0.02 -0.81 -1.69 113.55 117.78 2k23 h SER 154 Ca 0.31 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 2k23 h SER 154 Cb 0.03 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2k23 h SER 154 CO -0.05 0.97 -0.32 0.15 -1.14 0.00 0.00 176.83 176.43 2k23 h PHE 155 N 0.98 0.10 -0.57 3.45 3.57 -0.18 -2.15 116.94 122.14 2k23 h PHE 155 Ca 0.21 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.77 2k23 h PHE 155 Cb 0.35 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 2k23 h PHE 155 CO 0.03 0.41 0.23 0.00 -2.23 0.00 0.00 178.31 176.74 2k23 h ALA 156 N 1.60 0.72 0.00 2.41 0.00 0.81 -0.11 119.26 124.69 2k23 h ALA 156 Ca 0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2k23 h ALA 156 Cb 0.62 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2k23 h ALA 156 CO 0.04 -0.17 -0.10 0.87 0.00 0.00 0.00 179.25 179.90 2k23 h LYS 157 N 0.43 0.00 0.00 0.00 6.56 -1.11 -2.27 116.57 120.18 2k23 h LYS 157 Ca 0.27 0.00 -0.09 0.00 -1.06 0.00 0.00 60.65 59.78 2k23 h LYS 157 Cb 0.29 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.94 2k23 h LYS 157 CO -0.26 0.10 -0.42 0.77 -2.06 0.00 0.00 179.45 177.58 2k23 h SER 158 N 0.00 0.00 1.23 0.86 0.02 -0.44 -1.53 113.55 113.69 2k23 h SER 158 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k23 h SER 158 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 2k23 h SER 158 CO 0.01 0.42 0.00 -0.07 -1.14 0.00 0.00 176.83 176.06 2k23 h LEU 159 N 0.00 0.00 0.00 5.07 -0.00 -0.91 -3.46 115.31 116.00 2k23 h LEU 159 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2k23 h LEU 159 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 2k23 h LEU 159 CO 0.06 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.11 2k23 n GLY 160 N 0.56 1.33 1.71 0.83 0.00 -0.57 -4.32 105.19 104.73 2k23 n GLY 160 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2k23 n GLY 160 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k23 n LEU 161 N 0.00 0.00 -3.82 0.99 4.77 -0.89 -4.64 117.00 113.42 2k23 n LEU 161 Ca 0.00 -0.64 -0.10 0.00 -0.03 0.00 0.00 56.01 55.24 2k23 n LEU 161 Cb 0.00 -0.46 -0.07 0.00 -2.33 0.00 0.00 43.42 40.56 2k23 n LEU 161 CO 0.00 -1.01 -0.05 -1.59 -1.33 0.00 0.00 177.39 173.41 2k23 s LYS 162 N -4.28 0.82 0.61 3.23 0.00 -1.26 -3.87 119.74 114.98 2k23 s LYS 162 Ca 0.34 -0.77 0.29 0.00 0.00 0.00 0.00 55.97 55.82 2k23 s LYS 162 Cb -0.01 0.34 1.52 0.00 0.00 0.00 0.00 37.83 39.68 2k23 s LYS 162 CO 0.24 -0.26 1.91 0.22 0.00 0.00 0.00 175.35 177.46 2k23 h ASP 163 N 2.99 0.00 -0.07 0.03 3.58 -1.92 0.23 116.42 121.26 2k23 h ASP 163 Ca -0.33 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.14 2k23 h ASP 163 Cb 1.20 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.25 2k23 h ASP 163 CO 0.52 0.00 0.10 0.78 -2.88 0.00 0.00 179.24 177.76 2k23 h ASN 164 N 0.00 0.00 -0.03 2.28 4.21 -1.98 -1.07 115.58 118.99 2k23 h ASN 164 Ca 0.14 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.60 2k23 h ASN 164 Cb 0.98 0.00 -0.08 0.00 -1.12 0.00 0.00 38.32 38.10 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 -3.60 1.72 -4.15 5.81 4.13 0.79 -4.86 115.26 115.11 2k23 n ASN 165 Ca -0.01 -3.57 -0.30 0.00 1.68 0.00 0.00 54.58 52.37 2k23 n ASN 165 Cb 0.20 -0.48 -0.17 0.00 -1.54 0.00 0.00 39.78 37.79 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 -2.77 1.81 0.44 2.41 1.01 -0.41 -0.01 121.20 123.69 2k23 s ILE 166 Ca 0.38 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 60.21 2k23 s ILE 166 Cb 0.37 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 2k23 s ILE 166 CO -0.08 0.50 0.04 0.68 0.00 0.00 0.00 174.94 176.09 2k23 s VAL 167 N 0.62 1.19 -0.03 2.92 -7.23 0.17 -4.93 120.40 113.12 2k23 s VAL 167 Ca -0.13 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.10 2k23 s VAL 167 Cb -0.16 -2.47 -0.01 0.00 0.56 0.00 0.00 36.38 34.30 2k23 s VAL 167 CO 0.04 0.00 -0.21 -0.36 -0.31 0.00 0.00 175.10 174.26 2k23 s PHE 168 N -2.99 1.95 -0.10 2.82 0.08 -1.26 -1.72 117.98 116.75 2k23 s PHE 168 Ca 0.20 -0.45 -0.29 0.00 0.12 0.00 0.00 56.93 56.52 2k23 s PHE 168 Cb 0.05 -1.27 -0.06 0.00 -0.57 0.00 0.00 43.02 41.16 2k23 s PHE 168 CO 0.11 -0.09 2.01 -1.54 -0.10 0.00 0.00 175.22 175.60 2k23 s SER 169 N -0.33 6.05 -0.00 1.36 1.04 -1.23 -4.77 113.70 115.81 2k23 s SER 169 Ca 0.04 2.20 -0.30 0.00 0.48 0.00 0.00 55.95 58.36 2k23 s SER 169 Cb -0.10 -2.52 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 2k23 s SER 169 CO 0.01 -1.44 1.14 -0.69 0.98 0.00 0.00 173.24 173.23 2k23 s VAL 170 N 6.07 4.34 -1.16 5.02 1.01 -1.10 -4.46 120.40 130.12 2k23 s VAL 170 Ca 0.90 1.67 -0.22 0.00 0.00 0.00 0.00 61.98 64.33 2k23 s VAL 170 Cb -0.36 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 2k23 s VAL 170 CO 0.37 0.08 1.91 -2.16 0.00 0.00 0.00 175.10 175.29 2k23 s PRO 171 N 1.52 2.68 0.86 2.72 0.04 -1.26 -0.64 135.00 140.92 2k23 s PRO 171 Ca 0.56 -1.15 -0.11 0.00 0.04 0.00 0.00 61.00 60.33 2k23 s PRO 171 Cb -0.25 -5.26 0.11 0.00 0.04 0.00 0.00 34.50 29.14 2k23 s PRO 171 CO 0.26 -3.69 1.09 -0.08 0.04 0.00 0.00 177.00 174.62 2k23 s THR 172 N 10.06 2.85 -1.07 1.26 -1.32 -1.26 -4.90 115.64 121.26 2k23 s THR 172 Ca 0.67 0.28 -0.22 0.00 -1.21 0.00 0.00 61.69 61.20 2k23 s THR 172 Cb -0.01 -2.75 0.01 0.00 -1.51 0.00 0.00 72.50 68.24 2k23 s THR 172 CO 0.10 -0.36 1.71 -0.62 -2.21 0.00 0.00 174.62 173.25 2k23 s ASP 173 N -3.39 5.98 -0.21 8.08 2.15 -1.26 -4.84 116.67 123.17 2k23 s ASP 173 Ca 0.63 -1.47 -0.22 0.00 0.43 0.00 0.00 52.55 51.92 2k23 s ASP 173 Cb -0.18 -2.57 0.06 0.00 -0.30 0.00 0.00 42.92 39.93 2k23 s ASP 173 CO 0.57 -2.01 0.61 -1.58 -0.17 0.00 0.00 175.17 172.58 2k23 s GLN 174 N 5.61 0.74 0.00 4.34 -0.44 -1.26 -5.03 119.66 123.62 2k23 s GLN 174 Ca 0.57 0.79 -0.02 0.00 -2.50 0.00 0.00 55.36 54.21 2k23 s GLN 174 Cb -0.01 0.36 -0.01 0.00 -1.64 0.00 0.00 33.01 31.71 2k23 s GLN 174 CO -0.01 -0.10 1.03 0.00 0.50 0.00 0.00 175.29 176.71 2k23 n ILE 176 N -2.25 0.00 -1.34 0.00 3.06 -1.26 -4.88 119.36 112.70 2k23 n ILE 176 Ca -0.01 0.00 -0.38 0.00 -2.50 0.00 0.00 62.75 59.86 2k23 n ILE 176 Cb 0.02 -0.15 -0.02 0.00 0.54 0.00 0.00 39.64 40.03 2k23 n ILE 176 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 2k23 n ASP 177 N 0.00 7.70 -0.36 9.51 5.75 -1.26 -4.81 116.55 133.08 2k23 n ASP 177 Ca 0.00 -2.60 0.14 0.00 -0.01 0.00 0.00 54.79 52.33 2k23 n ASP 177 Cb 0.00 -1.54 0.63 0.00 -1.03 0.00 0.00 41.12 39.18 2k23 n ASP 177 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89