#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k23 h ASP 2 N 0.00 0.72 -0.06 1.08 2.03 -2.05 -2.45 116.42 115.69 2k23 h ASP 2 Ca 0.00 -0.24 0.00 0.00 -0.73 0.00 0.00 57.03 56.06 2k23 h ASP 2 Cb 0.00 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.31 2k23 h ASP 2 CO 0.00 0.77 0.00 -1.54 -1.03 0.00 0.00 179.24 177.44 2k23 n SER 3 N -4.48 1.29 -3.55 4.15 3.41 -1.26 -4.35 113.62 108.83 2k23 n SER 3 Ca 0.01 -1.50 -0.28 0.00 -0.26 0.00 0.00 58.87 56.84 2k23 n SER 3 Cb 0.22 -0.03 -0.11 0.00 -0.26 0.00 0.00 64.21 64.03 2k23 n SER 3 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2k23 s THR 4 N -1.93 1.03 -0.47 6.66 -4.23 -0.93 -5.00 115.64 110.77 2k23 s THR 4 Ca 0.37 -2.96 -0.03 0.00 -1.18 0.00 0.00 61.69 57.89 2k23 s THR 4 Cb 0.19 -1.70 0.15 0.00 1.34 0.00 0.00 72.50 72.48 2k23 s THR 4 CO 0.31 -1.13 2.49 0.00 -0.54 0.00 0.00 174.62 175.74 2k23 n GLN 5 N 2.79 2.32 0.00 3.99 6.02 -1.23 -1.53 117.38 129.74 2k23 n GLN 5 Ca 0.24 -2.34 0.00 0.00 -0.01 0.00 0.00 57.00 54.89 2k23 n GLN 5 Cb 0.43 -2.04 0.00 0.00 1.02 0.00 0.00 30.24 29.64 2k23 n GLN 5 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2k23 n ASN 6 N 0.51 0.00 -4.72 1.08 5.15 -1.26 -4.19 115.26 111.82 2k23 n ASN 6 Ca 0.46 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 54.08 2k23 n ASN 6 Cb 0.53 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.71 2k23 n ASN 6 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 2k23 s LEU 7 N 0.00 4.23 0.22 1.20 0.05 -1.26 -4.91 118.68 118.21 2k23 s LEU 7 Ca 0.00 0.48 -0.22 0.00 0.05 0.00 0.00 54.13 54.43 2k23 s LEU 7 Cb 0.00 -2.35 -0.08 0.00 -2.05 0.00 0.00 46.19 41.70 2k23 s LEU 7 CO 0.00 0.09 0.77 -0.63 -0.55 0.00 0.00 176.35 176.04 2k23 s ILE 8 N 0.52 4.45 0.00 1.48 1.01 -1.26 -4.79 121.20 122.61 2k23 s ILE 8 Ca 0.16 1.50 0.00 0.00 0.00 0.00 0.00 60.65 62.31 2k23 s ILE 8 Cb -0.13 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.37 2k23 s ILE 8 CO 0.03 0.31 0.00 -2.65 0.00 0.00 0.00 174.94 172.63 2k23 n PRO 9 N 1.00 0.00 -2.78 2.79 -0.02 -1.26 -4.72 135.00 130.01 2k23 n PRO 9 Ca -0.03 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.02 2k23 n PRO 9 Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.94 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 3.15 -0.05 3.55 0.00 -1.26 -4.55 121.76 122.60 2k23 s ALA 10 Ca 0.00 -1.01 -0.18 0.00 0.00 0.00 0.00 51.96 50.77 2k23 s ALA 10 Cb 0.00 -3.77 -0.05 0.00 0.00 0.00 0.00 23.12 19.30 2k23 s ALA 10 CO 0.00 -2.34 0.48 -1.25 0.00 0.00 0.00 175.76 172.65 2k23 s PRO 11 N 4.10 4.20 0.94 0.00 0.05 -1.26 -5.09 135.00 137.94 2k23 s PRO 11 Ca 0.35 0.51 -0.12 0.00 0.05 0.00 0.00 61.00 61.79 2k23 s PRO 11 Cb -0.11 -3.34 0.16 0.00 0.05 0.00 0.00 34.50 31.26 2k23 s PRO 11 CO 0.23 0.40 1.11 -2.14 0.05 0.00 0.00 177.00 176.64 2k23 s PRO 12 N -0.19 0.89 0.43 0.56 0.02 -1.26 -4.88 135.00 130.57 2k23 s PRO 12 Ca 0.26 0.50 0.27 0.00 0.02 0.00 0.00 61.00 62.05 2k23 s PRO 12 Cb -0.16 -1.79 1.33 0.00 0.02 0.00 0.00 34.50 33.90 2k23 s PRO 12 CO 0.13 -2.41 1.67 1.25 -0.33 0.00 0.00 177.00 177.31 2k23 h LEU 13 N -1.66 0.30 0.00 -5.54 7.12 -1.96 0.59 115.31 114.15 2k23 h LEU 13 Ca -0.52 0.12 0.00 0.00 0.13 0.00 0.00 57.88 57.61 2k23 h LEU 13 Cb 1.32 0.09 0.00 0.00 -0.53 0.00 0.00 40.66 41.54 2k23 h LEU 13 CO 0.59 -0.10 0.00 2.30 -0.13 0.00 0.00 178.44 181.09 2k23 n ILE 14 N -4.66 0.04 0.12 4.05 -5.35 -1.26 -0.87 119.36 111.42 2k23 n ILE 14 Ca 0.33 0.01 0.11 0.00 -0.27 0.00 0.00 62.75 62.93 2k23 n ILE 14 Cb 1.26 -0.80 -0.13 0.00 -1.74 0.00 0.00 39.64 38.23 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 -1.02 0.23 -4.74 7.28 7.64 0.20 -4.95 113.62 118.26 2k23 n SER 15 Ca 0.10 -0.05 -0.38 0.00 1.01 0.00 0.00 58.87 59.56 2k23 n SER 15 Cb 0.05 1.65 -0.06 0.00 -1.01 0.00 0.00 64.21 64.83 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 -3.44 5.19 0.85 0.44 0.11 -0.05 -5.07 120.40 118.43 2k23 s VAL 16 Ca -0.05 0.85 -0.11 0.00 -2.93 0.00 0.00 61.98 59.74 2k23 s VAL 16 Cb 0.14 -3.76 0.11 0.00 -1.53 0.00 0.00 36.38 31.33 2k23 s VAL 16 CO 0.88 0.37 1.11 -2.84 -3.33 0.00 0.00 175.10 171.29 2k23 s PRO 17 N 0.36 1.57 0.11 1.54 0.02 -1.26 -4.99 135.00 132.35 2k23 s PRO 17 Ca 0.24 1.23 0.08 0.00 0.02 0.00 0.00 61.00 62.57 2k23 s PRO 17 Cb -0.15 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 2k23 s PRO 17 CO 0.09 -2.14 -0.21 -1.17 -0.33 0.00 0.00 177.00 173.24 2k23 s LEU 18 N -6.25 2.32 -0.60 -5.54 2.96 -1.26 -3.41 118.68 106.91 2k23 s LEU 18 Ca 0.64 -0.71 -0.27 0.00 -0.22 0.00 0.00 54.13 53.56 2k23 s LEU 18 Cb -0.19 -0.88 -0.00 0.00 0.50 0.00 0.00 46.19 45.61 2k23 s LEU 18 CO 0.57 0.05 1.64 -1.58 -1.32 0.00 0.00 176.35 175.71 2k23 s GLN 19 N -2.05 2.95 0.12 1.98 2.00 0.11 -4.79 119.66 119.98 2k23 s GLN 19 Ca 0.08 0.48 -0.32 0.00 -2.00 0.00 0.00 55.36 53.60 2k23 s GLN 19 Cb -0.09 -4.27 -0.12 0.00 0.80 0.00 0.00 33.01 29.33 2k23 s GLN 19 CO 0.05 -2.36 1.78 -2.30 -0.50 0.00 0.00 175.29 171.96 2k23 n PRO 20 N 9.03 2.62 -3.85 1.67 -0.02 -1.26 -2.65 135.00 140.55 2k23 n PRO 20 Ca 0.15 0.95 -0.28 0.00 -2.02 0.00 0.00 63.50 62.31 2k23 n PRO 20 Cb 0.50 -2.81 0.03 0.00 -0.02 0.00 0.00 33.50 31.20 2k23 n PRO 20 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k23 n GLY 21 N 4.07 -0.45 3.88 -1.23 0.00 -1.26 -4.96 105.19 105.24 2k23 n GLY 21 Ca 0.18 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.38 3.41 0.11 1.61 5.36 -1.08 -5.08 117.98 118.93 2k23 s PHE 22 Ca 0.51 1.06 0.03 0.00 -0.96 0.00 0.00 56.93 57.58 2k23 s PHE 22 Cb -0.25 -2.90 -0.04 0.00 -0.34 0.00 0.00 43.02 39.48 2k23 s PHE 22 CO 0.82 -0.96 -0.08 -0.46 -1.46 0.00 0.00 175.22 173.07 2k23 s TRP 23 N -3.24 1.04 0.17 10.12 -0.00 -1.26 -4.60 118.94 121.17 2k23 s TRP 23 Ca 0.56 -0.81 -0.25 0.00 -0.00 0.00 0.00 56.10 55.61 2k23 s TRP 23 Cb -0.11 -0.57 0.05 0.00 -0.00 0.00 0.00 33.47 32.84 2k23 s TRP 23 CO 0.51 -0.04 1.57 1.79 -0.00 0.00 0.00 176.95 180.78 2k23 h THR 24 N 3.04 0.09 -0.64 5.86 1.35 -1.98 -2.68 112.91 117.96 2k23 h THR 24 Ca -0.36 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.43 2k23 h THR 24 Cb 1.18 0.09 -0.03 0.00 -1.73 0.00 0.00 68.15 67.67 2k23 h THR 24 CO 0.62 0.00 0.12 -0.08 -0.25 0.00 0.00 175.52 175.93 2k23 h GLU 25 N -0.22 1.04 0.00 4.72 4.81 -1.98 -2.93 114.58 120.03 2k23 h GLU 25 Ca 0.19 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2k23 h GLU 25 Cb 0.56 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2k23 h GLU 25 CO -0.69 0.96 0.00 -0.09 -0.73 0.00 0.00 179.01 178.46 2k23 h ARG 26 N 0.96 0.00 -0.01 1.92 9.65 -1.92 -2.90 114.38 122.08 2k23 h ARG 26 Ca 0.20 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.08 2k23 h ARG 26 Cb 0.41 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 2k23 h ARG 26 CO 0.01 0.00 -0.43 0.34 2.80 0.00 0.00 179.97 182.68 2k23 n PHE 27 N -2.38 0.00 -2.58 2.20 7.35 -1.04 -4.94 117.46 116.07 2k23 n PHE 27 Ca 0.05 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.39 2k23 n PHE 27 Cb 0.44 -0.11 -0.04 0.00 0.35 0.00 0.00 39.48 40.12 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 -2.64 4.04 0.00 -4.13 0.74 -1.10 -4.86 119.66 111.71 2k23 s GLN 28 Ca 0.19 1.40 0.00 0.00 0.05 0.00 0.00 55.36 57.00 2k23 s GLN 28 Cb 0.18 -2.33 0.00 0.00 1.10 0.00 0.00 33.01 31.96 2k23 s GLN 28 CO 0.60 -0.23 0.00 0.41 -0.55 0.00 0.00 175.29 175.52 2k23 n GLY 29 N 0.01 0.87 3.63 2.59 0.00 -1.11 -4.98 105.19 106.21 2k23 n GLY 29 Ca 0.07 -2.01 -0.42 0.00 0.00 0.00 0.00 46.02 43.66 2k23 n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k23 s ARG 30 N -1.43 4.12 -0.25 1.61 3.00 -1.26 -1.90 118.95 122.84 2k23 s ARG 30 Ca 0.00 0.85 -0.03 0.00 0.00 0.00 0.00 55.73 56.55 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 -0.58 -0.03 -1.58 0.00 0.00 0.00 175.30 173.11 2k23 s TRP 31 N 2.91 3.06 -0.17 -0.53 0.52 -0.07 -4.72 118.94 119.94 2k23 s TRP 31 Ca 0.35 -1.36 -0.14 0.00 0.02 0.00 0.00 56.10 54.96 2k23 s TRP 31 Cb -0.15 -2.10 -0.04 0.00 -1.15 0.00 0.00 33.47 30.03 2k23 s TRP 31 CO 0.09 -0.68 0.32 -0.06 0.02 0.00 0.00 176.95 176.64 2k23 s PHE 32 N 1.38 3.44 0.24 -1.98 0.08 -0.85 -0.81 117.98 119.48 2k23 s PHE 32 Ca 0.01 0.60 -0.30 0.00 0.12 0.00 0.00 56.93 57.36 2k23 s PHE 32 Cb -0.16 -2.39 -0.09 0.00 -0.57 0.00 0.00 43.02 39.80 2k23 s PHE 32 CO -0.03 0.17 1.32 0.08 -0.10 0.00 0.00 175.22 176.65 2k23 s VAL 33 N 0.69 3.03 0.00 -0.44 1.01 -1.10 0.33 120.40 123.93 2k23 s VAL 33 Ca 0.17 0.90 0.00 0.00 0.00 0.00 0.00 61.98 63.05 2k23 s VAL 33 Cb -0.13 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.67 2k23 s VAL 33 CO 0.05 0.16 0.00 0.52 0.00 0.00 0.00 175.10 175.83 2k23 n VAL 34 N 2.08 0.00 -3.63 2.92 0.31 0.11 -4.70 118.33 115.42 2k23 n VAL 34 Ca 0.04 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.27 2k23 n VAL 34 Cb 0.42 0.24 -0.03 0.00 -0.91 0.00 0.00 33.84 33.56 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 -1.67 -0.29 -0.15 2.92 0.00 -1.03 -2.61 107.32 104.49 2k23 s GLY 35 Ca 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 44.72 44.60 2k23 s GLY 35 CO 0.00 -0.15 0.41 -2.27 0.00 0.00 0.00 173.10 171.09 2k23 s LEU 36 N -2.82 0.45 -0.13 0.66 2.96 -0.13 -0.73 118.68 118.93 2k23 s LEU 36 Ca 0.05 0.82 -0.06 0.00 -0.22 0.00 0.00 54.13 54.72 2k23 s LEU 36 Cb -0.00 1.39 0.06 0.00 0.50 0.00 0.00 46.19 48.13 2k23 s LEU 36 CO -0.08 -0.14 0.31 0.00 -1.32 0.00 0.00 176.35 175.12 2k23 s ALA 37 N 0.22 -0.73 0.00 5.97 0.00 0.18 0.49 121.76 127.89 2k23 s ALA 37 Ca -0.00 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2k23 s ALA 37 Cb -0.03 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2k23 s ALA 37 CO 0.00 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.85 2k23 n GLY 38 N 4.50 2.39 0.20 0.00 0.00 1.00 0.86 105.19 114.14 2k23 n GLY 38 Ca -0.20 -0.72 0.06 0.00 0.00 0.00 0.00 46.02 45.15 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 0.35 1.61 -1.24 -1.76 -0.48 115.58 114.05 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 0.34 -0.13 0.00 -1.29 0.00 0.00 177.43 176.35 2k23 n ALA 40 N -2.33 2.80 -2.46 1.57 0.00 -1.25 -4.79 120.51 114.06 2k23 n ALA 40 Ca -0.01 -0.28 -0.42 0.00 0.00 0.00 0.00 53.44 52.72 2k23 n ALA 40 Cb 0.45 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 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 -2.48 4.28 -1.25 0.00 1.01 -0.19 -4.94 120.40 116.82 2k23 s VAL 41 Ca 0.28 1.58 -0.20 0.00 0.00 0.00 0.00 61.98 63.65 2k23 s VAL 41 Cb 0.20 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2k23 s VAL 41 CO 0.48 -0.04 1.85 0.00 0.00 0.00 0.00 175.10 177.39 2k23 n GLN 42 N 5.58 2.53 -3.11 2.72 10.64 -1.26 -4.84 117.38 129.64 2k23 n GLN 42 Ca 0.12 -2.88 -0.45 0.00 -1.83 0.00 0.00 57.00 51.96 2k23 n GLN 42 Cb 0.46 -3.54 -0.03 0.00 -0.86 0.00 0.00 30.24 26.26 2k23 n GLN 42 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 2k23 s LYS 43 N 4.99 3.31 -0.07 2.61 2.36 -1.26 -3.95 119.74 127.73 2k23 s LYS 43 Ca 0.59 -1.68 -0.22 0.00 -2.55 0.00 0.00 55.97 52.11 2k23 s LYS 43 Cb 0.04 -4.47 -0.18 0.00 -1.05 0.00 0.00 37.83 32.17 2k23 s LYS 43 CO 0.09 -1.55 0.84 1.05 1.55 0.00 0.00 175.35 177.33 2k23 h GLU 44 N 8.79 -0.11 0.00 4.03 -0.00 -1.89 -3.46 114.58 121.94 2k23 h GLU 44 Ca -0.09 0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.28 2k23 h GLU 44 Cb 1.06 0.02 0.00 0.00 -0.00 0.00 0.00 28.75 29.83 2k23 h GLU 44 CO 1.03 0.44 0.00 -2.13 -0.00 0.00 0.00 179.01 178.34 2k23 n ARG 45 N -4.82 0.00 0.07 1.06 0.63 -1.26 -5.02 116.66 107.31 2k23 n ARG 45 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 2k23 n ARG 45 Cb 0.29 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.20 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 -0.05 0.00 0.00 -0.14 10.64 -1.26 -5.11 117.38 121.46 2k23 n GLN 46 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2k23 n GLN 46 Cb 0.00 -0.12 0.00 0.00 -0.86 0.00 0.00 30.24 29.26 2k23 n GLN 46 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2k23 n SER 47 N -3.11 0.00 0.09 2.61 7.64 -1.26 -4.39 113.62 115.20 2k23 n SER 47 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 2k23 n SER 47 Cb 0.05 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.34 2k23 n SER 47 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2k23 h ARG 48 N 0.00 0.00 -7.16 1.43 2.43 -1.94 -3.47 114.38 105.67 2k23 h ARG 48 Ca 0.00 0.00 -0.47 0.00 -0.81 0.00 0.00 59.98 58.70 2k23 h ARG 48 Cb 0.00 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2k23 h ARG 48 CO 0.00 0.00 0.37 0.12 -1.51 0.00 0.00 179.97 178.95 2k23 s PHE 49 N -3.26 3.24 0.01 2.20 5.36 -1.26 -5.01 117.98 119.26 2k23 s PHE 49 Ca 0.03 1.52 0.01 0.00 -0.96 0.00 0.00 56.93 57.53 2k23 s PHE 49 Cb 0.11 -2.90 -0.01 0.00 -0.34 0.00 0.00 43.02 39.88 2k23 s PHE 49 CO 0.75 -0.60 -0.03 0.95 -1.46 0.00 0.00 175.22 174.83 2k23 s THR 50 N -2.41 0.23 0.25 0.12 -4.23 -1.26 -2.38 115.64 105.94 2k23 s THR 50 Ca 0.62 -0.48 -0.30 0.00 -1.18 0.00 0.00 61.69 60.35 2k23 s THR 50 Cb -0.12 -0.26 -0.09 0.00 1.34 0.00 0.00 72.50 73.36 2k23 s THR 50 CO 0.28 -0.17 1.16 0.00 -0.54 0.00 0.00 174.62 175.36 2k23 s MET 51 N -0.68 4.55 0.41 3.99 0.23 0.73 -4.69 119.30 123.83 2k23 s MET 51 Ca -0.05 1.88 0.04 0.00 -1.03 0.00 0.00 55.69 56.54 2k23 s MET 51 Cb -0.05 -3.19 -0.02 0.00 -1.53 0.00 0.00 34.83 30.04 2k23 s MET 51 CO -0.00 0.04 0.16 1.52 -2.03 0.00 0.00 175.02 174.71 2k23 s TYR 52 N -0.72 1.78 -0.22 3.16 -0.85 -1.26 -4.42 117.35 114.82 2k23 s TYR 52 Ca 0.48 -1.38 -0.08 0.00 -0.52 0.00 0.00 57.07 55.57 2k23 s TYR 52 Cb -0.33 -1.09 -0.04 0.00 0.38 0.00 0.00 41.96 40.88 2k23 s TYR 52 CO 0.41 -0.42 0.10 -1.12 -1.52 0.00 0.00 175.55 173.00 2k23 s SER 53 N -3.60 5.66 -0.42 -0.18 0.01 -1.26 -2.71 113.70 111.21 2k23 s SER 53 Ca 0.24 0.02 -0.08 0.00 1.31 0.00 0.00 55.95 57.44 2k23 s SER 53 Cb 0.02 -2.00 0.09 0.00 0.21 0.00 0.00 66.02 64.33 2k23 s SER 53 CO 0.17 0.08 0.26 -0.89 0.41 0.00 0.00 173.24 173.27 2k23 s THR 54 N 0.92 4.09 -0.38 1.44 2.01 0.01 -2.60 115.64 121.13 2k23 s THR 54 Ca 0.05 -1.53 -0.03 0.00 0.31 0.00 0.00 61.69 60.49 2k23 s THR 54 Cb -0.14 -3.56 0.09 0.00 0.01 0.00 0.00 72.50 68.90 2k23 s THR 54 CO 0.03 -0.56 0.15 -0.63 -0.69 0.00 0.00 174.62 172.92 2k23 s ILE 55 N 1.38 3.30 -0.63 1.82 1.01 -0.89 -0.89 121.20 126.30 2k23 s ILE 55 Ca 0.04 -1.81 -0.27 0.00 0.00 0.00 0.00 60.65 58.61 2k23 s ILE 55 Cb -0.23 -3.15 0.03 0.00 0.01 0.00 0.00 42.46 39.12 2k23 s ILE 55 CO 0.01 -0.52 1.16 -0.31 0.00 0.00 0.00 174.94 175.28 2k23 s TYR 56 N 1.20 2.54 -0.56 3.97 2.02 -0.80 -0.19 117.35 125.53 2k23 s TYR 56 Ca 0.04 0.12 -0.20 0.00 -0.37 0.00 0.00 57.07 56.66 2k23 s TYR 56 Cb -0.22 -4.47 0.07 0.00 -0.40 0.00 0.00 41.96 36.95 2k23 s TYR 56 CO -0.03 -1.71 0.75 -2.00 -1.57 0.00 0.00 175.55 170.99 2k23 s GLU 57 N 4.98 3.13 -0.05 -0.62 2.56 -0.38 -2.74 118.70 125.57 2k23 s GLU 57 Ca 0.37 -0.91 -0.30 0.00 0.00 0.00 0.00 54.97 54.13 2k23 s GLU 57 Cb -0.09 -4.16 -0.06 0.00 2.00 0.00 0.00 34.13 31.82 2k23 s GLU 57 CO 0.20 -1.45 1.69 -1.17 -0.56 0.00 0.00 175.26 173.97 2k23 s LEU 58 N 3.09 4.31 0.00 2.70 2.96 -1.26 0.39 118.68 130.87 2k23 s LEU 58 Ca 0.17 2.26 0.02 0.00 -0.22 0.00 0.00 54.13 56.36 2k23 s LEU 58 Cb -0.19 -3.53 0.08 0.00 0.50 0.00 0.00 46.19 43.05 2k23 s LEU 58 CO 0.11 -0.96 0.59 0.00 -1.32 0.00 0.00 176.35 174.77 2k23 n GLN 59 N 7.21 0.36 0.00 1.98 1.13 -0.65 -4.94 117.38 122.47 2k23 n GLN 59 Ca 0.18 -1.79 0.08 0.00 -1.94 0.00 0.00 57.00 53.53 2k23 n GLN 59 Cb 0.43 -0.33 0.37 0.00 0.11 0.00 0.00 30.24 30.82 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 -2.04 0.06 -1.68 -1.09 0.28 -1.26 -2.77 120.64 112.14 2k23 n GLU 60 Ca 0.10 0.20 -0.07 0.00 -0.16 0.00 0.00 57.16 57.23 2k23 n GLU 60 Cb 0.37 -1.50 0.08 0.00 1.43 0.00 0.00 31.44 31.82 2k23 n GLU 60 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2k23 n ASP 61 N -1.45 2.86 -0.48 -1.84 2.03 -1.26 -4.95 116.55 111.46 2k23 n ASP 61 Ca 0.05 -3.26 -0.04 0.00 0.52 0.00 0.00 54.79 52.06 2k23 n ASP 61 Cb 0.18 -0.42 -0.02 0.00 -0.72 0.00 0.00 41.12 40.15 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 -0.65 -2.69 -4.69 1.67 0.23 -1.11 -4.91 115.26 103.10 2k23 n ASN 62 Ca 0.25 0.09 -0.40 0.00 -0.53 0.00 0.00 54.58 53.99 2k23 n ASN 62 Cb 0.88 -2.12 -0.05 0.00 -2.08 0.00 0.00 39.78 36.41 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 -1.26 6.84 -0.06 0.53 1.04 -1.26 -4.27 113.70 115.27 2k23 s SER 63 Ca 0.00 1.02 -0.19 0.00 0.48 0.00 0.00 55.95 57.26 2k23 s SER 63 Cb 0.00 -2.38 -0.05 0.00 0.10 0.00 0.00 66.02 63.70 2k23 s SER 63 CO 0.00 -0.18 0.52 -0.31 0.98 0.00 0.00 173.24 174.25 2k23 s TYR 64 N 1.26 3.60 -0.72 5.02 2.02 0.21 -1.64 117.35 127.09 2k23 s TYR 64 Ca 0.33 1.03 -0.25 0.00 -0.37 0.00 0.00 57.07 57.81 2k23 s TYR 64 Cb -0.17 -2.55 0.05 0.00 -0.40 0.00 0.00 41.96 38.89 2k23 s TYR 64 CO 0.14 0.28 1.15 -0.80 -1.57 0.00 0.00 175.55 174.75 2k23 s ASN 65 N 0.15 6.20 -0.47 2.29 -0.87 0.16 -1.81 114.94 120.60 2k23 s ASN 65 Ca 0.28 -0.78 -0.18 0.00 -1.57 0.00 0.00 52.86 50.61 2k23 s ASN 65 Cb -0.16 -2.49 0.04 0.00 -0.02 0.00 0.00 41.25 38.61 2k23 s ASN 65 CO 0.13 -1.63 0.54 -0.69 -2.57 0.00 0.00 177.10 172.89 2k23 s VAL 66 N 4.89 4.97 -0.74 1.60 1.01 0.22 -1.25 120.40 131.09 2k23 s VAL 66 Ca 0.30 -0.43 -0.22 0.00 0.00 0.00 0.00 61.98 61.63 2k23 s VAL 66 Cb -0.11 -4.19 0.08 0.00 0.00 0.00 0.00 36.38 32.16 2k23 s VAL 66 CO 0.11 -0.63 1.05 -0.89 0.00 0.00 0.00 175.10 174.73 2k23 s THR 67 N 2.39 4.34 -0.33 3.92 2.01 0.73 -1.38 115.64 127.33 2k23 s THR 67 Ca 0.14 -0.58 -0.12 0.00 0.31 0.00 0.00 61.69 61.43 2k23 s THR 67 Cb -0.18 -4.74 -0.02 0.00 0.01 0.00 0.00 72.50 67.56 2k23 s THR 67 CO 0.13 -1.53 0.22 -0.44 -0.69 0.00 0.00 174.62 172.32 2k23 s SER 68 N 3.76 6.00 -0.38 3.53 0.01 -1.04 -2.09 113.70 123.48 2k23 s SER 68 Ca 0.27 -0.37 -0.17 0.00 1.31 0.00 0.00 55.95 56.99 2k23 s SER 68 Cb -0.13 -2.12 0.01 0.00 0.21 0.00 0.00 66.02 63.99 2k23 s SER 68 CO 0.05 -0.20 0.42 -0.51 0.41 0.00 0.00 173.24 173.41 2k23 s ILE 69 N 1.72 5.11 0.37 1.44 2.07 -1.07 0.50 121.20 131.33 2k23 s ILE 69 Ca 0.06 -0.13 0.08 0.00 -1.41 0.00 0.00 60.65 59.25 2k23 s ILE 69 Cb -0.17 -3.95 -0.07 0.00 0.13 0.00 0.00 42.46 38.39 2k23 s ILE 69 CO 0.10 -0.28 -0.03 -0.76 -1.91 0.00 0.00 174.94 172.06 2k23 s LEU 70 N 2.13 2.75 -0.61 8.50 1.02 -0.78 -4.19 118.68 127.49 2k23 s LEU 70 Ca 0.13 -1.29 -0.22 0.00 0.02 0.00 0.00 54.13 52.76 2k23 s LEU 70 Cb -0.17 -0.88 0.07 0.00 0.02 0.00 0.00 46.19 45.23 2k23 s LEU 70 CO 0.13 -0.36 0.90 -0.69 0.02 0.00 0.00 176.35 176.35 2k23 s VAL 71 N -2.74 4.44 -0.35 -1.59 1.01 -1.26 -1.17 120.40 118.75 2k23 s VAL 71 Ca 0.34 -0.31 -0.13 0.00 0.00 0.00 0.00 61.98 61.88 2k23 s VAL 71 Cb 0.07 -4.60 -0.01 0.00 0.00 0.00 0.00 36.38 31.84 2k23 s VAL 71 CO 0.17 -1.29 0.24 -0.13 0.00 0.00 0.00 175.10 174.09 2k23 s ARG 72 N 3.75 3.41 6.23 2.72 1.81 -0.21 -4.85 118.95 131.82 2k23 s ARG 72 Ca 0.22 -0.70 0.00 0.00 -1.72 0.00 0.00 55.73 53.53 2k23 s ARG 72 Cb -0.17 -3.81 0.00 0.00 -0.45 0.00 0.00 34.95 30.52 2k23 s ARG 72 CO 0.12 -0.48 0.00 0.41 -0.68 0.00 0.00 175.30 174.67 2k23 n GLY 73 N 5.10 1.74 0.19 -3.53 0.00 -1.26 -2.96 105.19 104.47 2k23 n GLY 73 Ca -0.13 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.68 2k23 n GLY 73 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k23 n GLN 74 N 1.39 0.95 -1.38 1.61 6.02 -1.26 -5.07 117.38 119.64 2k23 n GLN 74 Ca 0.00 -2.03 0.00 0.00 -0.01 0.00 0.00 57.00 54.96 2k23 n GLN 74 Cb 0.00 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 30.09 2k23 n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k23 n GLY 75 N -0.95 3.82 3.46 1.08 0.00 -1.15 -5.15 105.19 106.30 2k23 n GLY 75 Ca 0.10 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.33 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 0.32 0.05 -0.55 0.00 3.52 -0.32 -4.86 118.95 117.10 2k23 s ARG 77 Ca -0.06 0.06 -0.28 0.00 -0.13 0.00 0.00 55.73 55.33 2k23 s ARG 77 Cb -0.15 0.01 0.03 0.00 -1.56 0.00 0.00 34.95 33.29 2k23 s ARG 77 CO 0.04 -0.01 1.16 0.71 -0.81 0.00 0.00 175.30 176.38 2k23 s TYR 78 N 0.06 2.67 -0.51 5.12 2.02 -1.26 -1.87 117.35 123.58 2k23 s TYR 78 Ca -0.00 0.44 -0.22 0.00 -0.37 0.00 0.00 57.07 56.92 2k23 s TYR 78 Cb -0.01 -4.46 0.04 0.00 -0.40 0.00 0.00 41.96 37.14 2k23 s TYR 78 CO -0.00 -1.50 0.79 -0.46 -1.57 0.00 0.00 175.55 172.81 2k23 s TRP 79 N 4.75 2.93 -0.21 2.71 -0.00 0.18 -4.85 118.94 124.45 2k23 s TRP 79 Ca 0.43 -0.17 -0.06 0.00 -0.00 0.00 0.00 56.10 56.31 2k23 s TRP 79 Cb -0.08 -3.77 -0.03 0.00 -0.00 0.00 0.00 33.47 29.59 2k23 s TRP 79 CO 0.26 -1.15 0.02 0.42 -0.00 0.00 0.00 176.95 176.50 2k23 s ILE 80 N 3.32 4.13 0.07 5.86 1.01 -1.26 -2.49 121.20 131.84 2k23 s ILE 80 Ca 0.25 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2k23 s ILE 80 Cb -0.15 -2.88 0.00 0.00 0.01 0.00 0.00 42.46 39.44 2k23 s ILE 80 CO 0.17 0.41 0.02 -1.14 0.00 0.00 0.00 174.94 174.40 2k23 n ARG 81 N 4.29 1.69 -4.74 2.79 3.00 -0.48 -4.86 116.66 118.36 2k23 n ARG 81 Ca -0.17 -0.49 -0.27 0.00 -0.00 0.00 0.00 57.85 56.92 2k23 n ARG 81 Cb 0.52 0.11 -0.17 0.00 0.00 0.00 0.00 32.46 32.92 2k23 n ARG 81 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2k23 s THR 82 N -0.97 1.43 -0.11 5.15 2.01 -1.25 0.68 115.64 122.58 2k23 s THR 82 Ca 0.01 -0.64 -0.02 0.00 0.31 0.00 0.00 61.69 61.35 2k23 s THR 82 Cb -0.00 -1.28 -0.03 0.00 0.01 0.00 0.00 72.50 71.20 2k23 s THR 82 CO 0.01 0.42 -0.05 -0.36 -0.69 0.00 0.00 174.62 173.95 2k23 s PHE 83 N 0.62 3.01 0.01 4.92 0.08 -0.75 0.75 117.98 126.62 2k23 s PHE 83 Ca -0.15 -0.12 0.03 0.00 0.12 0.00 0.00 56.93 56.81 2k23 s PHE 83 Cb -0.16 -1.84 -0.01 0.00 -0.57 0.00 0.00 43.02 40.44 2k23 s PHE 83 CO 0.04 0.17 -0.08 0.14 -0.10 0.00 0.00 175.22 175.39 2k23 s VAL 84 N -0.25 0.64 0.14 -0.44 -7.23 0.12 0.63 120.40 114.01 2k23 s VAL 84 Ca 0.04 -0.62 -0.31 0.00 -1.81 0.00 0.00 61.98 59.28 2k23 s VAL 84 Cb -0.13 -0.59 -0.09 0.00 0.56 0.00 0.00 36.38 36.13 2k23 s VAL 84 CO 0.02 -0.01 1.52 -2.16 -0.31 0.00 0.00 175.10 174.16 2k23 s PRO 85 N -0.70 4.25 0.00 4.82 0.04 -1.26 -0.53 135.00 141.61 2k23 s PRO 85 Ca -0.01 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.30 2k23 s PRO 85 Cb -0.05 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.26 2k23 s PRO 85 CO 0.00 -0.57 0.00 -1.13 0.04 0.00 0.00 177.00 175.35 2k23 n SER 86 N 4.11 0.00 0.31 6.66 3.41 -0.21 -4.79 113.62 123.11 2k23 n SER 86 Ca 0.13 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.94 2k23 n SER 86 Cb 0.40 0.00 0.99 0.00 -0.26 0.00 0.00 64.21 65.34 2k23 n SER 86 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2k23 h SER 87 N 0.00 0.00 -3.67 4.04 0.02 -1.96 -3.42 113.55 108.56 2k23 h SER 87 Ca 0.00 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.79 2k23 h SER 87 Cb 0.00 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 62.28 2k23 h SER 87 CO 0.00 0.01 -0.40 0.00 -1.14 0.00 0.00 176.83 175.30 2k23 s ARG 88 N -4.01 0.30 0.36 3.45 3.03 -1.26 -5.14 118.95 115.69 2k23 s ARG 88 Ca -0.03 0.46 -0.28 0.00 2.03 0.00 0.00 55.73 57.91 2k23 s ARG 88 Cb 0.12 0.08 -0.11 0.00 -1.03 0.00 0.00 34.95 34.00 2k23 s ARG 88 CO 0.48 -0.08 1.44 -0.35 -1.13 0.00 0.00 175.30 175.66 2k23 n PRO 89 N 3.34 2.52 0.00 3.89 -0.04 -1.26 -2.24 135.00 141.21 2k23 n PRO 89 Ca -0.17 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.18 2k23 n PRO 89 Cb 0.57 -2.58 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 2k23 n PRO 89 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k23 n GLY 90 N 0.69 3.10 3.56 0.55 0.00 -1.26 -4.65 105.19 107.17 2k23 n GLY 90 Ca 0.03 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 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 3.57 0.14 1.61 0.74 -0.95 -3.65 119.66 121.12 2k23 s GLN 91 Ca 0.00 -0.03 0.08 0.00 0.05 0.00 0.00 55.36 55.45 2k23 s GLN 91 Cb 0.00 -3.85 -0.04 0.00 1.10 0.00 0.00 33.01 30.21 2k23 s GLN 91 CO 0.00 -0.85 -0.08 -0.06 -0.55 0.00 0.00 175.29 173.75 2k23 s PHE 92 N 2.84 2.73 0.29 1.67 0.08 0.26 -1.05 117.98 124.80 2k23 s PHE 92 Ca 0.25 -0.17 0.07 0.00 0.12 0.00 0.00 56.93 57.20 2k23 s PHE 92 Cb -0.14 -1.38 -0.03 0.00 -0.57 0.00 0.00 43.02 40.91 2k23 s PHE 92 CO 0.17 0.47 0.24 -2.37 -0.10 0.00 0.00 175.22 173.63 2k23 n THR 93 N 0.33 0.00 -3.46 0.64 5.66 0.31 -0.71 114.28 117.06 2k23 n THR 93 Ca -0.12 -2.13 -0.38 0.00 -3.05 0.00 0.00 64.05 58.38 2k23 n THR 93 Cb 0.54 1.06 -0.06 0.00 -1.55 0.00 0.00 70.33 70.31 2k23 n THR 93 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2k23 s LEU 94 N 0.00 4.37 0.43 1.09 2.01 -1.26 0.13 118.68 125.45 2k23 s LEU 94 Ca 0.34 0.82 0.24 0.00 0.01 0.00 0.00 54.13 55.55 2k23 s LEU 94 Cb 0.02 -2.57 1.25 0.00 0.01 0.00 0.00 46.19 44.90 2k23 s LEU 94 CO 0.24 0.19 1.75 1.23 1.01 0.00 0.00 176.35 180.77 2k23 h GLY 95 N 5.70 1.00 -5.47 -3.19 0.00 0.07 0.56 103.07 101.73 2k23 h GLY 95 Ca -0.46 -0.15 -0.48 0.00 0.00 0.00 0.00 47.33 46.24 2k23 h GLY 95 CO 0.68 -0.16 -1.06 -2.01 0.00 0.00 0.00 176.54 173.99 2k23 n ASN 96 N -4.55 1.98 0.14 0.19 2.85 -1.26 -4.81 115.26 109.80 2k23 n ASN 96 Ca 0.28 -3.11 -0.00 0.00 -0.11 0.00 0.00 54.58 51.63 2k23 n ASN 96 Cb 1.06 -0.57 0.19 0.00 1.24 0.00 0.00 39.78 41.70 2k23 n ASN 96 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 2k23 h ILE 97 N 2.02 1.38 0.00 -1.44 6.09 -1.23 -3.34 117.51 120.99 2k23 h ILE 97 Ca 0.07 -2.06 0.00 0.00 -1.37 0.00 0.00 64.86 61.50 2k23 h ILE 97 Cb 0.94 2.13 0.00 0.00 0.47 0.00 0.00 36.82 40.36 2k23 h ILE 97 CO 0.59 0.58 0.00 0.00 -3.07 0.00 0.00 178.15 176.25 2k23 n HIS 98 N -3.76 0.00 0.95 2.19 1.44 -1.26 0.77 115.22 115.55 2k23 n HIS 98 Ca -0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.81 2k23 n HIS 98 Cb 0.61 0.00 0.31 0.00 0.12 0.00 0.00 29.99 31.03 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 -0.68 2.17 -4.70 4.39 7.64 -1.25 -4.98 113.62 116.21 2k23 n SER 99 Ca 0.05 -1.81 -0.44 0.00 1.01 0.00 0.00 58.87 57.69 2k23 n SER 99 Cb 0.02 -0.15 -0.02 0.00 -1.01 0.00 0.00 64.21 63.05 2k23 n SER 99 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k23 n TYR 100 N 0.66 2.37 -0.06 1.43 0.18 0.23 -4.96 117.16 117.00 2k23 n TYR 100 Ca 0.17 0.41 -0.10 0.00 1.88 0.00 0.00 57.90 60.26 2k23 n TYR 100 Cb 0.40 -2.48 -0.10 0.00 -0.38 0.00 0.00 39.34 36.78 2k23 n TYR 100 CO 0.00 0.00 0.00 -1.00 -2.08 0.00 0.00 176.86 173.78 2k23 h PRO 101 N 4.00 -0.00 -0.01 -3.48 0.13 -1.94 -3.42 132.00 127.28 2k23 h PRO 101 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2k23 h PRO 101 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2k23 h PRO 101 CO 0.74 0.73 0.00 0.00 -0.23 0.00 0.00 178.00 179.23 2k23 n GLN 102 N -4.66 0.61 -2.24 0.86 10.64 -1.26 -4.96 117.38 116.37 2k23 n GLN 102 Ca -0.07 -0.94 -0.35 0.00 -1.83 0.00 0.00 57.00 53.80 2k23 n GLN 102 Cb 0.35 -1.02 -0.04 0.00 -0.86 0.00 0.00 30.24 28.67 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 -0.43 3.57 0.27 -0.39 1.01 -1.26 -2.53 121.20 121.43 2k23 s ILE 103 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.50 2k23 s ILE 103 Cb 0.01 -4.36 0.26 0.00 0.01 0.00 0.00 42.46 38.37 2k23 s ILE 103 CO 0.01 -1.30 1.79 1.56 0.00 0.00 0.00 174.94 177.01 2k23 h GLN 104 N 11.77 0.76 -1.64 2.79 1.08 -0.78 -3.44 115.11 125.66 2k23 h GLN 104 Ca -0.04 -0.05 0.06 0.00 -1.45 0.00 0.00 58.65 57.17 2k23 h GLN 104 Cb 1.06 -0.17 -0.22 0.00 -0.05 0.00 0.00 27.48 28.09 2k23 h GLN 104 CO 1.27 0.50 0.49 -1.54 -0.95 0.00 0.00 178.83 178.60 2k23 s SER 105 N -5.53 -0.42 -0.17 1.46 1.04 -1.23 -5.00 113.70 103.85 2k23 s SER 105 Ca -0.12 0.45 -0.03 0.00 0.48 0.00 0.00 55.95 56.74 2k23 s SER 105 Cb 0.22 0.34 0.05 0.00 0.10 0.00 0.00 66.02 66.74 2k23 s SER 105 CO 0.79 -0.39 0.03 -0.47 0.98 0.00 0.00 173.24 174.18 2k23 s TYR 106 N -1.13 0.97 -0.03 5.02 6.14 -1.26 -1.64 117.35 125.42 2k23 s TYR 106 Ca -0.03 -0.75 -0.04 0.00 0.64 0.00 0.00 57.07 56.88 2k23 s TYR 106 Cb -0.00 -0.99 0.01 0.00 0.42 0.00 0.00 41.96 41.39 2k23 s TYR 106 CO 0.03 -0.57 0.11 0.16 0.64 0.00 0.00 175.55 175.92 2k23 s ASP 107 N 1.88 -0.07 -0.05 4.32 1.47 -0.99 -4.35 116.67 118.88 2k23 s ASP 107 Ca 0.00 0.10 -0.03 0.00 1.18 0.00 0.00 52.55 53.80 2k23 s ASP 107 Cb -0.16 0.23 0.02 0.00 -0.34 0.00 0.00 42.92 42.67 2k23 s ASP 107 CO -0.08 -0.13 0.11 0.54 0.68 0.00 0.00 175.17 176.30 2k23 s VAL 108 N -0.34 -0.03 -0.00 2.11 0.11 0.11 -0.00 120.40 122.37 2k23 s VAL 108 Ca -0.04 0.09 0.07 0.00 -2.93 0.00 0.00 61.98 59.17 2k23 s VAL 108 Cb -0.03 -0.18 -0.02 0.00 -1.53 0.00 0.00 36.38 34.62 2k23 s VAL 108 CO 0.00 0.04 -0.22 -1.10 -3.33 0.00 0.00 175.10 170.49 2k23 s GLN 109 N 0.61 1.73 -0.21 1.54 -0.21 -0.66 0.89 119.66 123.35 2k23 s GLN 109 Ca -0.05 -0.84 -0.17 0.00 0.02 0.00 0.00 55.36 54.32 2k23 s GLN 109 Cb -0.06 -1.72 -0.04 0.00 1.00 0.00 0.00 33.01 32.19 2k23 s GLN 109 CO -0.03 0.47 0.46 0.54 -2.12 0.00 0.00 175.29 174.61 2k23 s VAL 110 N -0.59 5.15 0.19 1.09 0.11 -1.24 -1.05 120.40 124.07 2k23 s VAL 110 Ca 0.09 0.82 -0.01 0.00 -2.93 0.00 0.00 61.98 59.94 2k23 s VAL 110 Cb -0.09 -3.78 -0.07 0.00 -1.53 0.00 0.00 36.38 30.91 2k23 s VAL 110 CO -0.00 0.20 1.49 0.00 -3.33 0.00 0.00 175.10 173.46 2k23 h ALA 111 N 7.50 0.69 -2.30 1.54 0.00 -0.18 0.31 119.26 126.83 2k23 h ALA 111 Ca -0.34 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 53.99 2k23 h ALA 111 Cb 1.16 -0.07 -0.24 0.00 0.00 0.00 0.00 17.79 18.63 2k23 h ALA 111 CO 0.72 0.72 -0.20 0.16 0.00 0.00 0.00 179.25 180.65 2k23 s ASP 112 N -6.94 -0.70 -0.04 0.00 -4.77 -1.24 -3.53 116.67 99.44 2k23 s ASP 112 Ca -0.06 1.24 0.00 0.00 -3.30 0.00 0.00 52.55 50.43 2k23 s ASP 112 Cb 0.11 1.46 0.02 0.00 -1.09 0.00 0.00 42.92 43.43 2k23 s ASP 112 CO 0.83 -0.22 -0.02 0.28 0.70 0.00 0.00 175.17 176.74 2k23 s THR 113 N 2.18 0.36 0.20 2.11 -1.32 -1.26 -1.84 115.64 116.07 2k23 s THR 113 Ca -0.07 0.01 0.01 0.00 -1.21 0.00 0.00 61.69 60.43 2k23 s THR 113 Cb -0.10 -0.44 -0.05 0.00 -1.51 0.00 0.00 72.50 70.41 2k23 s THR 113 CO -0.16 0.20 0.06 -1.81 -2.21 0.00 0.00 174.62 170.70 2k23 s ASP 114 N 1.16 0.89 0.26 8.08 1.01 -1.25 -5.04 116.67 121.77 2k23 s ASP 114 Ca -0.08 -1.29 0.10 0.00 0.71 0.00 0.00 52.55 52.00 2k23 s ASP 114 Cb -0.14 0.20 0.31 0.00 1.01 0.00 0.00 42.92 44.31 2k23 s ASP 114 CO -0.02 -0.69 1.58 0.10 0.21 0.00 0.00 175.17 176.35 2k23 h TYR 115 N 2.60 0.00 0.00 4.23 -0.00 -1.95 -3.36 116.97 118.50 2k23 h TYR 115 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.36 2k23 h TYR 115 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.96 2k23 h TYR 115 CO 0.46 0.65 -0.88 -0.25 -0.00 0.00 0.00 178.16 178.14 2k23 n ASP 116 N -3.75 4.14 -3.60 0.10 8.00 -1.26 -4.92 116.55 115.27 2k23 n ASP 116 Ca -0.01 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.19 2k23 n ASP 116 Cb 0.64 0.32 0.27 0.00 -0.02 0.00 0.00 41.12 42.33 2k23 n ASP 116 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2k23 s GLN 117 N -1.88 -2.20 0.45 -1.24 2.00 -1.26 -4.54 119.66 111.00 2k23 s GLN 117 Ca 0.00 0.04 0.06 0.00 -2.00 0.00 0.00 55.36 53.46 2k23 s GLN 117 Cb 0.00 -1.47 0.01 0.00 0.80 0.00 0.00 33.01 32.35 2k23 s GLN 117 CO 0.00 -4.37 0.62 -0.59 -0.50 0.00 0.00 175.29 170.44 2k23 s PHE 118 N -2.61 2.84 -0.05 1.67 -0.71 -1.26 -4.17 117.98 113.69 2k23 s PHE 118 Ca 0.70 -0.29 0.02 0.00 -1.04 0.00 0.00 56.93 56.33 2k23 s PHE 118 Cb -0.11 -2.46 0.01 0.00 -1.21 0.00 0.00 43.02 39.25 2k23 s PHE 118 CO 0.57 -0.51 -0.10 0.00 -1.34 0.00 0.00 175.22 173.83 2k23 s ALA 119 N -2.45 1.06 -0.33 1.99 0.00 0.63 -3.92 121.76 118.74 2k23 s ALA 119 Ca 0.55 -0.35 -0.06 0.00 0.00 0.00 0.00 51.96 52.10 2k23 s ALA 119 Cb -0.10 -0.46 0.04 0.00 0.00 0.00 0.00 23.12 22.60 2k23 s ALA 119 CO 0.34 0.12 0.09 -1.64 0.00 0.00 0.00 175.76 174.68 2k23 s MET 120 N 0.50 2.64 -0.07 0.00 -1.94 -0.76 -1.30 119.30 118.37 2k23 s MET 120 Ca -0.10 -1.16 0.05 0.00 -1.71 0.00 0.00 55.69 52.77 2k23 s MET 120 Cb -0.13 -3.43 -0.01 0.00 2.01 0.00 0.00 34.83 33.27 2k23 s MET 120 CO 0.02 -0.65 -0.25 0.08 -0.01 0.00 0.00 175.02 174.22 2k23 s VAL 121 N 1.40 2.07 -0.25 -6.03 1.01 -0.85 0.29 120.40 118.04 2k23 s VAL 121 Ca -0.02 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 60.81 2k23 s VAL 121 Cb -0.19 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 2k23 s VAL 121 CO 0.02 0.57 0.17 0.12 0.00 0.00 0.00 175.10 175.98 2k23 s PHE 122 N -0.02 3.28 -0.13 5.22 2.19 -0.21 -0.23 117.98 128.08 2k23 s PHE 122 Ca -0.08 0.18 -0.01 0.00 0.33 0.00 0.00 56.93 57.35 2k23 s PHE 122 Cb -0.15 -2.30 -0.02 0.00 -1.31 0.00 0.00 43.02 39.24 2k23 s PHE 122 CO 0.05 -0.01 -0.09 -0.06 1.83 0.00 0.00 175.22 176.93 2k23 s PHE 123 N 1.29 2.89 -0.13 10.12 0.40 0.19 -1.65 117.98 131.11 2k23 s PHE 123 Ca 0.07 -0.47 0.00 0.00 -0.60 0.00 0.00 56.93 55.94 2k23 s PHE 123 Cb -0.14 -1.87 -0.01 0.00 0.51 0.00 0.00 43.02 41.50 2k23 s PHE 123 CO 0.07 -0.11 -0.14 -1.14 0.70 0.00 0.00 175.22 174.59 2k23 s GLN 124 N 0.27 3.34 -0.17 0.44 -0.44 1.00 -0.29 119.66 123.80 2k23 s GLN 124 Ca -0.07 -0.71 -0.02 0.00 -2.50 0.00 0.00 55.36 52.06 2k23 s GLN 124 Cb -0.15 -2.59 0.05 0.00 -1.64 0.00 0.00 33.01 28.68 2k23 s GLN 124 CO 0.04 0.20 0.00 0.21 0.50 0.00 0.00 175.29 176.24 2k23 s LYS 125 N 0.38 0.91 -0.14 1.67 2.47 0.12 -2.35 119.74 122.81 2k23 s LYS 125 Ca -0.12 -0.42 -0.01 0.00 -1.56 0.00 0.00 55.97 53.86 2k23 s LYS 125 Cb -0.16 -1.97 -0.02 0.00 -1.46 0.00 0.00 37.83 34.22 2k23 s LYS 125 CO 0.06 -0.54 -0.11 0.99 0.16 0.00 0.00 175.35 175.90 2k23 s THR 126 N 1.78 3.16 -0.23 3.43 2.01 -0.65 0.26 115.64 125.40 2k23 s THR 126 Ca -0.00 -0.62 -0.16 0.00 0.31 0.00 0.00 61.69 61.22 2k23 s THR 126 Cb -0.16 -2.34 0.07 0.00 0.01 0.00 0.00 72.50 70.07 2k23 s THR 126 CO -0.07 0.51 0.58 -0.44 -0.69 0.00 0.00 174.62 174.51 2k23 s SER 127 N 0.43 -0.72 -1.50 3.53 0.01 -0.67 0.02 113.70 114.79 2k23 s SER 127 Ca -0.09 1.24 -0.02 0.00 1.31 0.00 0.00 55.95 58.39 2k23 s SER 127 Cb -0.16 1.16 0.00 0.00 0.21 0.00 0.00 66.02 67.24 2k23 s SER 127 CO 0.05 -0.22 0.30 1.21 0.41 0.00 0.00 173.24 174.99 2k23 n GLU 128 N 3.80 -3.09 -0.68 12.44 4.07 -1.05 -0.35 120.64 135.78 2k23 n GLU 128 Ca -0.19 0.87 0.00 0.00 -0.06 0.00 0.00 57.16 57.78 2k23 n GLU 128 Cb 0.57 -5.48 0.00 0.00 -0.06 0.00 0.00 31.44 26.46 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 -1.87 -0.04 -4.50 4.31 5.03 -1.26 -4.92 115.26 112.01 2k23 n ASN 129 Ca -0.16 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 54.86 2k23 n ASN 129 Cb 0.64 -1.62 -0.05 0.00 -1.02 0.00 0.00 39.78 37.73 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 -0.65 3.27 -0.27 3.52 -0.14 0.53 -4.99 119.74 121.00 2k23 s LYS 130 Ca 0.00 -0.46 -0.24 0.00 -1.36 0.00 0.00 55.97 53.91 2k23 s LYS 130 Cb 0.00 -4.07 -0.00 0.00 -1.68 0.00 0.00 37.83 32.08 2k23 s LYS 130 CO 0.00 -1.41 0.82 -0.65 -0.76 0.00 0.00 175.35 173.35 2k23 s GLN 131 N 3.55 4.09 0.14 1.68 -0.21 -1.26 -1.67 119.66 125.98 2k23 s GLN 131 Ca 0.26 0.80 0.09 0.00 0.02 0.00 0.00 55.36 56.53 2k23 s GLN 131 Cb -0.15 -3.68 -0.04 0.00 1.00 0.00 0.00 33.01 30.14 2k23 s GLN 131 CO 0.17 -0.60 -0.21 0.71 -2.12 0.00 0.00 175.29 173.23 2k23 s TYR 132 N 2.93 1.96 0.13 0.91 2.02 0.14 -4.17 117.35 121.28 2k23 s TYR 132 Ca 0.34 -0.42 -0.17 0.00 -0.37 0.00 0.00 57.07 56.45 2k23 s TYR 132 Cb -0.15 -1.02 0.04 0.00 -0.40 0.00 0.00 41.96 40.43 2k23 s TYR 132 CO 0.10 0.32 0.44 -0.59 -1.57 0.00 0.00 175.55 174.24 2k23 s PHE 133 N -1.52 -0.25 -0.02 2.71 -0.71 -1.26 0.15 117.98 117.07 2k23 s PHE 133 Ca 0.13 -0.05 -0.20 0.00 -1.04 0.00 0.00 56.93 55.77 2k23 s PHE 133 Cb -0.08 0.31 0.04 0.00 -1.21 0.00 0.00 43.02 42.08 2k23 s PHE 133 CO 0.06 -0.74 0.43 0.21 -1.34 0.00 0.00 175.22 173.85 2k23 s LYS 134 N -3.80 0.80 -0.14 1.99 2.36 0.60 -2.88 119.74 118.68 2k23 s LYS 134 Ca 0.03 -0.05 -0.03 0.00 -2.55 0.00 0.00 55.97 53.37 2k23 s LYS 134 Cb 0.01 0.37 -0.03 0.00 -1.05 0.00 0.00 37.83 37.13 2k23 s LYS 134 CO -0.12 -0.23 -0.04 0.54 1.55 0.00 0.00 175.35 177.05 2k23 s VAL 135 N -1.32 3.86 -0.02 4.02 0.11 0.25 0.57 120.40 127.87 2k23 s VAL 135 Ca -0.13 -0.38 0.08 0.00 -2.93 0.00 0.00 61.98 58.62 2k23 s VAL 135 Cb -0.03 -2.67 -0.02 0.00 -1.53 0.00 0.00 36.38 32.13 2k23 s VAL 135 CO 0.06 0.51 -0.25 0.28 -3.33 0.00 0.00 175.10 172.37 2k23 s THR 136 N 0.15 1.96 -0.38 5.04 -1.32 0.68 -0.64 115.64 121.13 2k23 s THR 136 Ca -0.02 -1.06 -0.13 0.00 -1.21 0.00 0.00 61.69 59.27 2k23 s THR 136 Cb -0.14 -1.63 0.01 0.00 -1.51 0.00 0.00 72.50 69.24 2k23 s THR 136 CO 0.03 0.56 0.25 -0.22 -2.21 0.00 0.00 174.62 173.02 2k23 s LEU 137 N -0.57 4.79 0.00 9.08 1.98 0.09 -2.00 118.68 132.04 2k23 s LEU 137 Ca 0.09 -0.80 0.01 0.00 -2.89 0.00 0.00 54.13 50.54 2k23 s LEU 137 Cb -0.10 -2.10 -0.04 0.00 0.66 0.00 0.00 46.19 44.62 2k23 s LEU 137 CO -0.01 -0.37 0.01 -0.31 -1.89 0.00 0.00 176.35 173.79 2k23 s TYR 138 N 1.64 3.10 -0.01 5.38 2.02 -0.42 0.04 117.35 129.12 2k23 s TYR 138 Ca 0.04 0.10 0.03 0.00 -0.37 0.00 0.00 57.07 56.87 2k23 s TYR 138 Cb -0.19 -1.68 -0.01 0.00 -0.40 0.00 0.00 41.96 39.69 2k23 s TYR 138 CO 0.09 0.48 -0.09 0.20 -1.57 0.00 0.00 175.55 174.65 2k23 s GLY 139 N -1.60 0.47 0.51 0.71 0.00 0.15 -0.26 107.32 107.29 2k23 s GLY 139 Ca 0.20 -0.39 0.23 0.00 0.00 0.00 0.00 44.72 44.76 2k23 s GLY 139 CO 0.11 -0.29 2.08 -0.09 0.00 0.00 0.00 173.10 174.91 2k23 h ARG 140 N 6.00 0.00 0.00 2.90 1.12 -1.80 -2.26 114.38 120.34 2k23 h ARG 140 Ca -0.31 0.00 -0.08 0.00 -1.11 0.00 0.00 59.98 58.48 2k23 h ARG 140 Cb 1.18 0.00 -0.14 0.00 -0.01 0.00 0.00 29.97 31.00 2k23 h ARG 140 CO 0.49 0.12 -0.48 -2.37 -3.11 0.00 0.00 179.97 174.62 2k23 n THR 141 N -3.96 0.00 -0.61 0.20 5.66 -1.26 -4.73 114.28 109.58 2k23 n THR 141 Ca -0.02 -0.27 -0.01 0.00 -3.05 0.00 0.00 64.05 60.69 2k23 n THR 141 Cb 0.20 0.52 -0.00 0.00 -1.55 0.00 0.00 70.33 69.50 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 0.14 -1.92 -2.23 1.09 5.02 -1.23 -4.83 118.16 114.20 2k23 n LYS 142 Ca -0.05 0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 56.13 2k23 n LYS 142 Cb 0.78 -3.91 0.00 0.00 -0.02 0.00 0.00 35.03 31.87 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 0.45 5.19 3.51 0.72 0.00 -1.26 -4.95 105.19 108.84 2k23 n GLY 143 Ca -0.01 -2.17 -0.32 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 -1.87 2.83 0.55 0.99 1.43 -1.26 -5.02 118.68 116.33 2k23 s LEU 144 Ca 0.47 -0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 53.14 2k23 s LEU 144 Cb 0.15 -1.62 -0.05 0.00 0.03 0.00 0.00 46.19 44.69 2k23 s LEU 144 CO -0.06 0.30 1.07 -0.44 0.23 0.00 0.00 176.35 177.45 2k23 s SER 145 N -1.14 5.92 0.55 2.29 0.01 -1.26 -4.93 113.70 115.14 2k23 s SER 145 Ca 0.14 1.94 0.30 0.00 1.31 0.00 0.00 55.95 59.64 2k23 s SER 145 Cb -0.11 -2.55 1.61 0.00 0.21 0.00 0.00 66.02 65.18 2k23 s SER 145 CO 0.04 -1.07 2.13 0.44 0.41 0.00 0.00 173.24 175.18 2k23 h ASP 146 N 0.95 0.00 -0.28 2.44 3.32 -2.00 -2.46 116.42 118.39 2k23 h ASP 146 Ca -0.48 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.62 2k23 h ASP 146 Cb 1.23 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.73 2k23 h ASP 146 CO 0.58 0.08 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.08 2k23 h GLU 147 N 0.00 0.06 0.00 3.56 4.57 -1.99 0.26 114.58 121.05 2k23 h GLU 147 Ca -0.00 -0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 2k23 h GLU 147 Cb 0.26 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2k23 h GLU 147 CO 0.01 0.04 -0.39 1.37 -1.18 0.00 0.00 179.01 178.86 2k23 h LEU 148 N 0.07 0.00 0.01 1.64 8.10 -1.83 0.01 115.31 123.31 2k23 h LEU 148 Ca 0.14 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 58.02 2k23 h LEU 148 Cb 0.19 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.41 2k23 h LEU 148 CO -0.24 0.39 -0.41 0.11 -4.11 0.00 0.00 178.44 174.19 2k23 h LYS 149 N 0.00 0.26 -0.54 0.17 1.57 -1.42 -1.74 116.57 114.87 2k23 h LYS 149 Ca -0.00 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.49 2k23 h LYS 149 Cb 0.80 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 2k23 h LYS 149 CO 0.05 1.01 0.36 1.49 -0.57 0.00 0.00 179.45 181.79 2k23 h GLU 150 N -0.37 0.70 -0.96 3.15 4.57 -0.86 0.96 114.58 121.78 2k23 h GLU 150 Ca -0.05 -0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.17 2k23 h GLU 150 Cb 1.16 -0.16 -0.07 0.00 -0.16 0.00 0.00 28.75 29.52 2k23 h GLU 150 CO 0.08 0.47 0.62 -0.09 -1.18 0.00 0.00 179.01 178.90 2k23 h ARG 151 N 0.73 1.00 -0.19 1.92 2.43 -0.90 0.12 114.38 119.49 2k23 h ARG 151 Ca 0.20 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.23 2k23 h ARG 151 Cb -0.07 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.25 2k23 h ARG 151 CO -0.04 0.66 -0.19 0.27 -1.51 0.00 0.00 179.97 179.15 2k23 h PHE 152 N 1.03 0.56 -0.33 2.20 -5.15 0.08 0.13 116.94 115.46 2k23 h PHE 152 Ca 0.43 -0.17 -0.07 0.00 -0.20 0.00 0.00 57.97 57.96 2k23 h PHE 152 Cb 0.32 -0.12 -0.02 0.00 0.22 0.00 0.00 35.95 36.35 2k23 h PHE 152 CO -0.00 0.83 -0.10 -0.39 -2.00 0.00 0.00 178.31 176.65 2k23 h VAL 153 N 0.12 1.23 -0.50 0.88 -1.51 -0.86 0.41 116.25 116.03 2k23 h VAL 153 Ca 0.03 -1.01 -0.10 0.00 -1.23 0.00 0.00 66.70 64.39 2k23 h VAL 153 Cb 0.74 1.09 -0.02 0.00 -2.13 0.00 0.00 31.29 30.97 2k23 h VAL 153 CO 0.05 0.34 -0.07 0.28 -1.23 0.00 0.00 177.57 176.93 2k23 h SER 154 N 0.52 0.93 0.16 4.19 0.02 -0.67 -2.59 113.55 116.10 2k23 h SER 154 Ca 0.10 -0.34 -0.08 0.00 -0.84 0.00 0.00 61.79 60.63 2k23 h SER 154 Cb 0.48 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2k23 h SER 154 CO 0.03 1.05 -0.28 0.15 -1.14 0.00 0.00 176.83 176.64 2k23 h PHE 155 N 0.79 0.22 -0.41 3.45 3.57 0.14 0.06 116.94 124.76 2k23 h PHE 155 Ca 0.13 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.64 2k23 h PHE 155 Cb 0.62 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 2k23 h PHE 155 CO 0.05 0.47 0.16 0.00 -2.23 0.00 0.00 178.31 176.75 2k23 h ALA 156 N 1.54 0.50 0.00 2.41 0.00 0.15 -1.41 119.26 122.44 2k23 h ALA 156 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2k23 h ALA 156 Cb 0.59 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2k23 h ALA 156 CO 0.04 -0.22 -0.03 0.87 0.00 0.00 0.00 179.25 179.90 2k23 h LYS 157 N 0.33 0.00 0.00 0.00 1.57 -1.07 -2.27 116.57 115.13 2k23 h LYS 157 Ca 0.19 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.88 2k23 h LYS 157 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2k23 h LYS 157 CO -0.18 0.03 -0.43 1.03 -0.57 0.00 0.00 179.45 179.33 2k23 h SER 158 N 0.00 0.00 0.89 0.86 0.87 0.09 -1.89 113.55 114.38 2k23 h SER 158 Ca -0.00 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.39 2k23 h SER 158 Cb 0.86 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.80 2k23 h SER 158 CO 0.00 0.43 -0.78 -0.07 -0.53 0.00 0.00 176.83 175.88 2k23 h LEU 159 N 0.00 0.00 0.00 2.23 -0.00 -1.34 -3.47 115.31 112.73 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 0.85 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.51 2k23 h LEU 159 CO 0.06 0.78 0.00 0.61 -0.00 0.00 0.00 178.44 179.89 2k23 n GLY 160 N 0.88 -0.02 1.06 0.83 0.00 -0.71 -4.64 105.19 102.59 2k23 n GLY 160 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.87 -4.61 117.00 113.47 2k23 n LEU 161 Ca 0.00 -0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 55.45 2k23 n LEU 161 Cb 0.00 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 40.73 2k23 n LEU 161 CO 0.00 -0.76 -0.07 -1.59 -1.33 0.00 0.00 177.39 173.64 2k23 s LYS 162 N -3.77 0.62 0.66 3.23 0.00 -1.26 -3.98 119.74 115.23 2k23 s LYS 162 Ca 0.21 -0.38 0.34 0.00 0.00 0.00 0.00 55.97 56.14 2k23 s LYS 162 Cb -0.01 0.26 1.86 0.00 0.00 0.00 0.00 37.83 39.95 2k23 s LYS 162 CO 0.14 -0.17 2.07 0.22 0.00 0.00 0.00 175.35 177.62 2k23 h ASP 163 N 3.89 0.00 0.10 0.03 3.58 -1.93 0.66 116.42 122.75 2k23 h ASP 163 Ca -0.31 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.14 2k23 h ASP 163 Cb 1.19 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.24 2k23 h ASP 163 CO 0.42 0.00 -0.02 0.78 -2.88 0.00 0.00 179.24 177.55 2k23 h ASN 164 N 0.00 0.00 -0.15 2.28 4.21 -1.98 -1.44 115.58 118.50 2k23 h ASN 164 Ca 0.02 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.43 2k23 h ASN 164 Cb 0.48 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.61 2k23 h ASN 164 CO -0.00 0.02 -0.45 0.59 -1.29 0.00 0.00 177.43 176.30 2k23 n ASN 165 N -3.49 2.23 -4.10 5.81 4.13 0.22 -4.76 115.26 115.31 2k23 n ASN 165 Ca -0.03 -3.87 -0.31 0.00 1.68 0.00 0.00 54.58 52.06 2k23 n ASN 165 Cb 0.11 -0.53 -0.17 0.00 -1.54 0.00 0.00 39.78 37.65 2k23 n ASN 165 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2k23 s ILE 166 N -3.40 1.76 0.31 2.41 1.01 -0.54 -0.00 121.20 122.74 2k23 s ILE 166 Ca 0.41 -0.79 0.09 0.00 0.00 0.00 0.00 60.65 60.35 2k23 s ILE 166 Cb 0.38 -1.59 -0.06 0.00 0.01 0.00 0.00 42.46 41.20 2k23 s ILE 166 CO -0.05 0.49 -0.11 0.68 0.00 0.00 0.00 174.94 175.96 2k23 s VAL 167 N 0.98 2.08 -0.18 2.92 -7.23 0.18 -4.96 120.40 114.19 2k23 s VAL 167 Ca -0.05 -2.22 -0.02 0.00 -1.81 0.00 0.00 61.98 57.88 2k23 s VAL 167 Cb -0.15 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 2k23 s VAL 167 CO -0.03 -0.29 -0.07 -0.36 -0.31 0.00 0.00 175.10 174.03 2k23 s PHE 168 N -2.73 2.92 0.06 2.82 0.08 -1.26 -0.95 117.98 118.91 2k23 s PHE 168 Ca 0.31 -0.77 -0.33 0.00 0.12 0.00 0.00 56.93 56.26 2k23 s PHE 168 Cb 0.01 -1.99 -0.12 0.00 -0.57 0.00 0.00 43.02 40.35 2k23 s PHE 168 CO 0.14 -0.37 1.76 -1.13 -0.10 0.00 0.00 175.22 175.52 2k23 n SER 169 N 4.19 3.46 -4.73 1.36 3.41 -1.07 -4.87 113.62 115.36 2k23 n SER 169 Ca -0.18 1.02 -0.42 0.00 -0.26 0.00 0.00 58.87 59.03 2k23 n SER 169 Cb 0.52 -1.44 -0.03 0.00 -0.26 0.00 0.00 64.21 63.00 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 2.56 3.24 -0.67 -3.33 1.01 -1.00 -4.51 120.40 117.70 2k23 s VAL 170 Ca 0.85 0.98 -0.26 0.00 0.00 0.00 0.00 61.98 63.55 2k23 s VAL 170 Cb -0.63 -3.63 -0.08 0.00 0.00 0.00 0.00 36.38 32.04 2k23 s VAL 170 CO 0.43 0.13 2.24 -2.16 0.00 0.00 0.00 175.10 175.73 2k23 s PRO 171 N 0.23 2.11 0.34 2.72 0.04 -1.26 -0.19 135.00 138.98 2k23 s PRO 171 Ca 0.59 0.71 -0.28 0.00 0.04 0.00 0.00 61.00 62.06 2k23 s PRO 171 Cb -0.37 -4.69 -0.10 0.00 0.04 0.00 0.00 34.50 29.39 2k23 s PRO 171 CO 0.36 -3.56 1.30 0.99 0.04 0.00 0.00 177.00 176.13 2k23 s THR 172 N 12.13 2.71 -1.05 1.26 2.01 -1.26 -4.91 115.64 126.53 2k23 s THR 172 Ca 0.86 0.71 -0.18 0.00 0.31 0.00 0.00 61.69 63.39 2k23 s THR 172 Cb -0.13 -3.45 0.12 0.00 0.01 0.00 0.00 72.50 69.05 2k23 s THR 172 CO 0.15 0.16 1.32 -0.62 -0.69 0.00 0.00 174.62 174.95 2k23 s ASP 173 N -0.52 6.74 0.00 3.53 2.15 -1.26 -4.81 116.67 122.49 2k23 s ASP 173 Ca 0.50 -2.23 0.00 0.00 0.43 0.00 0.00 52.55 51.25 2k23 s ASP 173 Cb -0.39 -2.45 0.00 0.00 -0.30 0.00 0.00 42.92 39.78 2k23 s ASP 173 CO 0.52 -1.07 0.00 0.00 -0.17 0.00 0.00 175.17 174.45 2k23 n GLN 174 N 6.90 0.00 0.00 4.34 1.13 -1.26 -5.04 117.38 123.45 2k23 n GLN 174 Ca 0.31 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2k23 n GLN 174 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.82 2k23 n GLN 174 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k23 n ILE 176 N -0.20 -2.70 -2.23 0.00 0.00 -1.26 -4.90 119.36 108.07 2k23 n ILE 176 Ca 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 62.75 62.75 2k23 n ILE 176 Cb 0.00 -2.45 -0.03 0.00 0.00 0.00 0.00 39.64 37.17 2k23 n ILE 176 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2k23 n ASP 177 N -0.71 -0.23 -0.03 9.51 5.75 -1.26 -5.00 116.55 124.57 2k23 n ASP 177 Ca -0.14 -2.01 0.16 0.00 -0.01 0.00 0.00 54.79 52.79 2k23 n ASP 177 Cb 0.52 0.08 0.92 0.00 -1.03 0.00 0.00 41.12 41.62 2k23 n ASP 177 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68