#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k23 n ASP 2 N 0.00 0.90 0.09 1.08 2.03 -1.26 -4.70 116.55 114.69 2k23 n ASP 2 Ca 0.00 -1.31 0.04 0.00 0.52 0.00 0.00 54.79 54.04 2k23 n ASP 2 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 2k23 n ASP 2 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2k23 h SER 3 N 0.00 0.00 -4.99 1.67 4.64 -2.07 -3.48 113.55 109.32 2k23 h SER 3 Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2k23 h SER 3 Cb 0.47 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.46 2k23 h SER 3 CO 0.00 0.39 0.24 0.28 -0.87 0.00 0.00 176.83 176.87 2k23 s THR 4 N -3.05 0.00 -0.39 2.95 -1.32 -1.26 -5.07 115.64 107.50 2k23 s THR 4 Ca 0.00 -0.27 0.07 0.00 -1.21 0.00 0.00 61.69 60.28 2k23 s THR 4 Cb 0.08 -1.28 0.43 0.00 -1.51 0.00 0.00 72.50 70.23 2k23 s THR 4 CO 0.78 0.00 1.10 0.00 -2.21 0.00 0.00 174.62 174.29 2k23 n GLN 5 N -0.40 3.14 -0.01 7.08 6.02 -1.26 -4.90 117.38 127.05 2k23 n GLN 5 Ca -0.13 -4.27 0.00 0.00 -0.01 0.00 0.00 57.00 52.59 2k23 n GLN 5 Cb 0.63 -2.12 0.00 0.00 1.02 0.00 0.00 30.24 29.78 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 -0.47 0.00 -4.76 1.08 2.85 -1.26 -5.01 115.26 107.68 2k23 n ASN 6 Ca 0.35 -0.02 -0.41 0.00 -0.11 0.00 0.00 54.58 54.39 2k23 n ASN 6 Cb 0.74 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.74 2k23 n ASN 6 CO 0.00 0.00 0.00 -1.48 -2.11 0.00 0.00 177.26 173.67 2k23 s LEU 7 N 0.00 4.34 0.24 1.20 0.05 -1.26 -4.96 118.68 118.29 2k23 s LEU 7 Ca 0.00 2.95 -0.30 0.00 0.05 0.00 0.00 54.13 56.84 2k23 s LEU 7 Cb 0.00 -3.65 -0.09 0.00 -2.05 0.00 0.00 46.19 40.40 2k23 s LEU 7 CO 0.00 -0.86 1.11 -0.63 -0.55 0.00 0.00 176.35 175.41 2k23 s ILE 8 N -0.47 3.60 0.00 1.48 1.01 -1.26 -4.70 121.20 120.86 2k23 s ILE 8 Ca 0.58 1.52 0.00 0.00 0.00 0.00 0.00 60.65 62.75 2k23 s ILE 8 Cb -0.46 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.04 2k23 s ILE 8 CO 0.53 0.33 0.00 -2.65 0.00 0.00 0.00 174.94 173.15 2k23 n PRO 9 N 1.62 0.00 -2.81 2.79 -0.02 -1.26 -4.75 135.00 130.58 2k23 n PRO 9 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.06 2k23 n PRO 9 Cb 0.45 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.89 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 0.19 3.55 0.00 -1.26 -4.65 121.76 122.74 2k23 s ALA 10 Ca 0.00 -1.15 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 2k23 s ALA 10 Cb 0.00 -3.76 -0.08 0.00 0.00 0.00 0.00 23.12 19.28 2k23 s ALA 10 CO 0.00 -2.39 0.64 -1.25 0.00 0.00 0.00 175.76 172.77 2k23 s PRO 11 N 4.05 4.11 0.82 0.00 0.05 -1.26 -5.09 135.00 137.67 2k23 s PRO 11 Ca 0.33 0.68 -0.12 0.00 0.05 0.00 0.00 61.00 61.94 2k23 s PRO 11 Cb -0.12 -2.88 0.08 0.00 0.05 0.00 0.00 34.50 31.64 2k23 s PRO 11 CO 0.21 0.42 1.11 -2.14 0.05 0.00 0.00 177.00 176.65 2k23 s PRO 12 N -2.03 1.93 0.31 0.56 0.02 -1.26 -4.92 135.00 129.61 2k23 s PRO 12 Ca 0.41 0.48 0.06 0.00 0.02 0.00 0.00 61.00 61.98 2k23 s PRO 12 Cb -0.15 -1.91 0.87 0.00 0.02 0.00 0.00 34.50 33.32 2k23 s PRO 12 CO 0.20 -1.69 1.62 1.25 -0.33 0.00 0.00 177.00 178.05 2k23 h LEU 13 N -1.14 0.00 0.00 -5.54 7.12 -1.95 0.16 115.31 113.97 2k23 h LEU 13 Ca -0.48 0.23 0.00 0.00 0.13 0.00 0.00 57.88 57.76 2k23 h LEU 13 Cb 1.29 0.30 0.00 0.00 -0.53 0.00 0.00 40.66 41.72 2k23 h LEU 13 CO 0.61 -0.24 0.00 2.30 -0.13 0.00 0.00 178.44 180.98 2k23 n ILE 14 N -5.27 0.74 0.36 4.05 -0.00 -1.26 0.14 119.36 118.12 2k23 n ILE 14 Ca 0.26 0.18 0.12 0.00 -0.00 0.00 0.00 62.75 63.31 2k23 n ILE 14 Cb 0.83 -1.08 0.20 0.00 -0.00 0.00 0.00 39.64 39.60 2k23 n ILE 14 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 2k23 h SER 15 N 0.00 0.00 -3.22 7.28 0.02 -1.31 -3.45 113.55 112.87 2k23 h SER 15 Ca 0.00 -0.03 -0.65 0.00 -0.84 0.00 0.00 61.79 60.27 2k23 h SER 15 Cb 0.05 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.44 2k23 h SER 15 CO 0.00 0.02 -0.59 0.54 -1.14 0.00 0.00 176.83 175.66 2k23 s VAL 16 N -3.20 4.57 0.83 2.27 0.11 0.12 -5.09 120.40 120.00 2k23 s VAL 16 Ca 0.07 -0.13 -0.11 0.00 -2.93 0.00 0.00 61.98 58.88 2k23 s VAL 16 Cb 0.09 -2.99 0.09 0.00 -1.53 0.00 0.00 36.38 32.04 2k23 s VAL 16 CO 0.68 0.54 1.12 -2.84 -3.33 0.00 0.00 175.10 171.27 2k23 s PRO 17 N -0.31 1.74 0.06 1.54 0.02 -1.26 -4.95 135.00 131.84 2k23 s PRO 17 Ca 0.08 1.35 0.04 0.00 0.02 0.00 0.00 61.00 62.49 2k23 s PRO 17 Cb -0.12 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 2k23 s PRO 17 CO 0.02 -2.06 -0.01 -1.17 -0.33 0.00 0.00 177.00 173.45 2k23 s LEU 18 N -6.16 3.43 -0.45 -5.54 2.96 -1.25 -3.04 118.68 108.63 2k23 s LEU 18 Ca 0.64 -0.15 -0.28 0.00 -0.22 0.00 0.00 54.13 54.12 2k23 s LEU 18 Cb -0.20 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.38 2k23 s LEU 18 CO 0.56 0.21 1.55 -1.58 -1.32 0.00 0.00 176.35 175.77 2k23 s GLN 19 N -2.06 3.35 0.21 1.98 -0.44 -0.97 -4.78 119.66 116.96 2k23 s GLN 19 Ca 0.23 0.90 -0.30 0.00 -2.50 0.00 0.00 55.36 53.70 2k23 s GLN 19 Cb -0.12 -4.13 -0.09 0.00 -1.64 0.00 0.00 33.01 27.04 2k23 s GLN 19 CO 0.15 -1.85 1.31 -1.25 0.50 0.00 0.00 175.29 174.16 2k23 s PRO 20 N 5.46 4.39 -0.62 1.67 0.04 -1.26 -2.80 135.00 141.88 2k23 s PRO 20 Ca 0.64 2.07 -0.02 0.00 0.04 0.00 0.00 61.00 63.73 2k23 s PRO 20 Cb -0.15 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2k23 s PRO 20 CO 0.30 -0.25 0.29 0.41 0.04 0.00 0.00 177.00 177.79 2k23 n GLY 21 N 2.28 0.22 3.76 0.56 0.00 -1.26 -5.00 105.19 105.76 2k23 n GLY 21 Ca 0.06 -0.39 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 2k23 n GLY 21 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2k23 s PHE 22 N -2.86 3.45 0.17 1.61 2.19 -1.12 -5.06 117.98 116.37 2k23 s PHE 22 Ca 0.15 1.67 0.07 0.00 0.33 0.00 0.00 56.93 59.14 2k23 s PHE 22 Cb -0.06 -3.28 -0.04 0.00 -1.31 0.00 0.00 43.02 38.32 2k23 s PHE 22 CO 0.18 -0.69 -0.14 -1.58 1.83 0.00 0.00 175.22 174.83 2k23 s TRP 23 N -1.28 1.55 0.11 10.12 0.51 -1.26 -4.95 118.94 123.73 2k23 s TRP 23 Ca 0.48 -0.60 -0.31 0.00 -2.12 0.00 0.00 56.10 53.55 2k23 s TRP 23 Cb -0.30 -0.76 -0.11 0.00 -0.81 0.00 0.00 33.47 31.49 2k23 s TRP 23 CO 0.39 0.24 1.60 1.79 -0.51 0.00 0.00 176.95 180.46 2k23 h THR 24 N 2.89 0.20 0.00 2.01 1.35 -1.97 -2.28 112.91 115.11 2k23 h THR 24 Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 2k23 h THR 24 Cb 1.21 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 2k23 h THR 24 CO 0.59 0.00 0.00 1.21 -0.25 0.00 0.00 175.52 177.07 2k23 n GLU 25 N -5.46 0.20 -0.04 4.72 2.13 -1.26 -1.79 120.64 119.13 2k23 n GLU 25 Ca -0.08 0.39 0.03 0.00 0.66 0.00 0.00 57.16 58.16 2k23 n GLU 25 Cb 0.37 -1.86 0.38 0.00 0.27 0.00 0.00 31.44 30.60 2k23 n GLU 25 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2k23 h ARG 26 N 0.00 0.63 -1.69 5.31 9.65 -1.82 -2.75 114.38 123.71 2k23 h ARG 26 Ca 0.00 -0.05 -0.68 0.00 -1.10 0.00 0.00 59.98 58.15 2k23 h ARG 26 Cb 0.41 -0.14 -0.34 0.00 -1.39 0.00 0.00 29.97 28.51 2k23 h ARG 26 CO 0.00 0.43 0.24 0.34 2.80 0.00 0.00 179.97 183.78 2k23 n PHE 27 N -4.45 3.16 -4.67 2.20 7.35 -0.74 -4.81 117.46 115.50 2k23 n PHE 27 Ca 0.04 -2.68 -0.23 0.00 -0.76 0.00 0.00 57.45 53.82 2k23 n PHE 27 Cb 0.07 -0.71 -0.15 0.00 0.35 0.00 0.00 39.48 39.04 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 -3.82 1.23 0.00 -4.13 -0.44 -1.04 -4.67 119.66 106.79 2k23 s GLN 28 Ca 0.51 -0.51 0.00 0.00 -2.50 0.00 0.00 55.36 52.86 2k23 s GLN 28 Cb 0.43 -1.17 0.00 0.00 -1.64 0.00 0.00 33.01 30.63 2k23 s GLN 28 CO -0.28 0.29 0.00 0.41 0.50 0.00 0.00 175.29 176.21 2k23 n GLY 29 N 2.81 0.29 3.64 2.59 0.00 0.14 -4.93 105.19 109.73 2k23 n GLY 29 Ca -0.15 -2.30 -0.40 0.00 0.00 0.00 0.00 46.02 43.17 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 -0.04 4.15 -0.01 1.61 3.00 -1.26 -1.74 118.95 124.65 2k23 s ARG 30 Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 55.73 56.25 2k23 s ARG 30 Cb 0.00 -3.61 -0.01 0.00 0.00 0.00 0.00 34.95 31.33 2k23 s ARG 30 CO 0.00 -0.28 -0.15 -1.58 0.00 0.00 0.00 175.30 173.29 2k23 s TRP 31 N 2.07 1.34 -0.11 -0.53 0.51 -1.08 -4.92 118.94 116.21 2k23 s TRP 31 Ca 0.25 -0.27 -0.03 0.00 -2.12 0.00 0.00 56.10 53.93 2k23 s TRP 31 Cb -0.16 -0.87 -0.03 0.00 -0.81 0.00 0.00 33.47 31.60 2k23 s TRP 31 CO 0.09 -0.04 0.02 -0.06 -0.51 0.00 0.00 176.95 176.45 2k23 s PHE 32 N -0.28 3.20 0.40 -1.98 0.40 -0.97 -1.86 117.98 116.88 2k23 s PHE 32 Ca 0.04 0.14 -0.25 0.00 -0.60 0.00 0.00 56.93 56.26 2k23 s PHE 32 Cb -0.06 -1.87 -0.08 0.00 0.51 0.00 0.00 43.02 41.51 2k23 s PHE 32 CO -0.00 0.38 1.16 0.08 0.70 0.00 0.00 175.22 177.54 2k23 s VAL 33 N -0.54 3.19 0.00 -0.44 1.01 -1.13 0.15 120.40 122.63 2k23 s VAL 33 Ca 0.10 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.07 2k23 s VAL 33 Cb -0.12 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2k23 s VAL 33 CO 0.02 0.09 0.00 0.52 0.00 0.00 0.00 175.10 175.73 2k23 n VAL 34 N 0.08 0.00 -3.61 2.92 0.31 0.16 -4.79 118.33 113.40 2k23 n VAL 34 Ca 0.04 -0.16 -0.07 0.00 -0.01 0.00 0.00 64.34 64.14 2k23 n VAL 34 Cb 0.47 0.65 -0.02 0.00 -0.91 0.00 0.00 33.84 34.03 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 -1.16 -0.37 -0.22 2.92 0.00 -0.51 -3.15 107.32 104.83 2k23 s GLY 35 Ca 0.00 0.47 -0.15 0.00 0.00 0.00 0.00 44.72 45.04 2k23 s GLY 35 CO 0.00 0.14 0.54 -2.27 0.00 0.00 0.00 173.10 171.52 2k23 s LEU 36 N -2.73 -0.34 -0.07 0.66 2.96 -0.53 -0.64 118.68 118.00 2k23 s LEU 36 Ca 0.07 1.15 -0.03 0.00 -0.22 0.00 0.00 54.13 55.11 2k23 s LEU 36 Cb -0.02 1.85 0.04 0.00 0.50 0.00 0.00 46.19 48.57 2k23 s LEU 36 CO -0.04 -0.21 0.14 0.00 -1.32 0.00 0.00 176.35 174.92 2k23 s ALA 37 N 1.02 -0.21 0.00 5.97 0.00 -0.35 0.25 121.76 128.43 2k23 s ALA 37 Ca -0.06 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.53 2k23 s ALA 37 Cb -0.06 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.54 2k23 s ALA 37 CO -0.09 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.83 2k23 n GLY 38 N 4.46 2.61 0.25 0.00 0.00 0.12 0.12 105.19 112.75 2k23 n GLY 38 Ca -0.22 -0.70 0.14 0.00 0.00 0.00 0.00 46.02 45.24 2k23 n GLY 38 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2k23 h ASN 39 N 0.00 0.00 0.26 1.61 7.08 -1.77 -0.18 115.58 122.59 2k23 h ASN 39 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2k23 h ASN 39 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 2k23 h ASN 39 CO 0.00 0.09 -0.21 0.00 -2.08 0.00 0.00 177.43 175.23 2k23 n ALA 40 N -2.15 2.97 -1.99 4.14 0.00 -1.25 -4.81 120.51 117.42 2k23 n ALA 40 Ca 0.01 -0.37 -0.42 0.00 0.00 0.00 0.00 53.44 52.66 2k23 n ALA 40 Cb 0.37 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2k23 n ALA 40 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2k23 s VAL 41 N -2.48 3.48 -1.29 0.00 1.01 -0.08 -4.91 120.40 116.13 2k23 s VAL 41 Ca 0.26 0.66 -0.18 0.00 0.00 0.00 0.00 61.98 62.72 2k23 s VAL 41 Cb 0.19 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 33.18 2k23 s VAL 41 CO 0.50 -0.05 1.85 0.00 0.00 0.00 0.00 175.10 177.40 2k23 n GLN 42 N 6.78 2.86 -3.31 2.72 10.64 -1.26 -4.89 117.38 130.93 2k23 n GLN 42 Ca 0.17 -3.02 -0.41 0.00 -1.83 0.00 0.00 57.00 51.91 2k23 n GLN 42 Cb 0.42 -3.48 -0.08 0.00 -0.86 0.00 0.00 30.24 26.24 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 4.42 3.53 0.01 2.61 2.20 -1.26 -4.01 119.74 127.25 2k23 s LYS 43 Ca 0.55 -0.33 -0.24 0.00 -0.36 0.00 0.00 55.97 55.59 2k23 s LYS 43 Cb 0.05 -3.83 -0.17 0.00 -1.51 0.00 0.00 37.83 32.37 2k23 s LYS 43 CO 0.06 -0.63 1.37 1.05 -0.36 0.00 0.00 175.35 176.84 2k23 h GLU 44 N 8.50 0.11 0.00 4.03 9.09 -1.91 -3.46 114.58 130.94 2k23 h GLU 44 Ca -0.28 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.08 2k23 h GLU 44 Cb 1.13 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.23 2k23 h GLU 44 CO 0.75 0.48 0.00 -2.13 0.05 0.00 0.00 179.01 178.15 2k23 n ARG 45 N -4.82 0.00 0.00 1.06 0.63 -1.26 -5.06 116.66 107.21 2k23 n ARG 45 Ca -0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.86 2k23 n ARG 45 Cb 0.24 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.15 2k23 n ARG 45 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2k23 n GLN 46 N 0.00 0.00 -2.67 -0.14 6.02 -1.26 -5.06 117.38 114.27 2k23 n GLN 46 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.95 2k23 n GLN 46 Cb 0.00 0.00 0.11 0.00 1.02 0.00 0.00 30.24 31.37 2k23 n GLN 46 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2k23 n SER 47 N -0.23 -1.36 0.00 1.08 3.41 -1.26 -4.48 113.62 110.78 2k23 n SER 47 Ca 0.00 -2.08 0.11 0.00 -0.26 0.00 0.00 58.87 56.65 2k23 n SER 47 Cb 0.00 1.24 0.58 0.00 -0.26 0.00 0.00 64.21 65.77 2k23 n SER 47 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2k23 n ARG 48 N 0.41 0.34 -0.06 4.33 3.00 -1.26 -3.70 116.66 119.72 2k23 n ARG 48 Ca -0.05 0.07 -0.08 0.00 -0.00 0.00 0.00 57.85 57.79 2k23 n ARG 48 Cb 0.75 -1.50 -0.01 0.00 0.00 0.00 0.00 32.46 31.69 2k23 n ARG 48 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 2k23 h PHE 49 N 0.00 0.08 -3.87 -0.14 3.57 -1.88 -3.50 116.94 111.20 2k23 h PHE 49 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2k23 h PHE 49 Cb 0.20 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.95 2k23 h PHE 49 CO 0.00 0.02 -0.79 0.25 -2.23 0.00 0.00 178.31 175.56 2k23 n THR 50 N -5.09 -4.63 -2.24 4.41 -2.24 -1.24 -4.90 114.28 98.35 2k23 n THR 50 Ca -0.01 2.14 -0.36 0.00 -2.27 0.00 0.00 64.05 63.55 2k23 n THR 50 Cb 0.11 -2.83 0.00 0.00 -2.10 0.00 0.00 70.33 65.51 2k23 n THR 50 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k23 s MET 51 N -2.44 3.41 0.32 -0.78 0.23 0.12 -4.62 119.30 115.53 2k23 s MET 51 Ca 0.00 1.67 0.03 0.00 -1.03 0.00 0.00 55.69 56.36 2k23 s MET 51 Cb 0.00 -2.08 -0.05 0.00 -1.53 0.00 0.00 34.83 31.17 2k23 s MET 51 CO 0.00 -0.81 0.11 1.52 -2.03 0.00 0.00 175.02 173.80 2k23 s TYR 52 N -1.71 1.72 -0.25 3.16 -0.85 -1.26 -4.49 117.35 113.67 2k23 s TYR 52 Ca 0.71 -1.18 -0.08 0.00 -0.52 0.00 0.00 57.07 56.00 2k23 s TYR 52 Cb -0.25 -1.05 -0.03 0.00 0.38 0.00 0.00 41.96 41.01 2k23 s TYR 52 CO 0.29 -0.27 0.09 -1.12 -1.52 0.00 0.00 175.55 173.02 2k23 s SER 53 N -3.43 5.32 -0.49 -0.18 0.01 -1.26 -2.83 113.70 110.84 2k23 s SER 53 Ca 0.34 -0.15 -0.18 0.00 1.31 0.00 0.00 55.95 57.27 2k23 s SER 53 Cb 0.06 -1.96 0.06 0.00 0.21 0.00 0.00 66.02 64.40 2k23 s SER 53 CO 0.15 -0.02 0.56 -0.89 0.41 0.00 0.00 173.24 173.45 2k23 s THR 54 N 1.53 4.98 -0.51 1.44 2.01 -0.78 -2.73 115.64 121.58 2k23 s THR 54 Ca 0.06 -0.64 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 2k23 s THR 54 Cb -0.15 -4.24 0.13 0.00 0.01 0.00 0.00 72.50 68.25 2k23 s THR 54 CO 0.05 -0.73 0.34 -0.63 -0.69 0.00 0.00 174.62 172.95 2k23 s ILE 55 N 2.34 3.70 -0.32 1.82 1.01 -0.81 -2.63 121.20 126.31 2k23 s ILE 55 Ca 0.12 -2.34 -0.22 0.00 0.00 0.00 0.00 60.65 58.21 2k23 s ILE 55 Cb -0.21 -3.46 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 2k23 s ILE 55 CO 0.11 -0.79 0.74 -0.31 0.00 0.00 0.00 174.94 174.68 2k23 s TYR 56 N 0.73 3.19 -0.11 3.97 2.02 -0.71 0.55 117.35 126.98 2k23 s TYR 56 Ca 0.11 0.69 0.01 0.00 -0.37 0.00 0.00 57.07 57.51 2k23 s TYR 56 Cb -0.22 -3.18 -0.02 0.00 -0.40 0.00 0.00 41.96 38.15 2k23 s TYR 56 CO -0.03 -0.57 -0.14 -2.00 -1.57 0.00 0.00 175.55 171.24 2k23 s GLU 57 N 2.87 3.17 -0.10 -0.62 2.12 -0.84 0.27 118.70 125.57 2k23 s GLU 57 Ca 0.30 -0.70 -0.30 0.00 0.36 0.00 0.00 54.97 54.64 2k23 s GLU 57 Cb -0.14 -2.56 -0.03 0.00 0.26 0.00 0.00 34.13 31.66 2k23 s GLU 57 CO 0.13 0.31 1.35 -0.51 -0.54 0.00 0.00 175.26 175.99 2k23 s LEU 58 N 0.10 4.25 0.71 2.70 2.01 -1.26 -0.69 118.68 126.49 2k23 s LEU 58 Ca -0.06 1.88 -0.08 0.00 0.01 0.00 0.00 54.13 55.88 2k23 s LEU 58 Cb -0.15 -3.54 0.06 0.00 0.01 0.00 0.00 46.19 42.56 2k23 s LEU 58 CO 0.05 -0.75 1.03 -1.58 1.01 0.00 0.00 176.35 176.10 2k23 s GLN 59 N 3.19 2.27 0.00 1.70 0.74 -0.45 -4.94 119.66 122.17 2k23 s GLN 59 Ca 0.60 -0.13 0.12 0.00 0.05 0.00 0.00 55.36 55.99 2k23 s GLN 59 Cb -0.26 -2.14 0.66 0.00 1.10 0.00 0.00 33.01 32.37 2k23 s GLN 59 CO 0.21 -1.23 1.17 -0.85 -0.55 0.00 0.00 175.29 174.04 2k23 n GLU 60 N -2.95 0.30 -2.92 1.67 0.28 -1.26 -2.68 120.64 113.08 2k23 n GLU 60 Ca 0.08 0.06 -0.13 0.00 -0.16 0.00 0.00 57.16 57.00 2k23 n GLU 60 Cb 0.60 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.97 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 -1.09 1.14 -0.24 -1.84 2.03 -1.26 -4.98 116.55 110.31 2k23 n ASP 61 Ca 0.08 -2.86 -0.02 0.00 0.52 0.00 0.00 54.79 52.51 2k23 n ASP 61 Cb 0.06 -0.57 -0.01 0.00 -0.72 0.00 0.00 41.12 39.88 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 0.11 -2.39 -4.64 1.67 0.23 -1.09 -4.89 115.26 104.25 2k23 n ASN 62 Ca 0.17 0.04 -0.42 0.00 -0.53 0.00 0.00 54.58 53.83 2k23 n ASN 62 Cb 0.74 -1.82 -0.03 0.00 -2.08 0.00 0.00 39.78 36.59 2k23 n ASN 62 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 2k23 s SER 63 N -0.99 6.91 -0.08 0.53 0.01 -1.26 -4.27 113.70 114.55 2k23 s SER 63 Ca 0.00 1.09 -0.20 0.00 1.31 0.00 0.00 55.95 58.16 2k23 s SER 63 Cb 0.00 -2.49 -0.04 0.00 0.21 0.00 0.00 66.02 63.70 2k23 s SER 63 CO 0.00 -0.66 0.54 -0.31 0.41 0.00 0.00 173.24 173.22 2k23 s TYR 64 N 3.16 3.57 -0.62 2.43 2.02 0.22 -1.34 117.35 126.78 2k23 s TYR 64 Ca 0.40 1.02 -0.21 0.00 -0.37 0.00 0.00 57.07 57.91 2k23 s TYR 64 Cb -0.14 -2.60 0.08 0.00 -0.40 0.00 0.00 41.96 38.90 2k23 s TYR 64 CO 0.09 0.21 0.85 0.54 -1.57 0.00 0.00 175.55 175.67 2k23 s ASN 65 N 0.44 6.18 -0.38 2.29 2.20 0.13 -0.76 114.94 125.04 2k23 s ASN 65 Ca 0.29 -1.14 -0.18 0.00 -0.94 0.00 0.00 52.86 50.88 2k23 s ASN 65 Cb -0.16 -2.37 0.01 0.00 -2.00 0.00 0.00 41.25 36.73 2k23 s ASN 65 CO 0.13 -1.28 0.53 -0.69 -2.94 0.00 0.00 177.10 172.85 2k23 s VAL 66 N 3.45 4.99 -0.77 3.54 1.01 0.13 -1.99 120.40 130.76 2k23 s VAL 66 Ca 0.18 0.16 -0.21 0.00 0.00 0.00 0.00 61.98 62.12 2k23 s VAL 66 Cb -0.20 -4.03 0.10 0.00 0.00 0.00 0.00 36.38 32.25 2k23 s VAL 66 CO 0.09 -0.34 1.01 -0.89 0.00 0.00 0.00 175.10 174.97 2k23 s THR 67 N 2.44 4.53 -0.62 3.92 2.01 0.19 -0.43 115.64 127.68 2k23 s THR 67 Ca 0.18 -0.92 -0.14 0.00 0.31 0.00 0.00 61.69 61.12 2k23 s THR 67 Cb -0.15 -4.71 0.16 0.00 0.01 0.00 0.00 72.50 67.80 2k23 s THR 67 CO 0.15 -1.45 0.56 -0.44 -0.69 0.00 0.00 174.62 172.74 2k23 s SER 68 N 3.68 6.25 0.10 3.53 0.01 0.13 -1.93 113.70 125.46 2k23 s SER 68 Ca 0.26 -2.14 -0.30 0.00 1.31 0.00 0.00 55.95 55.08 2k23 s SER 68 Cb -0.12 -2.16 -0.06 0.00 0.21 0.00 0.00 66.02 63.88 2k23 s SER 68 CO 0.01 -0.72 1.14 -0.51 0.41 0.00 0.00 173.24 173.57 2k23 s ILE 69 N 1.04 4.05 0.00 1.44 2.07 -1.11 -0.42 121.20 128.28 2k23 s ILE 69 Ca 0.09 1.58 -0.03 0.00 -1.41 0.00 0.00 60.65 60.87 2k23 s ILE 69 Cb -0.23 -4.01 -0.01 0.00 0.13 0.00 0.00 42.46 38.34 2k23 s ILE 69 CO -0.02 0.18 0.05 -1.48 -1.91 0.00 0.00 174.94 171.77 2k23 s LEU 70 N 0.47 1.87 -0.53 8.50 0.05 -0.11 -4.08 118.68 124.86 2k23 s LEU 70 Ca 0.54 -0.26 -0.28 0.00 0.05 0.00 0.00 54.13 54.18 2k23 s LEU 70 Cb -0.29 0.35 0.03 0.00 -2.05 0.00 0.00 46.19 44.23 2k23 s LEU 70 CO 0.31 -0.27 1.24 -0.69 -0.55 0.00 0.00 176.35 176.39 2k23 s VAL 71 N -1.13 4.02 -1.33 1.48 1.01 -1.26 -2.47 120.40 120.73 2k23 s VAL 71 Ca -0.12 0.96 -0.13 0.00 0.00 0.00 0.00 61.98 62.69 2k23 s VAL 71 Cb -0.07 -4.60 0.11 0.00 0.00 0.00 0.00 36.38 31.83 2k23 s VAL 71 CO 0.00 -1.17 1.91 0.54 0.00 0.00 0.00 175.10 176.39 2k23 n ARG 72 N 8.28 3.28 0.00 2.72 5.12 -0.05 -4.82 116.66 131.20 2k23 n ARG 72 Ca 0.11 -3.24 0.00 0.00 -1.93 0.00 0.00 57.85 52.79 2k23 n ARG 72 Cb 0.49 -3.13 0.00 0.00 -1.16 0.00 0.00 32.46 28.66 2k23 n ARG 72 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k23 n GLY 73 N 3.72 1.61 0.93 -0.13 0.00 -1.26 -3.69 105.19 106.37 2k23 n GLY 73 Ca 0.44 -0.39 0.05 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 2.50 -4.06 1.61 6.02 -1.26 -5.01 117.38 117.17 2k23 n GLN 74 Ca 0.00 -2.92 -0.14 0.00 -0.01 0.00 0.00 57.00 53.92 2k23 n GLN 74 Cb 0.00 -1.82 -0.04 0.00 1.02 0.00 0.00 30.24 29.40 2k23 n GLN 74 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2k23 s GLY 75 N -2.16 1.39 0.01 1.08 0.00 -1.24 -5.17 107.32 101.23 2k23 s GLY 75 Ca 0.42 -1.45 0.04 0.00 0.00 0.00 0.00 44.72 43.74 2k23 s GLY 75 CO 0.06 -0.94 -0.08 0.00 0.00 0.00 0.00 173.10 172.14 2k23 s ARG 77 N -1.45 0.69 -0.24 0.00 6.06 -1.03 -4.84 118.95 118.14 2k23 s ARG 77 Ca 0.17 0.82 -0.24 0.00 -2.50 0.00 0.00 55.73 53.98 2k23 s ARG 77 Cb -0.11 0.34 -0.01 0.00 0.06 0.00 0.00 34.95 35.23 2k23 s ARG 77 CO 0.07 -0.08 0.79 0.71 -2.50 0.00 0.00 175.30 174.29 2k23 s TYR 78 N 0.32 3.31 -0.44 5.12 2.02 -1.26 -0.93 117.35 125.49 2k23 s TYR 78 Ca -0.00 1.08 -0.14 0.00 -0.37 0.00 0.00 57.07 57.64 2k23 s TYR 78 Cb -0.04 -3.00 0.05 0.00 -0.40 0.00 0.00 41.96 38.57 2k23 s TYR 78 CO 0.01 -0.37 0.33 -0.46 -1.57 0.00 0.00 175.55 173.49 2k23 s TRP 79 N 2.71 3.25 -0.27 2.71 -0.11 0.45 -4.86 118.94 122.81 2k23 s TRP 79 Ca 0.33 -0.92 -0.12 0.00 1.22 0.00 0.00 56.10 56.62 2k23 s TRP 79 Cb -0.15 -2.90 -0.05 0.00 -1.50 0.00 0.00 33.47 28.87 2k23 s TRP 79 CO 0.08 -0.73 0.22 0.42 -4.62 0.00 0.00 176.95 172.32 2k23 s ILE 80 N 1.61 5.29 0.09 5.86 1.09 -1.26 0.19 121.20 134.07 2k23 s ILE 80 Ca 0.04 0.25 0.00 0.00 -1.10 0.00 0.00 60.65 59.84 2k23 s ILE 80 Cb -0.22 -3.56 0.00 0.00 -1.06 0.00 0.00 42.46 37.62 2k23 s ILE 80 CO 0.07 0.24 0.03 -1.14 -0.10 0.00 0.00 174.94 174.04 2k23 n ARG 81 N 5.04 1.58 -4.51 2.79 0.63 0.43 -4.86 116.66 117.76 2k23 n ARG 81 Ca -0.13 -0.59 -0.29 0.00 -0.92 0.00 0.00 57.85 55.92 2k23 n ARG 81 Cb 0.52 0.11 -0.17 0.00 0.45 0.00 0.00 32.46 33.37 2k23 n ARG 81 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2k23 s THR 82 N -0.88 1.54 -0.15 5.15 2.01 -1.26 0.17 115.64 122.22 2k23 s THR 82 Ca 0.02 -0.67 -0.02 0.00 0.31 0.00 0.00 61.69 61.34 2k23 s THR 82 Cb -0.00 -1.40 -0.02 0.00 0.01 0.00 0.00 72.50 71.09 2k23 s THR 82 CO 0.02 0.45 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.94 2k23 s PHE 83 N 0.94 2.89 -0.05 4.92 0.08 0.06 0.27 117.98 127.08 2k23 s PHE 83 Ca -0.07 -0.59 0.02 0.00 0.12 0.00 0.00 56.93 56.40 2k23 s PHE 83 Cb -0.15 -1.91 0.02 0.00 -0.57 0.00 0.00 43.02 40.41 2k23 s PHE 83 CO -0.01 -0.21 -0.08 0.14 -0.10 0.00 0.00 175.22 174.96 2k23 s VAL 84 N 0.50 0.80 0.32 -0.44 -7.23 0.52 0.70 120.40 115.56 2k23 s VAL 84 Ca -0.07 -0.29 -0.29 0.00 -1.81 0.00 0.00 61.98 59.52 2k23 s VAL 84 Cb -0.15 -0.76 -0.12 0.00 0.56 0.00 0.00 36.38 35.91 2k23 s VAL 84 CO 0.04 0.28 1.45 -0.81 -0.31 0.00 0.00 175.10 175.75 2k23 n PRO 85 N 3.85 2.43 0.00 4.82 -0.04 -1.26 0.09 135.00 144.90 2k23 n PRO 85 Ca -0.24 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 2k23 n PRO 85 Cb 0.52 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 2k23 n PRO 85 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2k23 n SER 86 N 1.33 0.00 0.29 3.54 3.41 0.11 -4.77 113.62 117.52 2k23 n SER 86 Ca 0.06 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.85 2k23 n SER 86 Cb 0.36 0.00 0.84 0.00 -0.26 0.00 0.00 64.21 65.15 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 -3.47 4.04 0.02 -1.95 -3.42 113.55 108.77 2k23 h SER 87 Ca 0.00 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.67 2k23 h SER 87 Cb 0.00 0.00 -0.33 0.00 0.14 0.00 0.00 62.40 62.21 2k23 h SER 87 CO 0.00 0.03 -0.68 0.00 -1.14 0.00 0.00 176.83 175.05 2k23 s ARG 88 N -3.91 0.01 -0.05 3.45 3.03 -1.26 -5.12 118.95 115.10 2k23 s ARG 88 Ca -0.01 0.27 -0.35 0.00 2.03 0.00 0.00 55.73 57.67 2k23 s ARG 88 Cb 0.11 -0.23 -0.13 0.00 -1.03 0.00 0.00 34.95 33.67 2k23 s ARG 88 CO 0.52 -0.18 1.76 -2.30 -1.13 0.00 0.00 175.30 173.97 2k23 n PRO 89 N 4.25 1.95 0.00 3.89 -0.02 -1.26 -2.09 135.00 141.73 2k23 n PRO 89 Ca -0.26 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2k23 n PRO 89 Cb 0.51 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 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 4.04 3.47 3.65 -1.23 0.00 -1.26 -4.78 105.19 109.08 2k23 n GLY 90 Ca 0.22 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 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 4.13 -0.05 1.61 0.74 -0.89 -3.99 119.66 121.22 2k23 s GLN 91 Ca 0.00 1.21 0.01 0.00 0.05 0.00 0.00 55.36 56.63 2k23 s GLN 91 Cb 0.00 -3.71 -0.03 0.00 1.10 0.00 0.00 33.01 30.36 2k23 s GLN 91 CO 0.00 -0.81 -0.04 -0.06 -0.55 0.00 0.00 175.29 173.83 2k23 s PHE 92 N 3.53 3.00 0.52 1.67 0.08 0.37 0.03 117.98 127.19 2k23 s PHE 92 Ca 0.46 0.06 0.01 0.00 0.12 0.00 0.00 56.93 57.58 2k23 s PHE 92 Cb -0.14 -1.70 -0.01 0.00 -0.57 0.00 0.00 43.02 40.60 2k23 s PHE 92 CO 0.13 0.39 0.00 0.95 -0.10 0.00 0.00 175.22 176.59 2k23 s THR 93 N -0.90 1.04 0.04 0.64 -4.23 0.11 -1.42 115.64 110.93 2k23 s THR 93 Ca 0.14 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.53 2k23 s THR 93 Cb -0.11 -2.07 -0.06 0.00 1.34 0.00 0.00 72.50 71.61 2k23 s THR 93 CO 0.04 0.00 0.41 -0.76 -0.54 0.00 0.00 174.62 173.77 2k23 s LEU 94 N -3.89 4.41 0.60 4.79 2.01 -1.26 -0.35 118.68 124.99 2k23 s LEU 94 Ca 0.03 0.89 0.29 0.00 0.01 0.00 0.00 54.13 55.34 2k23 s LEU 94 Cb 0.01 -2.79 1.49 0.00 0.01 0.00 0.00 46.19 44.91 2k23 s LEU 94 CO 0.01 0.25 1.90 1.23 1.01 0.00 0.00 176.35 180.75 2k23 h GLY 95 N 4.21 0.00 -4.92 -3.19 0.00 -0.47 0.74 103.07 99.45 2k23 h GLY 95 Ca -0.50 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.43 2k23 h GLY 95 CO 0.64 0.00 -1.10 -2.01 0.00 0.00 0.00 176.54 174.07 2k23 n ASN 96 N -3.60 2.15 0.12 0.19 5.15 -1.26 -4.83 115.26 113.17 2k23 n ASN 96 Ca 0.07 -2.87 -0.01 0.00 -0.60 0.00 0.00 54.58 51.16 2k23 n ASN 96 Cb 0.62 -0.51 0.05 0.00 -0.53 0.00 0.00 39.78 39.42 2k23 n ASN 96 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 2k23 h ILE 97 N 3.10 1.30 0.00 -1.44 2.10 -1.21 -3.36 117.51 118.01 2k23 h ILE 97 Ca -0.02 -2.54 0.00 0.00 1.08 0.00 0.00 64.86 63.38 2k23 h ILE 97 Cb 1.14 2.45 0.00 0.00 -1.09 0.00 0.00 36.82 39.32 2k23 h ILE 97 CO 0.55 0.68 0.00 1.57 -1.08 0.00 0.00 178.15 179.87 2k23 n HIS 98 N -3.43 0.00 -0.68 2.19 -0.00 -1.26 0.25 115.22 112.29 2k23 n HIS 98 Ca 0.00 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.25 2k23 n HIS 98 Cb 0.75 0.00 0.12 0.00 -0.12 0.00 0.00 29.99 30.74 2k23 n HIS 98 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2k23 n SER 99 N -0.72 2.53 -4.61 0.26 7.64 -1.26 -5.08 113.62 112.38 2k23 n SER 99 Ca 0.06 -2.67 -0.51 0.00 1.01 0.00 0.00 58.87 56.76 2k23 n SER 99 Cb 0.03 -0.31 -0.06 0.00 -1.01 0.00 0.00 64.21 62.87 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 -0.87 1.71 -0.07 1.43 0.18 0.14 -4.95 117.16 114.74 2k23 n TYR 100 Ca 0.12 0.54 -0.11 0.00 1.88 0.00 0.00 57.90 60.33 2k23 n TYR 100 Cb 0.55 -2.39 -0.10 0.00 -0.38 0.00 0.00 39.34 37.02 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 4.95 0.00 -0.00 -3.48 0.13 -1.98 -3.41 132.00 128.20 2k23 h PRO 101 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2k23 h PRO 101 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2k23 h PRO 101 CO 0.81 0.79 -0.07 0.00 -0.23 0.00 0.00 178.00 179.30 2k23 n GLN 102 N -4.64 2.07 -2.36 0.86 10.64 -1.26 -4.97 117.38 117.73 2k23 n GLN 102 Ca -0.08 -0.45 -0.42 0.00 -1.83 0.00 0.00 57.00 54.21 2k23 n GLN 102 Cb 0.39 -0.92 -0.02 0.00 -0.86 0.00 0.00 30.24 28.82 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 -0.77 3.81 0.21 -0.39 1.01 -1.26 -2.31 121.20 121.51 2k23 s ILE 103 Ca 0.04 0.75 -0.01 0.00 0.00 0.00 0.00 60.65 61.43 2k23 s ILE 103 Cb 0.03 -4.32 -0.03 0.00 0.01 0.00 0.00 42.46 38.15 2k23 s ILE 103 CO 0.10 -0.98 1.54 1.56 0.00 0.00 0.00 174.94 177.16 2k23 h GLN 104 N 11.09 0.50 -1.29 2.79 1.08 -0.89 -3.46 115.11 124.93 2k23 h GLN 104 Ca -0.27 -0.30 0.15 0.00 -1.45 0.00 0.00 58.65 56.78 2k23 h GLN 104 Cb 1.10 0.03 -0.29 0.00 -0.05 0.00 0.00 27.48 28.27 2k23 h GLN 104 CO 1.14 0.89 0.73 -1.54 -0.95 0.00 0.00 178.83 179.10 2k23 s SER 105 N -6.90 -0.21 -0.16 1.46 1.04 -1.25 -4.99 113.70 102.70 2k23 s SER 105 Ca -0.07 0.35 -0.02 0.00 0.48 0.00 0.00 55.95 56.69 2k23 s SER 105 Cb 0.12 0.33 0.05 0.00 0.10 0.00 0.00 66.02 66.62 2k23 s SER 105 CO 0.83 -0.11 0.03 -0.47 0.98 0.00 0.00 173.24 174.50 2k23 s TYR 106 N -0.28 0.95 -0.10 5.02 6.14 -1.26 -1.32 117.35 126.50 2k23 s TYR 106 Ca 0.05 -0.70 -0.04 0.00 0.64 0.00 0.00 57.07 57.02 2k23 s TYR 106 Cb -0.04 -0.98 0.05 0.00 0.42 0.00 0.00 41.96 41.41 2k23 s TYR 106 CO -0.09 -0.54 0.20 0.16 0.64 0.00 0.00 175.55 175.92 2k23 s ASP 107 N 1.88 0.29 -0.05 4.32 1.47 -1.00 -4.35 116.67 119.22 2k23 s ASP 107 Ca 0.01 0.44 0.04 0.00 1.18 0.00 0.00 52.55 54.21 2k23 s ASP 107 Cb -0.16 0.41 0.00 0.00 -0.34 0.00 0.00 42.92 42.83 2k23 s ASP 107 CO -0.07 -0.21 -0.17 0.68 0.68 0.00 0.00 175.17 176.08 2k23 s VAL 108 N 1.93 1.45 0.01 2.11 -7.23 -0.51 -2.19 120.40 115.97 2k23 s VAL 108 Ca -0.02 -0.70 -0.05 0.00 -1.81 0.00 0.00 61.98 59.39 2k23 s VAL 108 Cb -0.12 -1.26 -0.00 0.00 0.56 0.00 0.00 36.38 35.56 2k23 s VAL 108 CO -0.07 0.42 0.10 0.00 -0.31 0.00 0.00 175.10 175.23 2k23 s GLN 109 N 0.21 0.46 -0.02 4.82 -2.07 -0.84 0.14 119.66 122.36 2k23 s GLN 109 Ca -0.08 -0.49 -0.19 0.00 -1.82 0.00 0.00 55.36 52.79 2k23 s GLN 109 Cb -0.13 0.18 -0.05 0.00 -1.09 0.00 0.00 33.01 31.92 2k23 s GLN 109 CO 0.03 -0.10 0.53 0.54 -1.32 0.00 0.00 175.29 174.97 2k23 s VAL 110 N -1.53 4.97 0.23 3.63 0.11 -1.26 -1.95 120.40 124.59 2k23 s VAL 110 Ca -0.14 1.11 -0.07 0.00 -2.93 0.00 0.00 61.98 59.95 2k23 s VAL 110 Cb -0.07 -3.86 0.19 0.00 -1.53 0.00 0.00 36.38 31.10 2k23 s VAL 110 CO 0.00 0.45 1.82 0.00 -3.33 0.00 0.00 175.10 174.04 2k23 h ALA 111 N 5.55 1.12 -1.73 1.54 0.00 0.51 -2.58 119.26 123.67 2k23 h ALA 111 Ca -0.46 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.33 2k23 h ALA 111 Cb 1.20 -0.34 -0.24 0.00 0.00 0.00 0.00 17.79 18.41 2k23 h ALA 111 CO 0.69 0.67 0.30 0.34 0.00 0.00 0.00 179.25 181.24 2k23 s ASP 112 N -6.30 -0.61 -0.03 0.00 2.15 -1.26 -4.03 116.67 106.59 2k23 s ASP 112 Ca -0.12 1.09 0.01 0.00 0.43 0.00 0.00 52.55 53.96 2k23 s ASP 112 Cb 0.16 1.16 0.01 0.00 -0.30 0.00 0.00 42.92 43.96 2k23 s ASP 112 CO 0.83 -0.18 -0.06 0.28 -0.17 0.00 0.00 175.17 175.88 2k23 s THR 113 N 0.76 0.58 0.13 1.71 -1.32 -1.26 -2.96 115.64 113.28 2k23 s THR 113 Ca -0.03 -0.20 -0.03 0.00 -1.21 0.00 0.00 61.69 60.23 2k23 s THR 113 Cb -0.05 -0.56 -0.03 0.00 -1.51 0.00 0.00 72.50 70.35 2k23 s THR 113 CO -0.09 0.21 0.09 -0.62 -2.21 0.00 0.00 174.62 172.01 2k23 s ASP 114 N 0.58 0.27 0.14 8.08 2.15 -1.26 -5.04 116.67 121.60 2k23 s ASP 114 Ca -0.08 -1.10 -0.06 0.00 0.43 0.00 0.00 52.55 51.74 2k23 s ASP 114 Cb -0.11 0.31 -0.04 0.00 -0.30 0.00 0.00 42.92 42.78 2k23 s ASP 114 CO 0.00 -0.75 1.37 0.10 -0.17 0.00 0.00 175.17 175.73 2k23 h TYR 115 N 2.83 0.77 0.00 -5.34 -0.00 -1.96 -3.37 116.97 109.90 2k23 h TYR 115 Ca -0.34 -0.35 -0.40 0.00 -0.00 0.00 0.00 58.73 57.64 2k23 h TYR 115 Cb 1.20 -0.12 -0.07 0.00 -0.00 0.00 0.00 36.73 37.74 2k23 h TYR 115 CO 0.44 1.14 -2.46 -3.47 -0.00 0.00 0.00 178.16 173.81 2k23 n ASP 116 N -3.87 2.00 -4.02 0.10 2.03 -1.26 -4.34 116.55 107.19 2k23 n ASP 116 Ca -0.06 -0.02 -0.30 0.00 0.52 0.00 0.00 54.79 54.94 2k23 n ASP 116 Cb 0.74 -0.50 0.23 0.00 -0.72 0.00 0.00 41.12 40.86 2k23 n ASP 116 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2k23 s GLN 117 N -2.50 -0.87 0.41 -0.67 -0.21 -1.26 -4.43 119.66 110.13 2k23 s GLN 117 Ca -0.35 0.07 0.08 0.00 0.02 0.00 0.00 55.36 55.18 2k23 s GLN 117 Cb 0.10 -1.62 0.00 0.00 1.00 0.00 0.00 33.01 32.49 2k23 s GLN 117 CO 0.55 -3.51 0.53 -0.59 -2.12 0.00 0.00 175.29 170.16 2k23 s PHE 118 N -2.99 2.82 0.01 0.91 -0.71 -1.26 -4.14 117.98 112.62 2k23 s PHE 118 Ca 0.70 -0.40 0.02 0.00 -1.04 0.00 0.00 56.93 56.21 2k23 s PHE 118 Cb -0.12 -2.31 -0.01 0.00 -1.21 0.00 0.00 43.02 39.37 2k23 s PHE 118 CO 0.56 -0.34 -0.07 0.00 -1.34 0.00 0.00 175.22 174.04 2k23 s ALA 119 N -2.35 0.58 -0.27 1.99 0.00 -0.26 -4.23 121.76 117.21 2k23 s ALA 119 Ca 0.53 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 52.12 2k23 s ALA 119 Cb -0.09 -0.11 0.06 0.00 0.00 0.00 0.00 23.12 22.99 2k23 s ALA 119 CO 0.32 0.11 -0.08 -1.64 0.00 0.00 0.00 175.76 174.47 2k23 s MET 120 N -0.46 2.19 -0.13 0.00 -1.94 -1.15 -2.04 119.30 115.77 2k23 s MET 120 Ca 0.00 -1.39 0.01 0.00 -1.71 0.00 0.00 55.69 52.60 2k23 s MET 120 Cb -0.04 -2.97 -0.01 0.00 2.01 0.00 0.00 34.83 33.83 2k23 s MET 120 CO -0.00 -0.62 -0.18 0.08 -0.01 0.00 0.00 175.02 174.30 2k23 s VAL 121 N 1.10 2.59 -0.35 -6.03 1.01 0.18 0.83 120.40 119.73 2k23 s VAL 121 Ca -0.06 -0.82 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 2k23 s VAL 121 Cb -0.20 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 2k23 s VAL 121 CO -0.05 0.53 0.41 0.12 0.00 0.00 0.00 175.10 176.12 2k23 s PHE 122 N 0.48 3.20 -0.27 5.22 2.19 -0.82 0.43 117.98 128.41 2k23 s PHE 122 Ca -0.12 0.03 -0.10 0.00 0.33 0.00 0.00 56.93 57.06 2k23 s PHE 122 Cb -0.16 -2.76 -0.05 0.00 -1.31 0.00 0.00 43.02 38.74 2k23 s PHE 122 CO 0.05 -0.48 0.16 -0.06 1.83 0.00 0.00 175.22 176.72 2k23 s PHE 123 N 2.14 3.21 -0.15 10.12 0.40 0.75 -1.98 117.98 132.46 2k23 s PHE 123 Ca 0.14 0.02 -0.00 0.00 -0.60 0.00 0.00 56.93 56.49 2k23 s PHE 123 Cb -0.16 -2.33 -0.00 0.00 0.51 0.00 0.00 43.02 41.04 2k23 s PHE 123 CO 0.12 -0.16 -0.14 -1.14 0.70 0.00 0.00 175.22 174.60 2k23 s GLN 124 N 1.60 3.26 -0.15 0.44 0.74 -0.93 -1.08 119.66 123.53 2k23 s GLN 124 Ca 0.07 -0.73 -0.01 0.00 0.05 0.00 0.00 55.36 54.74 2k23 s GLN 124 Cb -0.15 -2.65 0.04 0.00 1.10 0.00 0.00 33.01 31.35 2k23 s GLN 124 CO 0.08 0.04 -0.02 0.21 -0.55 0.00 0.00 175.29 175.05 2k23 s LYS 125 N 0.76 1.10 -0.20 1.67 2.20 0.38 -2.37 119.74 123.29 2k23 s LYS 125 Ca -0.06 -0.37 -0.10 0.00 -0.36 0.00 0.00 55.97 55.09 2k23 s LYS 125 Cb -0.15 -1.82 -0.05 0.00 -1.51 0.00 0.00 37.83 34.30 2k23 s LYS 125 CO 0.01 -0.45 0.12 0.99 -0.36 0.00 0.00 175.35 175.66 2k23 s THR 126 N 1.75 5.30 -0.18 3.43 2.01 -0.44 -1.06 115.64 126.46 2k23 s THR 126 Ca 0.01 0.15 -0.16 0.00 0.31 0.00 0.00 61.69 62.01 2k23 s THR 126 Cb -0.15 -3.42 0.05 0.00 0.01 0.00 0.00 72.50 68.99 2k23 s THR 126 CO -0.07 0.44 0.47 -0.44 -0.69 0.00 0.00 174.62 174.33 2k23 s SER 127 N 0.37 -0.50 -1.48 3.53 0.01 0.64 -0.12 113.70 116.15 2k23 s SER 127 Ca 0.07 0.95 -0.06 0.00 1.31 0.00 0.00 55.95 58.22 2k23 s SER 127 Cb -0.11 0.94 0.02 0.00 0.21 0.00 0.00 66.02 67.08 2k23 s SER 127 CO -0.02 -0.17 0.59 1.21 0.41 0.00 0.00 173.24 175.27 2k23 n GLU 128 N 3.00 -4.60 0.00 12.44 4.07 -0.98 -0.73 120.64 133.84 2k23 n GLU 128 Ca -0.14 0.80 0.00 0.00 -0.06 0.00 0.00 57.16 57.75 2k23 n GLU 128 Cb 0.57 -5.63 0.00 0.00 -0.06 0.00 0.00 31.44 26.32 2k23 n GLU 128 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2k23 n ASN 129 N -2.48 0.00 -4.76 4.31 2.85 -1.26 -4.95 115.26 108.97 2k23 n ASN 129 Ca -0.09 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.01 2k23 n ASN 129 Cb 0.60 -0.47 -0.06 0.00 1.24 0.00 0.00 39.78 41.08 2k23 n ASN 129 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 2k23 s LYS 130 N 0.00 4.21 -0.22 1.20 -0.14 0.10 -5.05 119.74 119.83 2k23 s LYS 130 Ca 0.00 0.45 -0.09 0.00 -1.36 0.00 0.00 55.97 54.96 2k23 s LYS 130 Cb 0.00 -3.36 -0.05 0.00 -1.68 0.00 0.00 37.83 32.74 2k23 s LYS 130 CO 0.00 0.35 0.13 -0.65 -0.76 0.00 0.00 175.35 174.42 2k23 s GLN 131 N -0.00 4.04 -0.04 1.68 -0.21 -1.26 -0.26 119.66 123.62 2k23 s GLN 131 Ca 0.25 -0.29 0.05 0.00 0.02 0.00 0.00 55.36 55.39 2k23 s GLN 131 Cb -0.16 -3.43 -0.01 0.00 1.00 0.00 0.00 33.01 30.42 2k23 s GLN 131 CO 0.12 0.14 -0.18 0.71 -2.12 0.00 0.00 175.29 173.96 2k23 s TYR 132 N 0.80 1.74 0.13 0.91 2.02 -0.22 -4.58 117.35 118.13 2k23 s TYR 132 Ca 0.06 -0.45 -0.05 0.00 -0.37 0.00 0.00 57.07 56.27 2k23 s TYR 132 Cb -0.13 -1.15 -0.02 0.00 -0.40 0.00 0.00 41.96 40.26 2k23 s TYR 132 CO 0.02 -0.13 0.15 -0.59 -1.57 0.00 0.00 175.55 173.43 2k23 s PHE 133 N -0.12 0.55 0.02 2.71 -0.71 -1.26 -0.47 117.98 118.71 2k23 s PHE 133 Ca -0.00 -0.95 -0.18 0.00 -1.04 0.00 0.00 56.93 54.76 2k23 s PHE 133 Cb -0.10 -0.25 0.04 0.00 -1.21 0.00 0.00 43.02 41.49 2k23 s PHE 133 CO 0.01 -0.58 0.41 -1.59 -1.34 0.00 0.00 175.22 172.13 2k23 s LYS 134 N -3.98 0.87 -0.30 1.99 -2.85 -0.24 -3.00 119.74 112.24 2k23 s LYS 134 Ca 0.17 -0.28 -0.05 0.00 -1.00 0.00 0.00 55.97 54.81 2k23 s LYS 134 Cb 0.06 0.39 0.03 0.00 -2.06 0.00 0.00 37.83 36.24 2k23 s LYS 134 CO -0.02 -0.28 0.04 0.54 0.10 0.00 0.00 175.35 175.72 2k23 s VAL 135 N -2.13 3.49 -0.08 1.79 0.11 0.32 -0.18 120.40 123.73 2k23 s VAL 135 Ca -0.08 -1.00 -0.03 0.00 -2.93 0.00 0.00 61.98 57.95 2k23 s VAL 135 Cb -0.02 -2.87 -0.04 0.00 -1.53 0.00 0.00 36.38 31.93 2k23 s VAL 135 CO 0.00 0.01 0.04 0.28 -3.33 0.00 0.00 175.10 172.11 2k23 s THR 136 N 1.39 4.63 -0.18 5.04 -1.32 0.17 -1.22 115.64 124.16 2k23 s THR 136 Ca -0.00 -0.19 -0.03 0.00 -1.21 0.00 0.00 61.69 60.25 2k23 s THR 136 Cb -0.18 -3.00 -0.02 0.00 -1.51 0.00 0.00 72.50 67.79 2k23 s THR 136 CO 0.00 0.56 -0.06 -0.22 -2.21 0.00 0.00 174.62 172.69 2k23 s LEU 137 N -1.09 3.00 0.12 9.08 2.96 0.19 -0.65 118.68 132.30 2k23 s LEU 137 Ca 0.16 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 53.84 2k23 s LEU 137 Cb -0.12 -1.73 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 2k23 s LEU 137 CO 0.05 0.09 -0.10 -0.72 -1.32 0.00 0.00 176.35 174.35 2k23 s TYR 138 N 0.80 1.18 0.26 5.38 -0.85 -0.87 0.36 117.35 123.62 2k23 s TYR 138 Ca -0.02 -0.71 0.02 0.00 -0.52 0.00 0.00 57.07 55.84 2k23 s TYR 138 Cb -0.15 -0.62 -0.04 0.00 0.38 0.00 0.00 41.96 41.53 2k23 s TYR 138 CO 0.02 0.04 0.13 0.20 -1.52 0.00 0.00 175.55 174.42 2k23 s GLY 139 N -2.81 1.80 0.13 5.49 0.00 0.12 -1.11 107.32 110.95 2k23 s GLY 139 Ca 0.11 -1.80 -0.29 0.00 0.00 0.00 0.00 44.72 42.74 2k23 s GLY 139 CO 0.00 -1.54 1.58 -0.09 0.00 0.00 0.00 173.10 173.05 2k23 h ARG 140 N 2.37 -0.49 -0.26 2.90 2.43 -1.76 -2.56 114.38 117.01 2k23 h ARG 140 Ca -0.36 0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.70 2k23 h ARG 140 Cb 1.25 0.11 -0.14 0.00 -0.42 0.00 0.00 29.97 30.77 2k23 h ARG 140 CO 0.55 -0.33 -0.36 -2.37 -1.51 0.00 0.00 179.97 175.95 2k23 n THR 141 N -5.44 0.00 -0.55 0.20 5.66 -1.26 -4.39 114.28 108.50 2k23 n THR 141 Ca -0.04 -1.07 0.00 0.00 -3.05 0.00 0.00 64.05 59.88 2k23 n THR 141 Cb 0.36 1.20 0.00 0.00 -1.55 0.00 0.00 70.33 70.34 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 2.03 0.00 -3.90 1.09 4.76 -1.26 -4.86 118.16 116.02 2k23 n LYS 142 Ca 0.10 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.25 2k23 n LYS 142 Cb 0.63 -3.98 -0.12 0.00 -1.84 0.00 0.00 35.03 29.71 2k23 n LYS 142 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k23 s GLY 143 N -2.00 2.80 -0.04 0.72 0.00 -1.26 -5.04 107.32 102.49 2k23 s GLY 143 Ca 0.00 -3.69 0.04 0.00 0.00 0.00 0.00 44.72 41.08 2k23 s GLY 143 CO 0.00 1.09 -0.18 1.08 0.00 0.00 0.00 173.10 175.09 2k23 s LEU 144 N -1.18 1.93 0.58 0.66 1.43 -1.26 -4.83 118.68 116.02 2k23 s LEU 144 Ca 0.23 -0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 52.76 2k23 s LEU 144 Cb -0.09 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 2k23 s LEU 144 CO -0.13 0.16 1.30 -0.55 0.23 0.00 0.00 176.35 177.36 2k23 s SER 145 N 0.02 5.08 0.59 2.29 0.15 -1.26 -4.88 113.70 115.69 2k23 s SER 145 Ca -0.04 2.64 0.29 0.00 0.70 0.00 0.00 55.95 59.54 2k23 s SER 145 Cb -0.12 -2.62 1.80 0.00 -1.71 0.00 0.00 66.02 63.37 2k23 s SER 145 CO 0.02 -1.69 2.24 -0.78 1.20 0.00 0.00 173.24 174.23 2k23 h ASP 146 N 1.10 0.00 -0.16 5.45 3.58 -2.00 -2.00 116.42 122.39 2k23 h ASP 146 Ca -0.51 0.00 0.03 0.00 0.42 0.00 0.00 57.03 56.98 2k23 h ASP 146 Cb 1.31 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.33 2k23 h ASP 146 CO 0.56 0.00 -0.05 -0.08 -2.88 0.00 0.00 179.24 176.79 2k23 h GLU 147 N 0.00 -0.01 -0.00 0.28 4.81 -1.99 -1.60 114.58 116.06 2k23 h GLU 147 Ca 0.01 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.09 2k23 h GLU 147 Cb 0.07 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2k23 h GLU 147 CO -0.00 -0.01 -0.72 1.37 -0.73 0.00 0.00 179.01 178.93 2k23 h LEU 148 N -0.01 0.03 -0.04 1.64 8.10 -1.73 -1.70 115.31 121.61 2k23 h LEU 148 Ca 0.08 -0.02 -0.17 0.00 0.11 0.00 0.00 57.88 57.87 2k23 h LEU 148 Cb 0.13 -0.01 0.01 0.00 -0.44 0.00 0.00 40.66 40.35 2k23 h LEU 148 CO -0.17 0.74 -0.65 0.07 -4.11 0.00 0.00 178.44 174.31 2k23 h LYS 149 N 0.02 0.51 -0.74 0.17 2.10 -1.50 -2.34 116.57 114.79 2k23 h LYS 149 Ca -0.01 -0.50 0.11 0.00 -2.00 0.00 0.00 60.65 58.25 2k23 h LYS 149 Cb 1.27 0.13 -0.05 0.00 -0.90 0.00 0.00 32.23 32.67 2k23 h LYS 149 CO 0.10 1.13 0.49 1.49 -2.00 0.00 0.00 179.45 180.66 2k23 h GLU 150 N 0.08 0.57 -0.54 0.07 4.81 -1.22 0.11 114.58 118.46 2k23 h GLU 150 Ca -0.07 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.09 2k23 h GLU 150 Cb 1.33 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 2k23 h GLU 150 CO 0.13 0.37 0.19 0.00 -0.73 0.00 0.00 179.01 178.98 2k23 h ARG 151 N 0.58 0.78 -0.25 1.92 3.08 -1.08 -1.52 114.38 117.90 2k23 h ARG 151 Ca 0.35 -0.13 -0.17 0.00 0.07 0.00 0.00 59.98 60.11 2k23 h ARG 151 Cb 0.57 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2k23 h ARG 151 CO -0.12 0.66 -0.49 0.27 -1.07 0.00 0.00 179.97 179.22 2k23 h PHE 152 N 0.77 0.97 -0.57 3.04 -5.15 -0.31 -1.95 116.94 113.74 2k23 h PHE 152 Ca 0.18 -0.35 -0.04 0.00 -0.20 0.00 0.00 57.97 57.56 2k23 h PHE 152 Cb 0.19 -0.18 -0.03 0.00 0.22 0.00 0.00 35.95 36.16 2k23 h PHE 152 CO 0.01 1.15 0.18 -0.39 -2.00 0.00 0.00 178.31 177.26 2k23 h VAL 153 N 0.51 1.22 -0.44 0.88 -1.51 -0.93 0.28 116.25 116.25 2k23 h VAL 153 Ca 0.01 -0.76 -0.07 0.00 -1.23 0.00 0.00 66.70 64.64 2k23 h VAL 153 Cb 1.10 0.59 -0.02 0.00 -2.13 0.00 0.00 31.29 30.83 2k23 h VAL 153 CO 0.11 0.29 -0.02 0.28 -1.23 0.00 0.00 177.57 177.00 2k23 h SER 154 N 0.84 0.70 -0.39 4.19 0.02 -1.24 -1.31 113.55 116.36 2k23 h SER 154 Ca 0.19 -0.17 -0.09 0.00 -0.84 0.00 0.00 61.79 60.88 2k23 h SER 154 Cb 0.25 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 2k23 h SER 154 CO -0.01 0.78 -0.08 0.15 -1.14 0.00 0.00 176.83 176.53 2k23 h PHE 155 N 0.68 0.91 -0.27 3.45 3.57 -0.40 -0.71 116.94 124.17 2k23 h PHE 155 Ca 0.13 -0.16 0.04 0.00 3.53 0.00 0.00 57.97 61.51 2k23 h PHE 155 Cb 0.45 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 2k23 h PHE 155 CO 0.02 0.87 0.05 0.00 -2.23 0.00 0.00 178.31 177.03 2k23 h ALA 156 N 1.15 0.28 -0.16 2.41 0.00 0.27 0.12 119.26 123.33 2k23 h ALA 156 Ca 0.13 0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 2k23 h ALA 156 Cb 0.57 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2k23 h ALA 156 CO 0.04 -0.36 -0.64 0.87 0.00 0.00 0.00 179.25 179.16 2k23 h LYS 157 N 0.16 0.57 0.00 0.00 1.57 -1.06 0.32 116.57 118.13 2k23 h LYS 157 Ca 0.13 -0.41 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 2k23 h LYS 157 Cb 0.13 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2k23 h LYS 157 CO -0.17 1.02 -0.08 0.66 -0.57 0.00 0.00 179.45 180.32 2k23 h SER 158 N 0.42 0.00 1.27 0.86 4.64 -0.98 -2.49 113.55 117.27 2k23 h SER 158 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2k23 h SER 158 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2k23 h SER 158 CO 0.12 0.08 -0.02 -0.11 -0.87 0.00 0.00 176.83 176.02 2k23 n LEU 159 N -3.14 0.50 0.00 5.97 7.94 0.41 -4.90 117.00 123.78 2k23 n LEU 159 Ca 0.02 0.53 0.00 0.00 -1.11 0.00 0.00 56.01 55.45 2k23 n LEU 159 Cb 0.47 -0.38 0.00 0.00 0.53 0.00 0.00 43.42 44.04 2k23 n LEU 159 CO 0.32 -0.11 0.00 0.61 -1.11 0.00 0.00 177.39 177.11 2k23 n GLY 160 N 1.38 1.26 1.16 -3.96 0.00 -0.94 -4.62 105.19 99.48 2k23 n GLY 160 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.80 0.99 4.77 0.08 -4.55 117.00 114.48 2k23 n LEU 161 Ca 0.00 -0.65 -0.12 0.00 -0.03 0.00 0.00 56.01 55.21 2k23 n LEU 161 Cb 0.00 -0.18 -0.09 0.00 -2.33 0.00 0.00 43.42 40.81 2k23 n LEU 161 CO 0.00 -0.64 -0.06 -1.59 -1.33 0.00 0.00 177.39 173.78 2k23 s LYS 162 N -3.14 0.57 0.58 3.23 0.00 -1.26 -3.84 119.74 115.89 2k23 s LYS 162 Ca 0.20 -0.24 0.31 0.00 0.00 0.00 0.00 55.97 56.24 2k23 s LYS 162 Cb -0.01 0.25 1.38 0.00 0.00 0.00 0.00 37.83 39.45 2k23 s LYS 162 CO 0.13 -0.15 1.73 0.22 0.00 0.00 0.00 175.35 177.28 2k23 h ASP 163 N 4.14 0.00 0.26 0.03 3.58 -1.92 0.13 116.42 122.65 2k23 h ASP 163 Ca -0.30 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.15 2k23 h ASP 163 Cb 1.18 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.23 2k23 h ASP 163 CO 0.40 0.00 0.00 0.59 -2.88 0.00 0.00 179.24 177.35 2k23 n ASN 164 N -3.72 0.00 -1.64 2.28 3.02 -1.26 -0.71 115.26 113.24 2k23 n ASN 164 Ca 0.17 0.29 -0.00 0.00 -0.03 0.00 0.00 54.58 55.01 2k23 n ASN 164 Cb 1.04 -0.38 0.07 0.00 -0.61 0.00 0.00 39.78 39.90 2k23 n ASN 164 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2k23 n ASN 165 N -1.38 1.85 -3.88 6.41 3.02 0.45 -4.80 115.26 116.93 2k23 n ASN 165 Ca 0.04 -2.73 -0.30 0.00 -0.03 0.00 0.00 54.58 51.56 2k23 n ASN 165 Cb 0.10 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 38.72 2k23 n ASN 165 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2k23 s ILE 166 N -2.28 1.56 0.52 2.41 1.01 0.12 0.10 121.20 124.63 2k23 s ILE 166 Ca 0.36 -1.77 0.09 0.00 0.00 0.00 0.00 60.65 59.32 2k23 s ILE 166 Cb 0.37 -2.11 0.06 0.00 0.01 0.00 0.00 42.46 40.79 2k23 s ILE 166 CO -0.09 -0.56 0.71 0.68 0.00 0.00 0.00 174.94 175.68 2k23 s VAL 167 N 1.29 2.49 -0.03 2.92 -7.23 0.14 -4.92 120.40 115.05 2k23 s VAL 167 Ca 0.08 -0.98 0.07 0.00 -1.81 0.00 0.00 61.98 59.35 2k23 s VAL 167 Cb -0.18 -2.51 -0.02 0.00 0.56 0.00 0.00 36.38 34.23 2k23 s VAL 167 CO -0.15 0.00 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.03 2k23 s PHE 168 N -2.56 2.31 -0.04 2.82 0.08 -1.26 -1.45 117.98 117.88 2k23 s PHE 168 Ca 0.59 -0.50 -0.30 0.00 0.12 0.00 0.00 56.93 56.84 2k23 s PHE 168 Cb -0.07 -1.49 -0.06 0.00 -0.57 0.00 0.00 43.02 40.83 2k23 s PHE 168 CO 0.37 -0.08 1.58 -1.54 -0.10 0.00 0.00 175.22 175.45 2k23 s SER 169 N -0.49 6.71 -0.14 1.36 1.04 -1.19 -4.65 113.70 116.35 2k23 s SER 169 Ca 0.06 2.21 -0.24 0.00 0.48 0.00 0.00 55.95 58.47 2k23 s SER 169 Cb -0.11 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.45 2k23 s SER 169 CO 0.00 -0.88 0.75 -0.69 0.98 0.00 0.00 173.24 173.40 2k23 s VAL 170 N 3.54 4.96 -0.74 5.02 1.01 -1.26 -4.50 120.40 128.44 2k23 s VAL 170 Ca 0.71 1.48 -0.26 0.00 0.00 0.00 0.00 61.98 63.91 2k23 s VAL 170 Cb -0.33 -4.07 -0.12 0.00 0.00 0.00 0.00 36.38 31.87 2k23 s VAL 170 CO 0.28 0.12 2.36 -2.84 0.00 0.00 0.00 175.10 175.03 2k23 s PRO 171 N 1.65 1.78 0.60 2.72 0.02 -1.26 0.11 135.00 140.62 2k23 s PRO 171 Ca 0.36 0.61 -0.18 0.00 0.02 0.00 0.00 61.00 61.81 2k23 s PRO 171 Cb -0.17 -4.76 -0.03 0.00 0.02 0.00 0.00 34.50 29.56 2k23 s PRO 171 CO 0.14 -4.12 1.15 -0.08 -0.33 0.00 0.00 177.00 173.75 2k23 s THR 172 N 13.87 3.01 -1.04 0.99 -1.32 -1.26 -4.94 115.64 124.95 2k23 s THR 172 Ca 0.91 0.57 -0.15 0.00 -1.21 0.00 0.00 61.69 61.81 2k23 s THR 172 Cb -0.13 -3.16 0.17 0.00 -1.51 0.00 0.00 72.50 67.88 2k23 s THR 172 CO 0.11 -0.20 1.19 1.51 -2.21 0.00 0.00 174.62 175.03 2k23 s ASP 173 N -2.01 6.89 0.25 8.08 -4.77 -1.26 -4.86 116.67 119.00 2k23 s ASP 173 Ca 0.72 -2.66 -0.07 0.00 -3.30 0.00 0.00 52.55 47.24 2k23 s ASP 173 Cb -0.25 -2.35 0.03 0.00 -1.09 0.00 0.00 42.92 39.26 2k23 s ASP 173 CO 0.34 -0.79 0.45 0.00 0.70 0.00 0.00 175.17 175.87 2k23 n GLN 174 N 5.43 0.65 -0.45 2.11 1.13 -1.26 -5.02 117.38 119.96 2k23 n GLN 174 Ca 0.27 -1.56 -0.00 0.00 -1.94 0.00 0.00 57.00 53.77 2k23 n GLN 174 Cb 0.45 1.78 -0.00 0.00 0.11 0.00 0.00 30.24 32.58 2k23 n GLN 174 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k23 h ILE 176 N 1.16 1.12 -2.82 0.00 2.10 -1.96 -3.42 117.51 113.70 2k23 h ILE 176 Ca 0.00 -0.99 -0.56 0.00 1.08 0.00 0.00 64.86 64.40 2k23 h ILE 176 Cb 0.89 1.54 -0.03 0.00 -1.09 0.00 0.00 36.82 38.13 2k23 h ILE 176 CO 0.01 0.28 1.00 -0.62 -1.08 0.00 0.00 178.15 177.73 2k23 s ASP 177 N -6.84 6.75 0.00 2.19 2.15 -1.26 -4.69 116.67 114.96 2k23 s ASP 177 Ca -0.03 1.80 0.15 0.00 0.43 0.00 0.00 52.55 54.89 2k23 s ASP 177 Cb 0.15 -2.54 0.12 0.00 -0.30 0.00 0.00 42.92 40.35 2k23 s ASP 177 CO 0.70 -0.92 0.97 -3.20 -0.17 0.00 0.00 175.17 172.54