#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k23 s ASP 2 N 0.00 4.04 0.49 1.08 2.15 -1.26 -4.92 116.67 118.24 2k23 s ASP 2 Ca 0.00 -2.09 -0.16 0.00 0.43 0.00 0.00 52.55 50.72 2k23 s ASP 2 Cb 0.00 -1.07 -0.08 0.00 -0.30 0.00 0.00 42.92 41.47 2k23 s ASP 2 CO 0.00 -0.36 0.95 -0.44 -0.17 0.00 0.00 175.17 175.16 2k23 s SER 3 N 1.02 6.65 0.00 -0.34 0.01 -1.26 -5.05 113.70 114.72 2k23 s SER 3 Ca 0.13 1.53 0.00 0.00 1.31 0.00 0.00 55.95 58.92 2k23 s SER 3 Cb -0.20 -2.49 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2k23 s SER 3 CO -0.13 -0.54 0.00 0.35 0.41 0.00 0.00 173.24 173.33 2k23 n THR 4 N -1.44 0.00 -1.17 1.44 -2.24 -1.26 -4.63 114.28 104.98 2k23 n THR 4 Ca 0.06 0.10 -0.01 0.00 -2.27 0.00 0.00 64.05 61.93 2k23 n THR 4 Cb 0.54 -0.32 0.25 0.00 -2.10 0.00 0.00 70.33 68.70 2k23 n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k23 n GLN 5 N 0.00 2.74 0.00 -0.78 6.02 -1.26 -4.94 117.38 119.16 2k23 n GLN 5 Ca 0.00 -3.03 0.00 0.00 -0.01 0.00 0.00 57.00 53.96 2k23 n GLN 5 Cb 0.00 -1.95 0.00 0.00 1.02 0.00 0.00 30.24 29.31 2k23 n GLN 5 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2k23 n ASN 6 N -0.66 0.00 -4.77 1.08 4.13 -1.26 -5.01 115.26 108.77 2k23 n ASN 6 Ca 0.33 0.00 -0.40 0.00 1.68 0.00 0.00 54.58 56.18 2k23 n ASN 6 Cb 1.12 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 39.35 2k23 n ASN 6 CO 0.00 0.00 0.00 -1.48 0.28 0.00 0.00 177.26 176.06 2k23 s LEU 7 N 0.00 4.27 0.18 3.41 0.05 -1.26 -5.01 118.68 120.33 2k23 s LEU 7 Ca 0.00 2.81 -0.17 0.00 0.05 0.00 0.00 54.13 56.83 2k23 s LEU 7 Cb 0.00 -3.79 -0.07 0.00 -2.05 0.00 0.00 46.19 40.28 2k23 s LEU 7 CO 0.00 -0.84 0.63 -0.63 -0.55 0.00 0.00 176.35 174.96 2k23 s ILE 8 N -1.19 4.73 0.00 1.48 1.01 -1.26 -4.58 121.20 121.40 2k23 s ILE 8 Ca 0.55 1.02 0.00 0.00 0.00 0.00 0.00 60.65 62.22 2k23 s ILE 8 Cb -0.42 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.27 2k23 s ILE 8 CO 0.55 0.22 0.00 -2.65 0.00 0.00 0.00 174.94 173.06 2k23 n PRO 9 N 0.75 0.00 -2.47 2.79 -0.02 -1.26 -4.69 135.00 130.10 2k23 n PRO 9 Ca -0.04 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.02 2k23 n PRO 9 Cb 0.51 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.97 2k23 n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k23 s ALA 10 N 0.00 2.92 -0.15 3.55 0.00 -1.26 -4.56 121.76 122.26 2k23 s ALA 10 Ca 0.00 -0.68 -0.14 0.00 0.00 0.00 0.00 51.96 51.14 2k23 s ALA 10 Cb 0.00 -4.05 -0.05 0.00 0.00 0.00 0.00 23.12 19.02 2k23 s ALA 10 CO 0.00 -2.75 0.30 -1.25 0.00 0.00 0.00 175.76 172.06 2k23 s PRO 11 N 5.19 4.23 0.97 0.00 0.05 -1.26 -5.09 135.00 139.09 2k23 s PRO 11 Ca 0.49 0.12 -0.11 0.00 0.05 0.00 0.00 61.00 61.54 2k23 s PRO 11 Cb -0.09 -3.41 0.17 0.00 0.05 0.00 0.00 34.50 31.22 2k23 s PRO 11 CO 0.26 0.26 1.09 -1.25 0.05 0.00 0.00 177.00 177.42 2k23 s PRO 12 N 0.39 0.62 0.31 0.56 0.04 -1.26 -4.87 135.00 130.78 2k23 s PRO 12 Ca 0.17 1.11 0.07 0.00 0.04 0.00 0.00 61.00 62.38 2k23 s PRO 12 Cb -0.13 -1.71 0.84 0.00 0.04 0.00 0.00 34.50 33.54 2k23 s PRO 12 CO 0.04 -2.76 1.66 1.25 0.04 0.00 0.00 177.00 177.24 2k23 h LEU 13 N -1.94 0.24 -0.03 -3.56 7.12 -1.96 0.08 115.31 115.27 2k23 h LEU 13 Ca -0.50 0.19 0.00 0.00 0.13 0.00 0.00 57.88 57.69 2k23 h LEU 13 Cb 1.29 0.20 0.00 0.00 -0.53 0.00 0.00 40.66 41.61 2k23 h LEU 13 CO 0.49 -0.11 0.00 2.30 -0.13 0.00 0.00 178.44 180.98 2k23 n ILE 14 N -5.13 1.97 0.13 4.05 -5.35 -1.26 -0.13 119.36 113.64 2k23 n ILE 14 Ca 0.25 0.50 0.00 0.00 -0.27 0.00 0.00 62.75 63.23 2k23 n ILE 14 Cb 0.78 -1.50 0.04 0.00 -1.74 0.00 0.00 39.64 37.22 2k23 n ILE 14 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2k23 h SER 15 N 0.00 0.00 -3.22 7.28 0.02 -1.31 -3.45 113.55 112.88 2k23 h SER 15 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 2k23 h SER 15 Cb 0.00 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.46 2k23 h SER 15 CO 0.00 0.63 -0.28 0.54 -1.14 0.00 0.00 176.83 176.58 2k23 s VAL 16 N -3.03 5.25 0.70 2.27 0.11 0.82 -5.07 120.40 121.45 2k23 s VAL 16 Ca 0.02 0.66 -0.14 0.00 -2.93 0.00 0.00 61.98 59.59 2k23 s VAL 16 Cb 0.09 -3.67 0.02 0.00 -1.53 0.00 0.00 36.38 31.29 2k23 s VAL 16 CO 0.76 0.42 1.13 -2.84 -3.33 0.00 0.00 175.10 171.24 2k23 s PRO 17 N 0.16 2.50 -0.04 1.54 0.02 -1.26 -4.97 135.00 132.95 2k23 s PRO 17 Ca 0.19 1.45 -0.03 0.00 0.02 0.00 0.00 61.00 62.64 2k23 s PRO 17 Cb -0.14 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.44 2k23 s PRO 17 CO 0.07 -1.50 0.12 -1.17 -0.33 0.00 0.00 177.00 174.19 2k23 s LEU 18 N -5.15 4.16 -0.40 -5.54 2.96 -1.26 -3.47 118.68 109.98 2k23 s LEU 18 Ca 0.68 0.29 -0.28 0.00 -0.22 0.00 0.00 54.13 54.60 2k23 s LEU 18 Cb -0.22 -2.31 -0.02 0.00 0.50 0.00 0.00 46.19 44.14 2k23 s LEU 18 CO 0.45 0.31 1.82 -1.58 -1.32 0.00 0.00 176.35 176.03 2k23 s GLN 19 N -1.57 3.15 0.03 1.98 2.00 -1.04 -4.89 119.66 119.30 2k23 s GLN 19 Ca 0.22 1.24 -0.30 0.00 -2.00 0.00 0.00 55.36 54.51 2k23 s GLN 19 Cb -0.12 -4.25 -0.07 0.00 0.80 0.00 0.00 33.01 29.37 2k23 s GLN 19 CO 0.12 -2.09 1.54 -1.25 -0.50 0.00 0.00 175.29 173.12 2k23 s PRO 20 N 6.03 4.23 -1.13 1.67 0.04 -1.26 -3.67 135.00 140.91 2k23 s PRO 20 Ca 0.77 2.16 -0.20 0.00 0.04 0.00 0.00 61.00 63.77 2k23 s PRO 20 Cb -0.20 -3.62 -0.01 0.00 0.04 0.00 0.00 34.50 30.71 2k23 s PRO 20 CO 0.30 -0.67 0.81 0.41 0.04 0.00 0.00 177.00 177.89 2k23 n GLY 21 N 3.85 -1.01 3.92 0.56 0.00 -1.26 -4.99 105.19 106.26 2k23 n GLY 21 Ca 0.15 0.47 -0.20 0.00 0.00 0.00 0.00 46.02 46.44 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 -3.46 2.81 0.09 1.61 5.36 -1.24 -5.12 117.98 118.03 2k23 s PHE 22 Ca 0.48 -0.41 0.09 0.00 -0.96 0.00 0.00 56.93 56.13 2k23 s PHE 22 Cb -0.16 -2.16 -0.03 0.00 -0.34 0.00 0.00 43.02 40.32 2k23 s PHE 22 CO 0.85 -0.16 -0.24 -1.58 -1.46 0.00 0.00 175.22 172.64 2k23 s TRP 23 N -2.38 2.04 0.14 10.12 0.52 -1.26 -4.88 118.94 123.24 2k23 s TRP 23 Ca 0.49 -0.40 -0.27 0.00 0.02 0.00 0.00 56.10 55.94 2k23 s TRP 23 Cb -0.06 -1.15 -0.02 0.00 -1.15 0.00 0.00 33.47 31.09 2k23 s TRP 23 CO 0.30 0.21 1.58 1.79 0.02 0.00 0.00 176.95 180.85 2k23 h THR 24 N 4.10 0.14 0.00 2.01 1.35 -1.99 -2.02 112.91 116.49 2k23 h THR 24 Ca -0.47 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.36 2k23 h THR 24 Cb 1.17 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 67.72 2k23 h THR 24 CO 0.41 0.00 -0.15 1.05 -0.25 0.00 0.00 175.52 176.58 2k23 h GLU 25 N -0.39 0.00 -0.00 4.72 4.11 -1.96 -2.26 114.58 118.80 2k23 h GLU 25 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.54 2k23 h GLU 25 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2k23 h GLU 25 CO -0.50 0.15 -0.23 0.54 0.07 0.00 0.00 179.01 179.04 2k23 n ARG 26 N -3.28 0.41 -0.51 1.06 5.12 -0.91 -2.42 116.66 116.13 2k23 n ARG 26 Ca 0.01 -0.18 0.08 0.00 -1.93 0.00 0.00 57.85 55.83 2k23 n ARG 26 Cb 0.41 -1.50 0.29 0.00 -1.16 0.00 0.00 32.46 30.50 2k23 n ARG 26 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2k23 n PHE 27 N -1.14 1.16 -3.93 -1.55 -0.00 -0.81 -4.52 117.46 106.67 2k23 n PHE 27 Ca 0.10 -0.74 -0.35 0.00 -0.00 0.00 0.00 57.45 56.46 2k23 n PHE 27 Cb 0.32 -0.29 -0.06 0.00 -0.00 0.00 0.00 39.48 39.45 2k23 n PHE 27 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 2k23 s GLN 28 N -2.34 3.39 0.00 -4.13 -0.44 -1.02 -4.72 119.66 110.41 2k23 s GLN 28 Ca 0.43 -0.24 0.00 0.00 -2.50 0.00 0.00 55.36 53.05 2k23 s GLN 28 Cb 0.32 -3.11 0.00 0.00 -1.64 0.00 0.00 33.01 28.57 2k23 s GLN 28 CO 0.14 0.73 0.00 0.41 0.50 0.00 0.00 175.29 177.07 2k23 n GLY 29 N 1.55 0.78 3.62 2.59 0.00 -0.17 -4.95 105.19 108.60 2k23 n GLY 29 Ca -0.16 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.41 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 -1.17 4.05 -0.13 1.61 3.00 -1.26 -1.24 118.95 123.81 2k23 s ARG 30 Ca 0.00 0.12 0.01 0.00 0.00 0.00 0.00 55.73 55.87 2k23 s ARG 30 Cb 0.00 -3.64 0.02 0.00 0.00 0.00 0.00 34.95 31.33 2k23 s ARG 30 CO 0.00 -0.26 -0.16 -1.58 0.00 0.00 0.00 175.30 173.30 2k23 s TRP 31 N 2.01 2.18 -0.03 -0.53 0.51 -0.54 -4.36 118.94 118.18 2k23 s TRP 31 Ca 0.17 -1.11 -0.14 0.00 -2.12 0.00 0.00 56.10 52.89 2k23 s TRP 31 Cb -0.16 -1.56 -0.05 0.00 -0.81 0.00 0.00 33.47 30.89 2k23 s TRP 31 CO 0.09 -0.57 0.38 -0.06 -0.51 0.00 0.00 176.95 176.28 2k23 s PHE 32 N 1.12 3.69 -0.41 -1.98 0.40 0.23 -0.28 117.98 120.74 2k23 s PHE 32 Ca -0.03 0.92 -0.29 0.00 -0.60 0.00 0.00 56.93 56.93 2k23 s PHE 32 Cb -0.14 -2.27 0.00 0.00 0.51 0.00 0.00 43.02 41.12 2k23 s PHE 32 CO -0.05 0.60 1.49 0.08 0.70 0.00 0.00 175.22 178.04 2k23 s VAL 33 N -0.87 3.81 -0.08 -0.44 1.01 -1.01 -0.54 120.40 122.28 2k23 s VAL 33 Ca 0.22 0.81 0.21 0.00 0.00 0.00 0.00 61.98 63.23 2k23 s VAL 33 Cb -0.16 -4.12 -0.30 0.00 0.00 0.00 0.00 36.38 31.81 2k23 s VAL 33 CO 0.12 -0.73 0.43 0.52 0.00 0.00 0.00 175.10 175.43 2k23 n VAL 34 N 7.14 0.39 -3.72 2.92 0.31 0.11 -4.59 118.33 120.88 2k23 n VAL 34 Ca 0.17 -0.59 -0.10 0.00 -0.01 0.00 0.00 64.34 63.82 2k23 n VAL 34 Cb 0.48 -0.15 -0.04 0.00 -0.91 0.00 0.00 33.84 33.22 2k23 n VAL 34 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2k23 s GLY 35 N -4.74 -0.10 -0.23 2.92 0.00 -1.03 -2.48 107.32 101.65 2k23 s GLY 35 Ca -0.08 -0.21 -0.14 0.00 0.00 0.00 0.00 44.72 44.28 2k23 s GLY 35 CO 0.88 -0.31 0.57 -2.27 0.00 0.00 0.00 173.10 171.97 2k23 s LEU 36 N -2.86 -0.50 0.08 0.66 2.96 -0.35 -0.58 118.68 118.10 2k23 s LEU 36 Ca 0.08 1.22 0.06 0.00 -0.22 0.00 0.00 54.13 55.27 2k23 s LEU 36 Cb 0.00 1.93 -0.03 0.00 0.50 0.00 0.00 46.19 48.59 2k23 s LEU 36 CO -0.05 -0.22 -0.16 0.00 -1.32 0.00 0.00 176.35 174.60 2k23 s ALA 37 N 1.30 1.36 0.00 5.97 0.00 0.18 0.81 121.76 131.39 2k23 s ALA 37 Ca -0.08 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.82 2k23 s ALA 37 Cb -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 23.12 22.91 2k23 s ALA 37 CO -0.13 0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.26 2k23 n GLY 38 N 1.26 3.98 0.00 0.00 0.00 0.10 0.39 105.19 110.92 2k23 n GLY 38 Ca -0.21 -0.84 0.14 0.00 0.00 0.00 0.00 46.02 45.11 2k23 n GLY 38 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2k23 n ASN 39 N 0.00 0.00 -0.60 1.61 6.94 -1.08 -1.72 115.26 120.41 2k23 n ASN 39 Ca 0.00 -0.08 0.07 0.00 -0.02 0.00 0.00 54.58 54.54 2k23 n ASN 39 Cb 0.00 -0.30 0.09 0.00 -2.36 0.00 0.00 39.78 37.21 2k23 n ASN 39 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2k23 n ALA 40 N -1.30 2.42 -1.77 -2.53 0.00 -1.26 -4.98 120.51 111.10 2k23 n ALA 40 Ca 0.13 -0.73 -0.38 0.00 0.00 0.00 0.00 53.44 52.45 2k23 n ALA 40 Cb 0.23 -0.48 -0.02 0.00 0.00 0.00 0.00 19.45 19.18 2k23 n ALA 40 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2k23 s VAL 41 N -1.12 3.20 -1.21 0.00 1.01 -0.70 -4.91 120.40 116.67 2k23 s VAL 41 Ca 0.19 1.03 -0.21 0.00 0.00 0.00 0.00 61.98 62.99 2k23 s VAL 41 Cb 0.12 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 2k23 s VAL 41 CO 0.18 0.11 1.88 1.67 0.00 0.00 0.00 175.10 178.94 2k23 n GLN 42 N 0.22 2.19 -4.03 2.72 7.27 -1.26 -4.86 117.38 119.63 2k23 n GLN 42 Ca 0.04 -2.71 -0.32 0.00 0.07 0.00 0.00 57.00 54.08 2k23 n GLN 42 Cb 0.46 -3.58 -0.15 0.00 2.41 0.00 0.00 30.24 29.38 2k23 n GLN 42 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 2k23 s LYS 43 N 5.47 1.79 -0.13 3.69 2.36 -1.26 -2.48 119.74 129.18 2k23 s LYS 43 Ca 0.62 -1.67 -0.14 0.00 -2.55 0.00 0.00 55.97 52.23 2k23 s LYS 43 Cb 0.03 -3.10 -0.12 0.00 -1.05 0.00 0.00 37.83 33.59 2k23 s LYS 43 CO 0.11 -0.80 0.30 1.05 1.55 0.00 0.00 175.35 177.56 2k23 h GLU 44 N 7.69 0.00 0.00 4.03 -0.00 -1.89 -3.47 114.58 120.94 2k23 h GLU 44 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.26 2k23 h GLU 44 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.78 2k23 h GLU 44 CO 0.50 0.46 0.00 -2.13 -0.00 0.00 0.00 179.01 177.84 2k23 n ARG 45 N -4.67 0.00 -0.01 1.06 0.63 -1.26 -5.03 116.66 107.37 2k23 n ARG 45 Ca -0.07 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.85 2k23 n ARG 45 Cb 0.26 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.17 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 -0.39 0.08 0.00 -0.14 6.02 -1.26 -4.99 117.38 116.70 2k23 n GLN 46 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2k23 n GLN 46 Cb 0.00 -0.58 0.00 0.00 1.02 0.00 0.00 30.24 30.68 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 -2.84 0.00 0.00 1.08 3.41 -1.26 -4.90 113.62 109.12 2k23 n SER 47 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 2k23 n SER 47 Cb 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 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 0.00 2.24 -1.47 4.33 3.00 -1.26 -4.85 116.66 118.65 2k23 n ARG 48 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 57.85 58.04 2k23 n ARG 48 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 2k23 n ARG 48 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2k23 n PHE 49 N 0.00 -3.81 -3.66 -0.14 7.35 -1.04 -4.33 117.46 111.84 2k23 n PHE 49 Ca 0.00 1.99 -0.05 0.00 -0.76 0.00 0.00 57.45 58.63 2k23 n PHE 49 Cb 0.00 -3.46 -0.07 0.00 0.35 0.00 0.00 39.48 36.30 2k23 n PHE 49 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2k23 s THR 50 N -3.21 -0.62 0.48 -2.13 -4.23 -1.26 -3.78 115.64 100.88 2k23 s THR 50 Ca 0.00 0.06 -0.24 0.00 -1.18 0.00 0.00 61.69 60.33 2k23 s THR 50 Cb 0.00 -0.85 -0.08 0.00 1.34 0.00 0.00 72.50 72.91 2k23 s THR 50 CO 0.00 0.03 1.41 1.15 -0.54 0.00 0.00 174.62 176.66 2k23 n MET 51 N 5.12 2.09 -4.45 3.99 0.00 -0.75 -4.84 117.12 118.28 2k23 n MET 51 Ca -0.13 0.75 -0.23 0.00 0.00 0.00 0.00 57.70 58.09 2k23 n MET 51 Cb 0.51 -2.60 -0.09 0.00 0.00 0.00 0.00 33.22 31.04 2k23 n MET 51 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 175.97 177.49 2k23 s TYR 52 N -1.22 1.76 -0.26 3.17 -0.85 -1.26 -4.72 117.35 113.96 2k23 s TYR 52 Ca 0.64 -1.30 -0.08 0.00 -0.52 0.00 0.00 57.07 55.81 2k23 s TYR 52 Cb -0.44 -1.07 -0.03 0.00 0.38 0.00 0.00 41.96 40.80 2k23 s TYR 52 CO 0.55 -0.36 0.11 -1.12 -1.52 0.00 0.00 175.55 173.21 2k23 s SER 53 N -3.52 5.38 -0.54 -0.18 0.01 -1.26 -2.42 113.70 111.16 2k23 s SER 53 Ca 0.29 -0.21 -0.19 0.00 1.31 0.00 0.00 55.95 57.15 2k23 s SER 53 Cb 0.04 -1.98 0.08 0.00 0.21 0.00 0.00 66.02 64.38 2k23 s SER 53 CO 0.16 -0.06 0.63 -0.89 0.41 0.00 0.00 173.24 173.49 2k23 s THR 54 N 1.64 4.90 -0.55 1.44 2.01 0.61 -3.48 115.64 122.21 2k23 s THR 54 Ca 0.06 -0.83 -0.12 0.00 0.31 0.00 0.00 61.69 61.12 2k23 s THR 54 Cb -0.16 -4.37 0.14 0.00 0.01 0.00 0.00 72.50 68.12 2k23 s THR 54 CO 0.06 -0.94 0.46 -0.63 -0.69 0.00 0.00 174.62 172.88 2k23 s ILE 55 N 2.51 4.68 -0.57 1.82 -1.09 -0.95 -1.47 121.20 126.13 2k23 s ILE 55 Ca 0.12 -1.88 -0.28 0.00 -2.23 0.00 0.00 60.65 56.38 2k23 s ILE 55 Cb -0.23 -4.02 0.03 0.00 -1.58 0.00 0.00 42.46 36.66 2k23 s ILE 55 CO 0.08 -0.85 1.22 -0.31 -1.23 0.00 0.00 174.94 173.85 2k23 s TYR 56 N 1.17 2.58 -0.29 3.97 2.02 -0.38 -1.59 117.35 124.83 2k23 s TYR 56 Ca 0.07 0.44 -0.09 0.00 -0.37 0.00 0.00 57.07 57.12 2k23 s TYR 56 Cb -0.25 -4.50 -0.01 0.00 -0.40 0.00 0.00 41.96 36.80 2k23 s TYR 56 CO -0.01 -1.62 0.13 -1.21 -1.57 0.00 0.00 175.55 171.26 2k23 s GLU 57 N 4.99 3.39 0.25 -0.62 2.02 -0.94 -1.00 118.70 126.80 2k23 s GLU 57 Ca 0.44 -0.67 -0.30 0.00 0.02 0.00 0.00 54.97 54.46 2k23 s GLU 57 Cb -0.08 -3.49 -0.09 0.00 0.10 0.00 0.00 34.13 30.57 2k23 s GLU 57 CO 0.26 -0.36 1.08 -1.17 0.02 0.00 0.00 175.26 175.08 2k23 s LEU 58 N 1.60 4.55 0.00 1.80 2.96 -1.26 0.31 118.68 128.64 2k23 s LEU 58 Ca 0.05 2.18 0.02 0.00 -0.22 0.00 0.00 54.13 56.16 2k23 s LEU 58 Cb -0.17 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 42.93 2k23 s LEU 58 CO 0.05 -0.12 0.18 0.00 -1.32 0.00 0.00 176.35 175.14 2k23 n GLN 59 N 1.52 1.12 0.26 1.98 1.13 -0.97 -4.90 117.38 117.52 2k23 n GLN 59 Ca -0.00 -1.74 0.10 0.00 -1.94 0.00 0.00 57.00 53.41 2k23 n GLN 59 Cb 0.45 0.22 0.70 0.00 0.11 0.00 0.00 30.24 31.73 2k23 n GLN 59 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 2k23 h GLU 60 N 0.00 0.00 -0.63 -1.09 4.11 -1.97 -2.98 114.58 112.02 2k23 h GLU 60 Ca -0.18 0.00 -0.41 0.00 0.07 0.00 0.00 59.36 58.85 2k23 h GLU 60 Cb 0.64 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.64 2k23 h GLU 60 CO 0.28 0.05 -0.07 -3.47 0.07 0.00 0.00 179.01 175.87 2k23 n ASP 61 N -4.20 4.28 0.00 3.06 2.03 -1.26 -4.91 116.55 115.56 2k23 n ASP 61 Ca -0.03 -3.78 0.00 0.00 0.52 0.00 0.00 54.79 51.51 2k23 n ASP 61 Cb 0.14 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 39.91 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 -0.97 -2.20 -4.65 1.67 0.23 -1.13 -4.89 115.26 103.33 2k23 n ASN 62 Ca 0.44 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 54.06 2k23 n ASN 62 Cb 0.97 -1.81 -0.02 0.00 -2.08 0.00 0.00 39.78 36.83 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 -1.02 6.86 -0.03 0.53 1.04 -1.26 -4.19 113.70 115.63 2k23 s SER 63 Ca 0.00 1.49 -0.21 0.00 0.48 0.00 0.00 55.95 57.71 2k23 s SER 63 Cb 0.00 -2.54 -0.05 0.00 0.10 0.00 0.00 66.02 63.53 2k23 s SER 63 CO 0.00 -0.87 0.59 -0.31 0.98 0.00 0.00 173.24 173.63 2k23 s TYR 64 N 3.79 3.64 -0.63 5.02 2.02 0.27 -2.30 117.35 129.16 2k23 s TYR 64 Ca 0.54 1.16 -0.20 0.00 -0.37 0.00 0.00 57.07 58.20 2k23 s TYR 64 Cb -0.19 -2.63 0.09 0.00 -0.40 0.00 0.00 41.96 38.83 2k23 s TYR 64 CO 0.17 0.28 0.83 -0.80 -1.57 0.00 0.00 175.55 174.45 2k23 s ASN 65 N 0.10 6.19 -0.18 2.29 0.02 0.15 -0.14 114.94 123.37 2k23 s ASN 65 Ca 0.31 -1.27 -0.09 0.00 -1.02 0.00 0.00 52.86 50.79 2k23 s ASN 65 Cb -0.18 -2.35 -0.05 0.00 0.02 0.00 0.00 41.25 38.69 2k23 s ASN 65 CO 0.16 -1.25 0.13 -0.69 0.02 0.00 0.00 177.10 175.47 2k23 s VAL 66 N 3.26 5.42 0.26 1.60 1.01 0.20 -2.20 120.40 129.95 2k23 s VAL 66 Ca 0.16 0.19 -0.20 0.00 0.00 0.00 0.00 61.98 62.13 2k23 s VAL 66 Cb -0.21 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.64 2k23 s VAL 66 CO 0.07 0.48 0.77 -0.89 0.00 0.00 0.00 175.10 175.54 2k23 s THR 67 N 0.03 4.51 -0.34 3.92 2.01 -0.62 0.52 115.64 125.67 2k23 s THR 67 Ca 0.10 1.36 -0.01 0.00 0.31 0.00 0.00 61.69 63.45 2k23 s THR 67 Cb -0.11 -3.85 0.13 0.00 0.01 0.00 0.00 72.50 68.67 2k23 s THR 67 CO -0.01 0.14 0.19 -0.44 -0.69 0.00 0.00 174.62 173.81 2k23 s SER 68 N -1.72 3.17 -0.13 3.53 0.01 0.93 -2.23 113.70 117.25 2k23 s SER 68 Ca 0.46 -1.98 -0.29 0.00 1.31 0.00 0.00 55.95 55.44 2k23 s SER 68 Cb -0.16 -0.43 -0.01 0.00 0.21 0.00 0.00 66.02 65.63 2k23 s SER 68 CO 0.21 -0.34 1.04 -0.51 0.41 0.00 0.00 173.24 174.05 2k23 s ILE 69 N 1.29 4.69 0.02 1.44 2.07 -1.24 -0.59 121.20 128.87 2k23 s ILE 69 Ca 0.16 1.98 -0.00 0.00 -1.41 0.00 0.00 60.65 61.37 2k23 s ILE 69 Cb -0.21 -4.27 -0.02 0.00 0.13 0.00 0.00 42.46 38.08 2k23 s ILE 69 CO -0.09 -0.05 -0.03 -1.48 -1.91 0.00 0.00 174.94 171.39 2k23 s LEU 70 N 2.39 2.23 -0.47 8.50 0.05 -0.35 -4.44 118.68 126.58 2k23 s LEU 70 Ca 0.48 -0.49 -0.29 0.00 0.05 0.00 0.00 54.13 53.88 2k23 s LEU 70 Cb -0.18 0.10 0.03 0.00 -2.05 0.00 0.00 46.19 44.09 2k23 s LEU 70 CO 0.15 -0.29 1.17 -0.69 -0.55 0.00 0.00 176.35 176.14 2k23 s VAL 71 N -1.43 4.16 -0.99 1.48 1.01 -1.26 -1.06 120.40 122.30 2k23 s VAL 71 Ca -0.16 1.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.96 2k23 s VAL 71 Cb -0.10 -4.57 0.27 0.00 0.00 0.00 0.00 36.38 31.98 2k23 s VAL 71 CO -0.01 -1.00 1.08 0.54 0.00 0.00 0.00 175.10 175.71 2k23 n ARG 72 N 7.90 3.42 0.00 2.72 1.74 -0.32 -4.89 116.66 127.23 2k23 n ARG 72 Ca 0.12 -4.51 0.00 0.00 -0.77 0.00 0.00 57.85 52.69 2k23 n ARG 72 Cb 0.49 -2.47 0.00 0.00 -1.02 0.00 0.00 32.46 29.46 2k23 n ARG 72 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k23 n GLY 73 N 2.01 0.40 0.75 -0.13 0.00 -1.26 -4.46 105.19 102.51 2k23 n GLY 73 Ca 0.24 -1.25 0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 2.49 -4.12 1.61 1.13 -1.26 -5.01 117.38 112.22 2k23 n GLN 74 Ca 0.00 -2.83 -0.13 0.00 -1.94 0.00 0.00 57.00 52.10 2k23 n GLN 74 Cb 0.00 -1.78 -0.07 0.00 0.11 0.00 0.00 30.24 28.51 2k23 n GLN 74 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2k23 s GLY 75 N -2.19 1.34 -0.16 1.08 0.00 -1.26 -5.15 107.32 100.98 2k23 s GLY 75 Ca 0.40 -1.48 -0.04 0.00 0.00 0.00 0.00 44.72 43.61 2k23 s GLY 75 CO 0.07 -1.08 -0.03 0.00 0.00 0.00 0.00 173.10 172.05 2k23 s ARG 77 N 0.35 0.66 -0.25 0.00 6.06 -0.22 -4.91 118.95 120.64 2k23 s ARG 77 Ca -0.04 -0.30 -0.29 0.00 -2.50 0.00 0.00 55.73 52.60 2k23 s ARG 77 Cb -0.14 -0.63 0.00 0.00 0.06 0.00 0.00 34.95 34.24 2k23 s ARG 77 CO 0.03 0.17 1.14 0.71 -2.50 0.00 0.00 175.30 174.85 2k23 s TYR 78 N -0.22 3.08 -0.47 5.12 2.02 -1.26 -1.21 117.35 124.41 2k23 s TYR 78 Ca 0.03 1.20 -0.15 0.00 -0.37 0.00 0.00 57.07 57.78 2k23 s TYR 78 Cb -0.03 -3.52 0.07 0.00 -0.40 0.00 0.00 41.96 38.08 2k23 s TYR 78 CO -0.00 -1.02 0.39 -0.46 -1.57 0.00 0.00 175.55 172.89 2k23 s TRP 79 N 3.55 3.25 -0.15 2.71 -0.00 0.24 -4.86 118.94 123.68 2k23 s TRP 79 Ca 0.49 -0.92 -0.10 0.00 -0.00 0.00 0.00 56.10 55.56 2k23 s TRP 79 Cb -0.16 -3.16 -0.05 0.00 -0.00 0.00 0.00 33.47 30.10 2k23 s TRP 79 CO 0.13 -0.79 0.17 0.42 -0.00 0.00 0.00 176.95 176.88 2k23 s ILE 80 N 1.64 5.41 0.46 5.86 1.09 -1.26 -0.05 121.20 134.35 2k23 s ILE 80 Ca 0.04 0.29 0.03 0.00 -1.10 0.00 0.00 60.65 59.91 2k23 s ILE 80 Cb -0.24 -3.48 -0.03 0.00 -1.06 0.00 0.00 42.46 37.65 2k23 s ILE 80 CO 0.07 0.51 0.03 -0.13 -0.10 0.00 0.00 174.94 175.32 2k23 s ARG 81 N -0.23 2.07 -0.16 2.79 0.52 0.18 -4.91 118.95 119.21 2k23 s ARG 81 Ca 0.13 -2.28 -0.00 0.00 -0.52 0.00 0.00 55.73 53.06 2k23 s ARG 81 Cb -0.12 -1.31 -0.00 0.00 0.52 0.00 0.00 34.95 34.03 2k23 s ARG 81 CO 0.02 -0.33 -0.14 0.99 0.02 0.00 0.00 175.30 175.87 2k23 s THR 82 N -2.95 2.77 -0.20 0.02 2.01 -1.26 0.60 115.64 116.63 2k23 s THR 82 Ca 0.16 -0.73 -0.02 0.00 0.31 0.00 0.00 61.69 61.41 2k23 s THR 82 Cb 0.04 -2.18 0.00 0.00 0.01 0.00 0.00 72.50 70.36 2k23 s THR 82 CO 0.09 0.50 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.06 2k23 s PHE 83 N 0.89 2.89 -0.10 4.92 0.08 0.80 0.41 117.98 127.89 2k23 s PHE 83 Ca -0.03 -1.16 0.04 0.00 0.12 0.00 0.00 56.93 55.89 2k23 s PHE 83 Cb -0.15 -2.03 0.00 0.00 -0.57 0.00 0.00 43.02 40.27 2k23 s PHE 83 CO -0.01 -0.62 -0.22 0.14 -0.10 0.00 0.00 175.22 174.41 2k23 s VAL 84 N 1.37 1.88 0.33 -0.44 -7.23 0.13 0.97 120.40 117.41 2k23 s VAL 84 Ca 0.05 -0.91 -0.29 0.00 -1.81 0.00 0.00 61.98 59.02 2k23 s VAL 84 Cb -0.14 -1.64 -0.12 0.00 0.56 0.00 0.00 36.38 35.04 2k23 s VAL 84 CO -0.06 0.52 1.49 -2.65 -0.31 0.00 0.00 175.10 174.08 2k23 n PRO 85 N 3.64 2.53 0.00 4.82 -0.02 -1.26 0.25 135.00 144.96 2k23 n PRO 85 Ca -0.20 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2k23 n PRO 85 Cb 0.53 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 2k23 n PRO 85 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2k23 n SER 86 N 1.30 0.00 0.29 2.55 2.88 0.18 -4.78 113.62 116.04 2k23 n SER 86 Ca 0.05 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.76 2k23 n SER 86 Cb 0.37 0.00 0.90 0.00 -0.75 0.00 0.00 64.21 64.73 2k23 n SER 86 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2k23 h SER 87 N 0.00 0.00 -3.79 -3.46 0.87 -1.96 -3.42 113.55 101.79 2k23 h SER 87 Ca 0.00 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.39 2k23 h SER 87 Cb 0.00 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 61.70 2k23 h SER 87 CO 0.00 0.05 -0.46 0.00 -0.53 0.00 0.00 176.83 175.88 2k23 s ARG 88 N -4.27 0.25 0.06 2.24 3.03 -1.26 -5.12 118.95 113.88 2k23 s ARG 88 Ca -0.04 0.31 -0.32 0.00 2.03 0.00 0.00 55.73 57.72 2k23 s ARG 88 Cb 0.13 0.11 -0.11 0.00 -1.03 0.00 0.00 34.95 34.06 2k23 s ARG 88 CO 0.53 -0.04 1.87 -2.30 -1.13 0.00 0.00 175.30 174.23 2k23 n PRO 89 N 3.02 2.65 0.00 3.89 -0.02 -1.26 -2.15 135.00 141.13 2k23 n PRO 89 Ca -0.13 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 2k23 n PRO 89 Cb 0.58 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 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 4.30 3.65 3.57 -1.23 0.00 -1.26 -4.68 105.19 109.54 2k23 n GLY 90 Ca 0.19 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 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 3.68 0.05 1.61 0.74 -0.92 -3.25 119.66 121.57 2k23 s GLN 91 Ca 0.00 0.16 0.05 0.00 0.05 0.00 0.00 55.36 55.62 2k23 s GLN 91 Cb 0.00 -3.82 -0.04 0.00 1.10 0.00 0.00 33.01 30.25 2k23 s GLN 91 CO 0.00 -0.84 -0.10 -0.06 -0.55 0.00 0.00 175.29 173.74 2k23 s PHE 92 N 2.97 2.78 0.45 1.67 0.08 0.26 0.48 117.98 126.66 2k23 s PHE 92 Ca 0.28 -0.12 0.03 0.00 0.12 0.00 0.00 56.93 57.24 2k23 s PHE 92 Cb -0.14 -1.52 -0.02 0.00 -0.57 0.00 0.00 43.02 40.78 2k23 s PHE 92 CO 0.17 0.37 0.08 0.95 -0.10 0.00 0.00 175.22 176.69 2k23 s THR 93 N -1.07 0.82 -0.00 0.64 -4.23 0.14 -1.28 115.64 110.66 2k23 s THR 93 Ca 0.18 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.58 2k23 s THR 93 Cb -0.11 -2.28 -0.05 0.00 1.34 0.00 0.00 72.50 71.40 2k23 s THR 93 CO 0.10 0.00 0.34 -0.76 -0.54 0.00 0.00 174.62 173.76 2k23 s LEU 94 N -3.71 4.42 0.57 4.79 2.01 -1.26 0.19 118.68 125.68 2k23 s LEU 94 Ca 0.17 0.79 0.30 0.00 0.01 0.00 0.00 54.13 55.40 2k23 s LEU 94 Cb 0.02 -2.60 1.46 0.00 0.01 0.00 0.00 46.19 45.08 2k23 s LEU 94 CO 0.10 0.30 1.87 1.23 1.01 0.00 0.00 176.35 180.86 2k23 h GLY 95 N 4.44 0.00 -5.23 -3.19 0.00 -0.34 0.61 103.07 99.36 2k23 h GLY 95 Ca -0.51 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.53 2k23 h GLY 95 CO 0.62 0.00 -1.11 0.70 0.00 0.00 0.00 176.54 176.76 2k23 n ASN 96 N -3.90 1.82 -0.17 0.19 4.13 -1.26 -4.94 115.26 111.14 2k23 n ASN 96 Ca 0.13 -2.28 0.01 0.00 1.68 0.00 0.00 54.58 54.11 2k23 n ASN 96 Cb 0.81 -0.48 0.28 0.00 -1.54 0.00 0.00 39.78 38.85 2k23 n ASN 96 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2k23 h ILE 97 N 4.87 1.18 -0.04 2.41 6.09 -1.22 -0.71 117.51 130.09 2k23 h ILE 97 Ca -0.09 -0.34 0.00 0.00 -1.37 0.00 0.00 64.86 63.06 2k23 h ILE 97 Cb 1.27 0.20 0.00 0.00 0.47 0.00 0.00 36.82 38.76 2k23 h ILE 97 CO 0.29 0.17 0.00 1.57 -3.07 0.00 0.00 178.15 177.11 2k23 n HIS 98 N -4.42 0.04 0.66 2.19 -0.00 -1.26 -1.86 115.22 110.56 2k23 n HIS 98 Ca 0.07 -0.02 0.12 0.00 0.46 0.00 0.00 57.72 58.35 2k23 n HIS 98 Cb 0.05 0.00 0.25 0.00 -0.12 0.00 0.00 29.99 30.17 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 -0.29 0.66 -4.69 0.26 7.64 -0.28 -4.79 113.62 112.13 2k23 n SER 99 Ca 0.19 0.19 -0.42 0.00 1.01 0.00 0.00 58.87 59.84 2k23 n SER 99 Cb 0.23 -0.06 -0.03 0.00 -1.01 0.00 0.00 64.21 63.34 2k23 n SER 99 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2k23 s TYR 100 N -3.12 3.55 0.03 1.43 2.02 -0.78 -4.98 117.35 115.49 2k23 s TYR 100 Ca 0.08 1.56 -0.20 0.00 -0.37 0.00 0.00 57.07 58.15 2k23 s TYR 100 Cb 0.14 -3.13 -0.17 0.00 -0.40 0.00 0.00 41.96 38.40 2k23 s TYR 100 CO 0.68 -0.15 1.24 -1.00 -1.57 0.00 0.00 175.55 174.76 2k23 h PRO 101 N 7.02 0.41 0.00 -1.71 0.13 -1.86 -3.27 132.00 132.72 2k23 h PRO 101 Ca -0.34 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2k23 h PRO 101 Cb 1.17 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2k23 h PRO 101 CO 0.82 0.92 -0.54 0.37 -0.23 0.00 0.00 178.00 179.34 2k23 h GLN 102 N -0.02 0.00 -6.30 0.86 5.75 -1.94 -3.45 115.11 110.01 2k23 h GLN 102 Ca -0.01 0.00 -0.57 0.00 -0.15 0.00 0.00 58.65 57.92 2k23 h GLN 102 Cb 0.95 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.47 2k23 h GLN 102 CO 0.07 0.00 1.15 0.42 -2.65 0.00 0.00 178.83 177.82 2k23 s ILE 103 N -3.25 3.68 0.01 2.39 1.09 -1.23 -2.79 121.20 121.09 2k23 s ILE 103 Ca 0.04 0.74 -0.23 0.00 -1.10 0.00 0.00 60.65 60.11 2k23 s ILE 103 Cb 0.09 -3.74 -0.18 0.00 -1.06 0.00 0.00 42.46 37.57 2k23 s ILE 103 CO 0.72 -0.36 1.27 1.56 -0.10 0.00 0.00 174.94 178.03 2k23 h GLN 104 N 11.13 0.23 -2.96 2.79 1.08 -0.83 -3.48 115.11 123.07 2k23 h GLN 104 Ca -0.33 -0.14 0.01 0.00 -1.45 0.00 0.00 58.65 56.75 2k23 h GLN 104 Cb 1.15 0.01 -0.10 0.00 -0.05 0.00 0.00 27.48 28.49 2k23 h GLN 104 CO 1.01 0.70 0.23 -1.12 -0.95 0.00 0.00 178.83 178.71 2k23 s SER 105 N -6.04 -0.48 -0.22 1.46 0.01 -1.25 -4.99 113.70 102.19 2k23 s SER 105 Ca -0.15 -0.16 -0.05 0.00 1.31 0.00 0.00 55.95 56.91 2k23 s SER 105 Cb 0.03 0.62 0.12 0.00 0.21 0.00 0.00 66.02 67.00 2k23 s SER 105 CO 0.73 -1.05 0.40 -0.47 0.41 0.00 0.00 173.24 173.27 2k23 s TYR 106 N -3.76 -0.84 -0.06 2.43 6.14 -1.26 -1.10 117.35 118.90 2k23 s TYR 106 Ca 0.04 1.18 -0.04 0.00 0.64 0.00 0.00 57.07 58.89 2k23 s TYR 106 Cb -0.02 0.17 0.02 0.00 0.42 0.00 0.00 41.96 42.55 2k23 s TYR 106 CO -0.08 -0.62 0.15 0.16 0.64 0.00 0.00 175.55 175.80 2k23 s ASP 107 N 2.59 -0.14 -0.02 4.32 1.47 -0.75 -4.43 116.67 119.72 2k23 s ASP 107 Ca 0.07 0.30 0.02 0.00 1.18 0.00 0.00 52.55 54.11 2k23 s ASP 107 Cb -0.14 0.25 0.01 0.00 -0.34 0.00 0.00 42.92 42.70 2k23 s ASP 107 CO -0.15 -0.09 -0.05 0.54 0.68 0.00 0.00 175.17 176.10 2k23 s VAL 108 N 0.54 0.50 0.06 2.11 0.11 -0.40 -0.51 120.40 122.80 2k23 s VAL 108 Ca -0.04 -0.19 0.08 0.00 -2.93 0.00 0.00 61.98 58.90 2k23 s VAL 108 Cb -0.05 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.29 2k23 s VAL 108 CO -0.03 0.18 -0.22 -1.10 -3.33 0.00 0.00 175.10 170.61 2k23 s GLN 109 N 0.37 1.39 -0.28 1.54 -0.21 -0.35 0.92 119.66 123.03 2k23 s GLN 109 Ca -0.04 -1.02 -0.07 0.00 0.02 0.00 0.00 55.36 54.25 2k23 s GLN 109 Cb -0.08 -1.55 -0.00 0.00 1.00 0.00 0.00 33.01 32.37 2k23 s GLN 109 CO -0.00 0.39 0.08 0.54 -2.12 0.00 0.00 175.29 174.18 2k23 s VAL 110 N -0.88 4.08 0.32 1.09 0.11 -1.20 -0.62 120.40 123.29 2k23 s VAL 110 Ca 0.08 -0.54 0.06 0.00 -2.93 0.00 0.00 61.98 58.66 2k23 s VAL 110 Cb -0.09 -3.04 0.08 0.00 -1.53 0.00 0.00 36.38 31.79 2k23 s VAL 110 CO 0.02 0.15 1.77 0.00 -3.33 0.00 0.00 175.10 173.71 2k23 h ALA 111 N 8.24 1.22 -2.44 1.54 0.00 -1.10 -2.77 119.26 123.96 2k23 h ALA 111 Ca -0.34 -0.34 -0.21 0.00 0.00 0.00 0.00 54.91 54.03 2k23 h ALA 111 Cb 1.14 -0.10 -0.32 0.00 0.00 0.00 0.00 17.79 18.52 2k23 h ALA 111 CO 0.60 0.52 -0.52 -0.51 0.00 0.00 0.00 179.25 179.34 2k23 s ASP 112 N -6.86 0.50 -0.03 0.00 1.01 -1.21 -4.46 116.67 105.62 2k23 s ASP 112 Ca -0.05 0.33 0.02 0.00 0.71 0.00 0.00 52.55 53.55 2k23 s ASP 112 Cb 0.14 0.83 0.01 0.00 1.01 0.00 0.00 42.92 44.91 2k23 s ASP 112 CO 0.76 -0.28 -0.06 0.28 0.21 0.00 0.00 175.17 176.08 2k23 s THR 113 N 2.46 0.61 0.02 -1.27 -1.32 -1.26 -0.43 115.64 114.45 2k23 s THR 113 Ca 0.06 -0.23 -0.05 0.00 -1.21 0.00 0.00 61.69 60.26 2k23 s THR 113 Cb -0.14 -0.58 -0.01 0.00 -1.51 0.00 0.00 72.50 70.26 2k23 s THR 113 CO -0.12 0.22 0.08 -0.62 -2.21 0.00 0.00 174.62 171.96 2k23 s ASP 114 N 0.48 0.16 0.05 8.08 -1.08 -1.26 -5.00 116.67 118.09 2k23 s ASP 114 Ca -0.07 -0.45 0.23 0.00 -0.52 0.00 0.00 52.55 51.74 2k23 s ASP 114 Cb -0.10 0.19 0.94 0.00 -1.46 0.00 0.00 42.92 42.49 2k23 s ASP 114 CO 0.00 -0.43 1.73 0.00 0.52 0.00 0.00 175.17 176.99 2k23 n TYR 115 N 1.10 0.20 0.00 -5.34 0.18 -1.26 -3.94 117.16 108.11 2k23 n TYR 115 Ca -0.21 0.07 0.00 0.00 1.88 0.00 0.00 57.90 59.64 2k23 n TYR 115 Cb 0.57 -0.61 0.00 0.00 -0.38 0.00 0.00 39.34 38.92 2k23 n TYR 115 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 2k23 n ASP 116 N -1.67 0.37 -3.61 9.48 -0.08 -1.26 -4.86 116.55 114.91 2k23 n ASP 116 Ca 0.05 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 53.03 2k23 n ASP 116 Cb 0.28 0.00 0.26 0.00 2.34 0.00 0.00 41.12 44.00 2k23 n ASP 116 CO 0.00 0.00 0.00 -1.58 0.12 0.00 0.00 177.20 175.74 2k23 s GLN 117 N -1.98 -1.85 0.15 -0.67 2.00 -1.25 -4.53 119.66 111.52 2k23 s GLN 117 Ca 0.00 -0.09 -0.01 0.00 -2.00 0.00 0.00 55.36 53.25 2k23 s GLN 117 Cb 0.00 -1.52 -0.05 0.00 0.80 0.00 0.00 33.01 32.24 2k23 s GLN 117 CO 0.00 -4.12 0.34 -0.59 -0.50 0.00 0.00 175.29 170.41 2k23 s PHE 118 N -2.84 3.49 -0.08 1.67 -0.71 -1.26 -4.26 117.98 113.99 2k23 s PHE 118 Ca 0.71 0.36 0.03 0.00 -1.04 0.00 0.00 56.93 56.99 2k23 s PHE 118 Cb -0.09 -1.86 -0.02 0.00 -1.21 0.00 0.00 43.02 39.84 2k23 s PHE 118 CO 0.56 0.46 -0.17 0.00 -1.34 0.00 0.00 175.22 174.73 2k23 s ALA 119 N -1.71 2.52 -0.22 1.99 0.00 0.19 -4.21 121.76 120.32 2k23 s ALA 119 Ca 0.38 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 2k23 s ALA 119 Cb -0.12 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 22.02 2k23 s ALA 119 CO 0.27 0.40 -0.09 1.41 0.00 0.00 0.00 175.76 177.76 2k23 s MET 120 N -0.16 3.08 0.08 0.00 1.75 0.42 -0.46 119.30 124.01 2k23 s MET 120 Ca -0.01 -0.81 0.07 0.00 -1.25 0.00 0.00 55.69 53.68 2k23 s MET 120 Cb -0.14 -2.90 -0.03 0.00 2.84 0.00 0.00 34.83 34.60 2k23 s MET 120 CO 0.03 -0.28 -0.17 0.08 -0.65 0.00 0.00 175.02 174.03 2k23 s VAL 121 N 1.38 1.40 -0.22 10.11 1.01 -0.42 -1.00 120.40 132.65 2k23 s VAL 121 Ca 0.03 -1.39 -0.02 0.00 0.00 0.00 0.00 61.98 60.60 2k23 s VAL 121 Cb -0.15 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.94 2k23 s VAL 121 CO -0.06 -0.12 -0.07 0.12 0.00 0.00 0.00 175.10 174.97 2k23 s PHE 122 N -1.18 2.97 -0.17 5.22 2.19 0.21 -0.99 117.98 126.22 2k23 s PHE 122 Ca 0.02 -1.27 -0.04 0.00 0.33 0.00 0.00 56.93 55.97 2k23 s PHE 122 Cb -0.10 -2.06 -0.03 0.00 -1.31 0.00 0.00 43.02 39.52 2k23 s PHE 122 CO 0.03 -0.65 -0.02 -0.06 1.83 0.00 0.00 175.22 176.35 2k23 s PHE 123 N 1.40 3.05 -0.17 10.12 0.40 0.16 -1.21 117.98 131.73 2k23 s PHE 123 Ca 0.04 -0.29 -0.00 0.00 -0.60 0.00 0.00 56.93 56.07 2k23 s PHE 123 Cb -0.15 -2.00 -0.00 0.00 0.51 0.00 0.00 43.02 41.39 2k23 s PHE 123 CO -0.05 -0.06 -0.14 -1.14 0.70 0.00 0.00 175.22 174.53 2k23 s GLN 124 N 0.49 3.21 -0.17 0.44 -0.44 0.33 -0.07 119.66 123.46 2k23 s GLN 124 Ca -0.02 -0.74 -0.00 0.00 -2.50 0.00 0.00 55.36 52.10 2k23 s GLN 124 Cb -0.14 -2.68 0.04 0.00 -1.64 0.00 0.00 33.01 28.59 2k23 s GLN 124 CO 0.02 -0.04 -0.08 0.21 0.50 0.00 0.00 175.29 175.90 2k23 s LYS 125 N 0.97 1.70 -0.14 1.67 2.20 0.61 -1.80 119.74 124.95 2k23 s LYS 125 Ca -0.02 -0.59 -0.06 0.00 -0.36 0.00 0.00 55.97 54.94 2k23 s LYS 125 Cb -0.15 -2.10 -0.04 0.00 -1.51 0.00 0.00 37.83 34.04 2k23 s LYS 125 CO -0.02 -0.40 0.06 0.99 -0.36 0.00 0.00 175.35 175.62 2k23 s THR 126 N 1.56 4.78 -0.24 3.43 2.01 -0.26 0.34 115.64 127.26 2k23 s THR 126 Ca 0.01 -0.05 -0.17 0.00 0.31 0.00 0.00 61.69 61.78 2k23 s THR 126 Cb -0.15 -3.10 0.07 0.00 0.01 0.00 0.00 72.50 69.33 2k23 s THR 126 CO -0.08 0.54 0.60 -0.44 -0.69 0.00 0.00 174.62 174.55 2k23 s SER 127 N -0.32 -0.72 -1.25 3.53 0.01 0.28 -0.12 113.70 115.12 2k23 s SER 127 Ca 0.08 1.27 -0.00 0.00 1.31 0.00 0.00 55.95 58.61 2k23 s SER 127 Cb -0.12 1.21 0.00 0.00 0.21 0.00 0.00 66.02 67.32 2k23 s SER 127 CO 0.02 -0.22 0.05 1.21 0.41 0.00 0.00 173.24 174.71 2k23 n GLU 128 N 3.55 -1.44 -0.72 12.44 4.07 -1.12 -0.70 120.64 136.73 2k23 n GLU 128 Ca -0.18 0.71 0.00 0.00 -0.06 0.00 0.00 57.16 57.63 2k23 n GLU 128 Cb 0.57 -5.03 0.00 0.00 -0.06 0.00 0.00 31.44 26.92 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 -0.87 -0.56 -4.65 4.31 3.02 -1.26 -4.95 115.26 110.30 2k23 n ASN 129 Ca -0.16 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.01 2k23 n ASN 129 Cb 0.63 -1.69 -0.09 0.00 -0.61 0.00 0.00 39.78 38.02 2k23 n ASN 129 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2k23 s LYS 130 N -0.71 4.10 -0.19 3.52 -0.14 0.12 -5.06 119.74 121.38 2k23 s LYS 130 Ca 0.00 -0.04 -0.15 0.00 -1.36 0.00 0.00 55.97 54.42 2k23 s LYS 130 Cb 0.00 -3.56 -0.04 0.00 -1.68 0.00 0.00 37.83 32.55 2k23 s LYS 130 CO 0.00 -0.04 0.37 -0.65 -0.76 0.00 0.00 175.35 174.27 2k23 s GLN 131 N 1.34 4.20 -0.13 1.68 -0.21 -1.26 -0.56 119.66 124.72 2k23 s GLN 131 Ca 0.13 0.17 0.01 0.00 0.02 0.00 0.00 55.36 55.69 2k23 s GLN 131 Cb -0.14 -3.51 0.02 0.00 1.00 0.00 0.00 33.01 30.38 2k23 s GLN 131 CO 0.07 0.04 -0.13 0.71 -2.12 0.00 0.00 175.29 173.86 2k23 s TYR 132 N 1.07 1.94 0.27 0.91 2.02 0.15 -4.39 117.35 119.33 2k23 s TYR 132 Ca 0.18 -1.02 0.07 0.00 -0.37 0.00 0.00 57.07 55.94 2k23 s TYR 132 Cb -0.14 -1.45 -0.06 0.00 -0.40 0.00 0.00 41.96 39.91 2k23 s TYR 132 CO 0.07 -0.57 -0.07 -0.59 -1.57 0.00 0.00 175.55 172.82 2k23 s PHE 133 N 1.38 1.91 -0.02 2.71 -0.71 -1.26 -0.28 117.98 121.71 2k23 s PHE 133 Ca 0.01 -0.69 -0.10 0.00 -1.04 0.00 0.00 56.93 55.11 2k23 s PHE 133 Cb -0.13 -1.07 0.01 0.00 -1.21 0.00 0.00 43.02 40.62 2k23 s PHE 133 CO -0.07 0.28 0.21 -1.59 -1.34 0.00 0.00 175.22 172.70 2k23 s LYS 134 N -3.72 0.51 -0.27 1.99 -2.85 0.90 -2.63 119.74 113.67 2k23 s LYS 134 Ca 0.29 -0.20 0.00 0.00 -1.00 0.00 0.00 55.97 55.06 2k23 s LYS 134 Cb 0.03 0.22 0.05 0.00 -2.06 0.00 0.00 37.83 36.07 2k23 s LYS 134 CO 0.11 -0.12 -0.06 0.08 0.10 0.00 0.00 175.35 175.46 2k23 s VAL 135 N -1.10 2.61 0.19 1.79 1.01 0.16 0.38 120.40 125.44 2k23 s VAL 135 Ca -0.12 -1.39 0.08 0.00 0.00 0.00 0.00 61.98 60.56 2k23 s VAL 135 Cb -0.06 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 2k23 s VAL 135 CO 0.02 0.02 -0.05 0.28 0.00 0.00 0.00 175.10 175.37 2k23 s THR 136 N 1.21 3.41 -0.22 3.92 -1.32 -0.16 0.52 115.64 122.99 2k23 s THR 136 Ca -0.05 -1.60 -0.02 0.00 -1.21 0.00 0.00 61.69 58.81 2k23 s THR 136 Cb -0.19 -2.71 0.01 0.00 -1.51 0.00 0.00 72.50 68.10 2k23 s THR 136 CO -0.04 -0.14 -0.09 -0.22 -2.21 0.00 0.00 174.62 171.92 2k23 s LEU 137 N -2.96 2.78 0.00 9.08 1.98 0.26 -1.31 118.68 128.51 2k23 s LEU 137 Ca 0.26 -0.64 0.05 0.00 -2.89 0.00 0.00 54.13 50.92 2k23 s LEU 137 Cb -0.09 -1.64 -0.03 0.00 0.66 0.00 0.00 46.19 45.09 2k23 s LEU 137 CO 0.17 -0.05 -0.13 -0.31 -1.89 0.00 0.00 176.35 174.14 2k23 s TYR 138 N 1.37 2.72 0.07 5.38 2.02 0.39 0.08 117.35 129.38 2k23 s TYR 138 Ca 0.04 -0.15 0.02 0.00 -0.37 0.00 0.00 57.07 56.61 2k23 s TYR 138 Cb -0.15 -1.56 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 2k23 s TYR 138 CO -0.06 0.28 -0.07 0.20 -1.57 0.00 0.00 175.55 174.33 2k23 s GLY 139 N -1.24 0.62 0.28 0.71 0.00 0.30 0.56 107.32 108.55 2k23 s GLY 139 Ca 0.15 -1.02 0.25 0.00 0.00 0.00 0.00 44.72 44.10 2k23 s GLY 139 CO 0.05 -1.10 1.76 -0.09 0.00 0.00 0.00 173.10 173.71 2k23 h ARG 140 N 3.81 0.00 0.00 2.90 2.43 -1.78 0.65 114.38 122.39 2k23 h ARG 140 Ca -0.35 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.60 2k23 h ARG 140 Cb 1.18 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.69 2k23 h ARG 140 CO 0.52 0.00 -0.06 -2.37 -1.51 0.00 0.00 179.97 176.55 2k23 n THR 141 N -2.39 0.00 1.27 0.20 5.66 -1.26 -4.73 114.28 113.03 2k23 n THR 141 Ca 0.03 -1.50 0.01 0.00 -3.05 0.00 0.00 64.05 59.54 2k23 n THR 141 Cb 0.32 1.00 0.05 0.00 -1.55 0.00 0.00 70.33 70.14 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 -0.53 1.35 -3.03 1.09 4.76 -1.26 -4.40 118.16 116.15 2k23 n LYS 142 Ca -0.01 -0.38 -0.31 0.00 -2.87 0.00 0.00 58.31 54.75 2k23 n LYS 142 Cb 0.54 -1.31 -0.04 0.00 -1.84 0.00 0.00 35.03 32.38 2k23 n LYS 142 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k23 n GLY 143 N 0.39 5.46 3.42 0.72 0.00 -1.26 -5.01 105.19 108.91 2k23 n GLY 143 Ca 0.03 -2.74 -0.33 0.00 0.00 0.00 0.00 46.02 42.98 2k23 n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k23 s LEU 144 N -3.29 2.84 0.72 0.99 1.43 -1.26 -5.05 118.68 115.04 2k23 s LEU 144 Ca 0.43 -0.25 -0.14 0.00 -1.03 0.00 0.00 54.13 53.14 2k23 s LEU 144 Cb 0.21 -1.64 0.03 0.00 0.03 0.00 0.00 46.19 44.83 2k23 s LEU 144 CO -0.08 0.21 1.16 -0.44 0.23 0.00 0.00 176.35 177.42 2k23 s SER 145 N 0.10 4.49 0.51 2.29 0.01 -1.26 -4.91 113.70 114.94 2k23 s SER 145 Ca -0.05 2.17 0.26 0.00 1.31 0.00 0.00 55.95 59.64 2k23 s SER 145 Cb -0.14 -2.57 1.40 0.00 0.21 0.00 0.00 66.02 64.92 2k23 s SER 145 CO 0.04 -2.05 2.06 -0.78 0.41 0.00 0.00 173.24 172.92 2k23 h ASP 146 N -0.31 0.00 -0.17 2.44 3.58 -2.00 -2.68 116.42 117.29 2k23 h ASP 146 Ca -0.47 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.01 2k23 h ASP 146 Cb 1.27 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.30 2k23 h ASP 146 CO 0.51 0.13 0.02 -0.08 -2.88 0.00 0.00 179.24 176.94 2k23 h GLU 147 N 0.00 0.08 0.00 0.28 4.81 -1.99 0.31 114.58 118.07 2k23 h GLU 147 Ca -0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 2k23 h GLU 147 Cb 0.33 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2k23 h GLU 147 CO 0.02 0.06 -0.29 1.37 -0.73 0.00 0.00 179.01 179.43 2k23 h LEU 148 N 0.09 0.00 -0.05 1.64 8.10 -1.85 0.13 115.31 123.37 2k23 h LEU 148 Ca 0.08 0.00 -0.07 0.00 0.11 0.00 0.00 57.88 57.99 2k23 h LEU 148 Cb 0.08 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.30 2k23 h LEU 148 CO -0.11 0.29 -0.25 0.11 -4.11 0.00 0.00 178.44 174.37 2k23 h LYS 149 N 0.00 0.26 -0.38 0.17 1.57 -1.39 -2.45 116.57 114.35 2k23 h LYS 149 Ca -0.00 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 2k23 h LYS 149 Cb 0.60 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 2k23 h LYS 149 CO 0.04 0.86 0.21 0.93 -0.57 0.00 0.00 179.45 180.91 2k23 h GLU 150 N -0.28 0.52 -0.82 3.15 5.08 -0.59 -0.13 114.58 121.51 2k23 h GLU 150 Ca -0.02 -0.05 0.11 0.00 -1.00 0.00 0.00 59.36 58.40 2k23 h GLU 150 Cb 0.90 -0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.97 2k23 h GLU 150 CO 0.05 0.39 0.45 -0.09 -1.00 0.00 0.00 179.01 178.81 2k23 h ARG 151 N 0.53 0.71 -0.11 2.33 2.43 -0.64 0.28 114.38 119.90 2k23 h ARG 151 Ca 0.14 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 59.05 2k23 h ARG 151 Cb 0.02 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 29.42 2k23 h ARG 151 CO -0.02 0.47 -0.77 0.27 -1.51 0.00 0.00 179.97 178.41 2k23 h PHE 152 N 0.73 0.99 -0.46 2.20 -5.15 -0.59 -2.31 116.94 112.36 2k23 h PHE 152 Ca 0.41 -0.46 -0.03 0.00 -0.20 0.00 0.00 57.97 57.69 2k23 h PHE 152 Cb 0.43 -0.14 -0.02 0.00 0.22 0.00 0.00 35.95 36.44 2k23 h PHE 152 CO -0.07 1.28 0.15 -0.39 -2.00 0.00 0.00 178.31 177.28 2k23 h VAL 153 N 0.42 1.18 -0.45 0.88 -1.51 -0.73 0.66 116.25 116.70 2k23 h VAL 153 Ca -0.06 -0.61 -0.08 0.00 -1.23 0.00 0.00 66.70 64.71 2k23 h VAL 153 Cb 1.41 0.68 -0.02 0.00 -2.13 0.00 0.00 31.29 31.23 2k23 h VAL 153 CO 0.16 0.23 -0.02 0.28 -1.23 0.00 0.00 177.57 176.99 2k23 h SER 154 N 0.65 0.80 -0.01 4.19 0.02 -0.95 -2.34 113.55 115.92 2k23 h SER 154 Ca 0.16 -0.32 -0.06 0.00 -0.84 0.00 0.00 61.79 60.72 2k23 h SER 154 Cb 0.18 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2k23 h SER 154 CO -0.01 0.93 -0.15 0.15 -1.14 0.00 0.00 176.83 176.61 2k23 h PHE 155 N 0.66 0.33 -0.65 3.45 3.57 -0.62 -1.64 116.94 122.04 2k23 h PHE 155 Ca 0.12 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.60 2k23 h PHE 155 Cb 0.53 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 2k23 h PHE 155 CO 0.04 0.46 0.41 0.00 -2.23 0.00 0.00 178.31 176.99 2k23 h ALA 156 N 1.55 0.84 0.00 2.41 0.00 0.69 -2.61 119.26 122.15 2k23 h ALA 156 Ca 0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2k23 h ALA 156 Cb 0.45 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2k23 h ALA 156 CO 0.03 0.18 -0.18 0.87 0.00 0.00 0.00 179.25 180.14 2k23 h LYS 157 N 0.81 0.00 0.00 0.00 1.57 -0.92 -1.68 116.57 116.35 2k23 h LYS 157 Ca 0.26 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.99 2k23 h LYS 157 Cb -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2k23 h LYS 157 CO -0.09 0.15 -0.21 0.66 -0.57 0.00 0.00 179.45 179.39 2k23 h SER 158 N 0.00 0.00 0.55 0.86 4.64 -1.00 -2.30 113.55 116.30 2k23 h SER 158 Ca -0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.12 2k23 h SER 158 Cb 1.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2k23 h SER 158 CO 0.02 0.21 -0.85 -0.07 -0.87 0.00 0.00 176.83 175.27 2k23 h LEU 159 N 0.00 0.27 0.00 5.97 -0.00 -1.27 -3.48 115.31 116.80 2k23 h LEU 159 Ca -0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 57.88 57.67 2k23 h LEU 159 Cb 0.90 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 2k23 h LEU 159 CO 0.03 1.00 0.00 0.61 -0.00 0.00 0.00 178.44 180.07 2k23 n GLY 160 N 0.81 0.01 3.44 0.83 0.00 -0.87 -4.65 105.19 104.77 2k23 n GLY 160 Ca -0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.65 -4.59 117.00 113.72 2k23 n LEU 161 Ca 0.00 -1.36 -0.11 0.00 -0.03 0.00 0.00 56.01 54.51 2k23 n LEU 161 Cb 0.00 -0.87 -0.08 0.00 -2.33 0.00 0.00 43.42 40.14 2k23 n LEU 161 CO 0.00 -1.30 -0.03 -1.59 -1.33 0.00 0.00 177.39 173.14 2k23 s LYS 162 N -5.51 0.76 0.56 3.23 0.00 -1.26 -3.91 119.74 113.61 2k23 s LYS 162 Ca 0.66 -0.56 0.34 0.00 0.00 0.00 0.00 55.97 56.41 2k23 s LYS 162 Cb -0.02 0.32 1.49 0.00 0.00 0.00 0.00 37.83 39.63 2k23 s LYS 162 CO 0.46 -0.23 1.79 -0.44 0.00 0.00 0.00 175.35 176.93 2k23 h ASP 163 N 3.33 0.00 -0.01 0.03 3.32 -1.92 0.53 116.42 121.69 2k23 h ASP 163 Ca -0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 2k23 h ASP 163 Cb 1.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 2k23 h ASP 163 CO 0.47 0.00 0.10 -1.13 -1.72 0.00 0.00 179.24 176.96 2k23 h ASN 164 N 0.00 0.00 -0.38 6.45 -0.73 -1.95 -1.11 115.58 117.87 2k23 h ASN 164 Ca 0.49 0.00 -0.28 0.00 1.87 0.00 0.00 56.30 58.38 2k23 h ASN 164 Cb 2.08 0.00 -0.35 0.00 0.27 0.00 0.00 38.32 40.32 2k23 h ASN 164 CO -0.01 0.00 -0.94 0.59 -0.37 0.00 0.00 177.43 176.70 2k23 n ASN 165 N -3.12 2.39 -3.79 1.15 3.02 0.18 -4.80 115.26 110.28 2k23 n ASN 165 Ca -0.02 -2.73 -0.21 0.00 -0.03 0.00 0.00 54.58 51.58 2k23 n ASN 165 Cb 0.17 -0.41 -0.17 0.00 -0.61 0.00 0.00 39.78 38.75 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 -3.20 0.33 0.39 2.41 1.01 -0.42 0.01 121.20 121.73 2k23 s ILE 166 Ca 0.36 0.10 0.07 0.00 0.00 0.00 0.00 60.65 61.18 2k23 s ILE 166 Cb 0.36 -0.46 -0.08 0.00 0.01 0.00 0.00 42.46 42.30 2k23 s ILE 166 CO -0.05 0.23 -0.00 0.68 0.00 0.00 0.00 174.94 175.80 2k23 s VAL 167 N 1.61 1.96 -0.21 2.92 -7.23 0.24 -4.83 120.40 114.86 2k23 s VAL 167 Ca -0.01 -2.03 -0.02 0.00 -1.81 0.00 0.00 61.98 58.12 2k23 s VAL 167 Cb -0.13 -2.92 0.01 0.00 0.56 0.00 0.00 36.38 33.90 2k23 s VAL 167 CO -0.03 -0.03 -0.10 -0.36 -0.31 0.00 0.00 175.10 174.26 2k23 s PHE 168 N -2.75 2.92 -0.13 2.82 0.08 -1.26 -1.21 117.98 118.45 2k23 s PHE 168 Ca 0.35 -1.32 -0.37 0.00 0.12 0.00 0.00 56.93 55.71 2k23 s PHE 168 Cb 0.09 -2.03 -0.14 0.00 -0.57 0.00 0.00 43.02 40.37 2k23 s PHE 168 CO 0.17 -0.68 1.75 0.43 -0.10 0.00 0.00 175.22 176.80 2k23 n SER 169 N 4.71 2.84 -4.71 1.36 7.64 -1.04 -4.81 113.62 119.61 2k23 n SER 169 Ca -0.19 1.04 -0.42 0.00 1.01 0.00 0.00 58.87 60.31 2k23 n SER 169 Cb 0.50 -1.27 -0.03 0.00 -1.01 0.00 0.00 64.21 62.40 2k23 n SER 169 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2k23 s VAL 170 N 3.27 3.48 -0.37 0.44 1.01 -1.25 -4.68 120.40 122.30 2k23 s VAL 170 Ca 0.93 1.06 -0.19 0.00 0.00 0.00 0.00 61.98 63.77 2k23 s VAL 170 Cb -0.87 -3.68 -0.20 0.00 0.00 0.00 0.00 36.38 31.64 2k23 s VAL 170 CO 0.56 0.08 1.66 -2.65 0.00 0.00 0.00 175.10 174.75 2k23 n PRO 171 N 3.96 0.75 -1.15 2.72 -0.02 -1.26 -1.81 135.00 138.20 2k23 n PRO 171 Ca 0.11 -1.24 -0.31 0.00 -2.02 0.00 0.00 63.50 60.04 2k23 n PRO 171 Cb 0.43 -2.54 0.11 0.00 -0.02 0.00 0.00 33.50 31.48 2k23 n PRO 171 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2k23 s THR 172 N 5.54 3.03 -1.01 3.45 -1.32 -1.26 -4.95 115.64 119.12 2k23 s THR 172 Ca 0.49 0.34 -0.15 0.00 -1.21 0.00 0.00 61.69 61.16 2k23 s THR 172 Cb 0.12 -2.73 0.18 0.00 -1.51 0.00 0.00 72.50 68.55 2k23 s THR 172 CO 0.16 -0.44 1.14 -0.62 -2.21 0.00 0.00 174.62 172.66 2k23 s ASP 173 N -3.26 6.86 -0.06 8.08 -1.08 -1.26 -4.62 116.67 121.33 2k23 s ASP 173 Ca 0.62 -2.61 0.09 0.00 -0.52 0.00 0.00 52.55 50.13 2k23 s ASP 173 Cb -0.18 -2.34 0.16 0.00 -1.46 0.00 0.00 42.92 39.09 2k23 s ASP 173 CO 0.57 -0.79 1.08 0.00 0.52 0.00 0.00 175.17 176.54 2k23 n GLN 174 N 5.35 0.56 0.00 4.34 6.02 -1.26 -4.93 117.38 127.46 2k23 n GLN 174 Ca 0.25 -1.77 0.00 0.00 -0.01 0.00 0.00 57.00 55.48 2k23 n GLN 174 Cb 0.46 -0.90 0.00 0.00 1.02 0.00 0.00 30.24 30.82 2k23 n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k23 n ILE 176 N 0.00 0.00 -1.02 0.00 3.06 -1.26 -5.04 119.36 115.10 2k23 n ILE 176 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2k23 n ILE 176 Cb 0.00 -0.26 0.00 0.00 0.54 0.00 0.00 39.64 39.92 2k23 n ILE 176 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 2k23 n ASP 177 N -4.22 -5.20 0.00 9.51 9.92 -1.26 -5.09 116.55 120.21 2k23 n ASP 177 Ca 0.01 0.61 0.00 0.00 -0.53 0.00 0.00 54.79 54.87 2k23 n ASP 177 Cb 0.36 -2.28 0.00 0.00 -0.64 0.00 0.00 41.12 38.55 2k23 n ASP 177 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13