#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q23 s LYS 3 N 0.00 1.27 -0.31 3.49 1.02 -1.26 -5.12 119.74 118.83 1q23 s LYS 3 Ca 0.00 -1.27 -0.11 0.00 0.02 0.00 0.00 55.97 54.62 1q23 s LYS 3 Cb 0.00 -1.65 -0.02 0.00 -0.52 0.00 0.00 37.83 35.64 1q23 s LYS 3 CO 0.00 0.39 0.17 0.21 -0.92 0.00 0.00 175.35 175.20 1q23 s LYS 4 N -2.01 3.49 -0.25 1.68 2.47 -1.26 -5.08 119.74 118.79 1q23 s LYS 4 Ca 0.11 -0.62 -0.11 0.00 -1.56 0.00 0.00 55.97 53.79 1q23 s LYS 4 Cb -0.10 -3.62 -0.05 0.00 -1.46 0.00 0.00 37.83 32.60 1q23 s LYS 4 CO 0.05 -0.37 0.18 0.42 0.16 0.00 0.00 175.35 175.79 1q23 s ILE 5 N 1.66 5.34 0.40 5.43 1.09 -1.26 -5.08 121.20 128.78 1q23 s ILE 5 Ca 0.05 0.20 -0.07 0.00 -1.10 0.00 0.00 60.65 59.74 1q23 s ILE 5 Cb -0.17 -3.52 -0.05 0.00 -1.06 0.00 0.00 42.46 37.66 1q23 s ILE 5 CO 0.08 0.32 0.71 0.42 -0.10 0.00 0.00 174.94 176.37 1q23 s THR 6 N 1.25 4.89 0.65 2.92 -4.23 -1.26 -5.06 115.64 114.80 1q23 s THR 6 Ca 0.08 0.32 -0.09 0.00 -1.18 0.00 0.00 61.69 60.82 1q23 s THR 6 Cb -0.14 -3.78 0.01 0.00 1.34 0.00 0.00 72.50 69.93 1q23 s THR 6 CO 0.06 -0.57 1.00 -0.83 -0.54 0.00 0.00 174.62 173.74 1q23 s GLY 7 N -3.47 1.62 0.12 3.99 0.00 -1.26 -4.92 107.32 103.39 1q23 s GLY 7 Ca 0.48 -0.50 -0.09 0.00 0.00 0.00 0.00 44.72 44.61 1q23 s GLY 7 CO 0.35 -0.18 0.24 -2.52 0.00 0.00 0.00 173.10 170.99 1q23 s TYR 8 N -3.18 0.21 -0.07 1.90 -0.85 -1.26 -0.27 117.35 113.83 1q23 s TYR 8 Ca 0.56 -0.61 0.05 0.00 -0.52 0.00 0.00 57.07 56.55 1q23 s TYR 8 Cb -0.11 -0.04 -0.00 0.00 0.38 0.00 0.00 41.96 42.19 1q23 s TYR 8 CO 0.49 -0.61 -0.23 -0.08 -1.52 0.00 0.00 175.55 173.60 1q23 s THR 9 N -3.89 1.89 0.23 -3.49 -1.32 -0.21 -4.93 115.64 103.92 1q23 s THR 9 Ca 0.09 -0.95 -0.30 0.00 -1.21 0.00 0.00 61.69 59.31 1q23 s THR 9 Cb 0.04 -1.62 -0.10 0.00 -1.51 0.00 0.00 72.50 69.32 1q23 s THR 9 CO -0.07 0.53 1.39 -0.89 -2.21 0.00 0.00 174.62 173.36 1q23 s THR 10 N 0.08 2.86 -0.15 5.08 2.01 -1.26 0.13 115.64 124.39 1q23 s THR 10 Ca -0.09 0.72 -0.21 0.00 0.31 0.00 0.00 61.69 62.42 1q23 s THR 10 Cb -0.15 -3.46 -0.03 0.00 0.01 0.00 0.00 72.50 68.87 1q23 s THR 10 CO 0.05 0.11 0.60 -0.69 -0.69 0.00 0.00 174.62 174.00 1q23 s VAL 11 N 0.02 5.07 -0.80 3.82 1.01 -0.15 -4.89 120.40 124.49 1q23 s VAL 11 Ca 0.58 1.17 -0.26 0.00 0.00 0.00 0.00 61.98 63.48 1q23 s VAL 11 Cb -0.40 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 32.08 1q23 s VAL 11 CO 0.41 0.20 1.38 -0.62 0.00 0.00 0.00 175.10 176.48 1q23 s ASP 12 N 0.96 6.15 0.45 3.32 3.68 -1.26 -4.82 116.67 125.15 1q23 s ASP 12 Ca 0.30 -0.64 0.13 0.00 2.13 0.00 0.00 52.55 54.46 1q23 s ASP 12 Cb -0.16 -2.56 1.03 0.00 -1.45 0.00 0.00 42.92 39.78 1q23 s ASP 12 CO 0.12 -1.82 2.04 0.40 0.13 0.00 0.00 175.17 176.04 1q23 h ILE 13 N 6.31 1.09 0.00 4.11 2.04 -1.95 -2.14 117.51 126.98 1q23 h ILE 13 Ca -0.15 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 1q23 h ILE 13 Cb 1.05 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1q23 h ILE 13 CO 1.31 0.12 -0.02 0.77 0.00 0.00 0.00 178.15 180.33 1q23 h SER 14 N 0.14 0.00 -0.10 1.72 4.64 -2.01 -2.83 113.55 115.10 1q23 h SER 14 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1q23 h SER 14 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1q23 h SER 14 CO 0.01 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 1q23 n GLN 15 N -3.23 1.18 -2.83 4.77 1.13 -0.81 -4.95 117.38 112.62 1q23 n GLN 15 Ca -0.02 -1.42 -0.42 0.00 -1.94 0.00 0.00 57.00 53.20 1q23 n GLN 15 Cb 0.15 -1.24 -0.04 0.00 0.11 0.00 0.00 30.24 29.22 1q23 n GLN 15 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 1q23 s TRP 16 N -1.00 3.38 0.58 1.08 -0.00 -1.07 -4.95 118.94 116.96 1q23 s TRP 16 Ca 0.17 1.28 0.28 0.00 -0.00 0.00 0.00 56.10 57.82 1q23 s TRP 16 Cb 0.11 -3.09 1.65 0.00 -0.00 0.00 0.00 33.47 32.14 1q23 s TRP 16 CO 0.15 -0.34 2.13 0.45 -0.00 0.00 0.00 176.95 179.35 1q23 h HIS 17 N 7.45 0.00 -0.35 5.86 3.86 -1.93 -2.78 115.15 127.27 1q23 h HIS 17 Ca -0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1q23 h HIS 17 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 1q23 h HIS 17 CO 0.73 0.00 0.00 0.54 0.86 0.00 0.00 177.93 180.06 1q23 n ARG 18 N -3.89 1.82 -0.18 2.45 1.74 -1.26 -4.61 116.66 112.72 1q23 n ARG 18 Ca 0.01 -1.25 -0.02 0.00 -0.77 0.00 0.00 57.85 55.81 1q23 n ARG 18 Cb 0.27 -1.28 0.08 0.00 -1.02 0.00 0.00 32.46 30.51 1q23 n ARG 18 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1q23 h LYS 19 N 2.02 0.44 -0.09 5.56 2.10 -1.73 0.35 116.57 125.22 1q23 h LYS 19 Ca 0.00 -0.03 0.02 0.00 -2.00 0.00 0.00 60.65 58.65 1q23 h LYS 19 Cb 0.47 -0.10 -0.03 0.00 -0.90 0.00 0.00 32.23 31.68 1q23 h LYS 19 CO 0.00 0.29 -0.07 1.49 -2.00 0.00 0.00 179.45 179.17 1q23 h GLU 20 N 0.45 -0.07 0.22 0.07 4.81 -1.87 -1.30 114.58 116.88 1q23 h GLU 20 Ca 0.26 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1q23 h GLU 20 Cb 0.24 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1q23 h GLU 20 CO -0.22 -0.05 -0.18 0.45 -0.73 0.00 0.00 179.01 178.28 1q23 h HIS 21 N -0.07 -0.47 -0.86 0.92 3.86 -1.76 -1.75 115.15 115.02 1q23 h HIS 21 Ca 0.06 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.39 1q23 h HIS 21 Cb 0.16 0.18 -0.06 0.00 1.06 0.00 0.00 27.41 28.74 1q23 h HIS 21 CO -0.18 -0.27 0.56 0.35 0.86 0.00 0.00 177.93 179.25 1q23 h PHE 22 N -0.41 0.82 0.00 2.45 3.04 -0.23 -0.24 116.94 122.37 1q23 h PHE 22 Ca -0.01 0.02 -0.14 0.00 3.98 0.00 0.00 57.97 61.83 1q23 h PHE 22 Cb 0.37 -0.26 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 1q23 h PHE 22 CO -0.13 0.34 -0.65 0.93 -2.02 0.00 0.00 178.31 176.79 1q23 h GLU 23 N 0.73 0.00 -0.22 1.11 5.08 -0.82 -1.14 114.58 119.32 1q23 h GLU 23 Ca 0.42 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.63 1q23 h GLU 23 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1q23 h GLU 23 CO -0.18 0.65 -0.48 0.00 -1.00 0.00 0.00 179.01 177.99 1q23 h ALA 24 N 1.35 0.74 -0.00 3.43 0.00 -0.53 -3.12 119.26 121.12 1q23 h ALA 24 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1q23 h ALA 24 Cb 1.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1q23 h ALA 24 CO 0.08 0.67 -0.31 1.19 0.00 0.00 0.00 179.25 180.89 1q23 n PHE 25 N -3.99 0.00 1.15 0.00 0.99 -0.18 -0.13 117.46 115.30 1q23 n PHE 25 Ca -0.03 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.55 1q23 n PHE 25 Cb 0.57 -0.18 0.22 0.00 -1.00 0.00 0.00 39.48 39.09 1q23 n PHE 25 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1q23 n GLN 26 N -0.96 1.38 0.00 -1.08 1.13 -0.45 -4.00 117.38 113.39 1q23 n GLN 26 Ca 0.10 -1.01 0.00 0.00 -1.94 0.00 0.00 57.00 54.15 1q23 n GLN 26 Cb 0.34 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.21 1q23 n GLN 26 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1q23 n SER 27 N 0.07 0.00 0.14 1.08 3.41 -0.82 -4.88 113.62 112.62 1q23 n SER 27 Ca 0.13 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.73 1q23 n SER 27 Cb 0.44 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.63 1q23 n SER 27 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1q23 h VAL 28 N 0.00 1.35 -0.60 -3.33 -1.51 -1.72 -1.18 116.25 109.26 1q23 h VAL 28 Ca 0.00 -1.69 -0.09 0.00 -1.23 0.00 0.00 66.70 63.70 1q23 h VAL 28 Cb 0.00 1.88 -0.05 0.00 -2.13 0.00 0.00 31.29 30.98 1q23 h VAL 28 CO 0.00 0.49 0.10 0.00 -1.23 0.00 0.00 177.57 176.93 1q23 n ALA 29 N -2.45 4.08 -1.76 5.19 0.00 0.81 -5.03 120.51 121.35 1q23 n ALA 29 Ca -0.02 -2.16 -0.42 0.00 0.00 0.00 0.00 53.44 50.84 1q23 n ALA 29 Cb 0.51 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 1q23 n ALA 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1q23 s GLN 30 N -2.88 4.14 0.26 0.00 0.74 -0.45 -4.58 119.66 116.89 1q23 s GLN 30 Ca 0.54 2.56 -0.15 0.00 0.05 0.00 0.00 55.36 58.36 1q23 s GLN 30 Cb 0.42 -3.20 0.00 0.00 1.10 0.00 0.00 33.01 31.34 1q23 s GLN 30 CO 0.14 -0.75 0.56 0.00 -0.55 0.00 0.00 175.29 174.69 1q23 s THR 32 N -3.94 1.76 -0.04 0.00 -1.32 -1.26 -1.26 115.64 109.58 1q23 s THR 32 Ca 0.19 -2.20 -0.17 0.00 -1.21 0.00 0.00 61.69 58.31 1q23 s THR 32 Cb -0.02 -2.03 0.03 0.00 -1.51 0.00 0.00 72.50 68.96 1q23 s THR 32 CO 0.09 -0.57 0.37 -0.72 -2.21 0.00 0.00 174.62 171.57 1q23 s TYR 33 N -2.90 -0.27 0.11 9.09 -0.85 -0.66 -4.93 117.35 116.94 1q23 s TYR 33 Ca 0.22 0.48 0.09 0.00 -0.52 0.00 0.00 57.07 57.34 1q23 s TYR 33 Cb -0.01 0.14 -0.04 0.00 0.38 0.00 0.00 41.96 42.43 1q23 s TYR 33 CO 0.07 -0.39 -0.18 -0.80 -1.52 0.00 0.00 175.55 172.72 1q23 s ASN 34 N -1.11 3.85 0.00 -0.18 -0.87 -1.26 -1.84 114.94 113.54 1q23 s ASN 34 Ca -0.11 -0.55 -0.12 0.00 -1.57 0.00 0.00 52.86 50.50 1q23 s ASN 34 Cb -0.04 -0.54 0.01 0.00 -0.02 0.00 0.00 41.25 40.67 1q23 s ASN 34 CO 0.04 0.19 0.25 0.00 -2.57 0.00 0.00 177.10 175.01 1q23 s GLN 35 N -2.07 0.64 0.01 -0.60 -2.07 -0.78 -5.00 119.66 109.79 1q23 s GLN 35 Ca 0.17 -0.33 0.07 0.00 -1.82 0.00 0.00 55.36 53.46 1q23 s GLN 35 Cb -0.11 0.28 -0.02 0.00 -1.09 0.00 0.00 33.01 32.07 1q23 s GLN 35 CO 0.09 -0.17 -0.22 0.99 -1.32 0.00 0.00 175.29 174.66 1q23 s THR 36 N -1.61 1.78 0.13 3.63 2.01 -1.26 -1.47 115.64 118.86 1q23 s THR 36 Ca -0.12 -1.09 0.08 0.00 0.31 0.00 0.00 61.69 60.87 1q23 s THR 36 Cb -0.05 -1.51 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 1q23 s THR 36 CO 0.02 0.38 -0.19 0.54 -0.69 0.00 0.00 174.62 174.68 1q23 s VAL 37 N -0.65 1.74 -0.89 3.82 0.11 0.69 -4.95 120.40 120.27 1q23 s VAL 37 Ca 0.09 -1.73 -0.18 0.00 -2.93 0.00 0.00 61.98 57.23 1q23 s VAL 37 Cb -0.09 -1.69 0.15 0.00 -1.53 0.00 0.00 36.38 33.22 1q23 s VAL 37 CO 0.00 -0.21 1.04 -1.10 -3.33 0.00 0.00 175.10 171.51 1q23 s GLN 38 N -2.38 3.57 0.23 1.54 -1.52 -1.26 -0.30 119.66 119.54 1q23 s GLN 38 Ca 0.11 -1.86 -0.30 0.00 -1.95 0.00 0.00 55.36 51.36 1q23 s GLN 38 Cb -0.08 -4.78 -0.10 0.00 -0.22 0.00 0.00 33.01 27.84 1q23 s GLN 38 CO 0.05 -1.67 1.39 -1.17 -0.25 0.00 0.00 175.29 173.64 1q23 s LEU 39 N 2.22 4.40 -0.60 2.90 0.20 0.13 -4.71 118.68 123.22 1q23 s LEU 39 Ca 0.29 2.57 -0.23 0.00 0.69 0.00 0.00 54.13 57.45 1q23 s LEU 39 Cb -0.07 -3.62 0.05 0.00 -0.43 0.00 0.00 46.19 42.13 1q23 s LEU 39 CO -0.08 -0.63 0.93 -0.62 -0.29 0.00 0.00 176.35 175.65 1q23 s ASP 40 N 0.32 6.25 -0.17 3.68 3.68 -1.26 -0.39 116.67 128.78 1q23 s ASP 40 Ca 0.58 -0.67 0.16 0.00 2.13 0.00 0.00 52.55 54.75 1q23 s ASP 40 Cb -0.40 -2.42 0.75 0.00 -1.45 0.00 0.00 42.92 39.40 1q23 s ASP 40 CO 0.42 -1.30 1.67 2.30 0.13 0.00 0.00 175.17 178.38 1q23 n ILE 41 N 6.03 2.29 0.17 4.11 -5.35 0.12 -4.75 119.36 122.00 1q23 n ILE 41 Ca -0.01 -1.35 -0.17 0.00 -0.27 0.00 0.00 62.75 60.95 1q23 n ILE 41 Cb 0.46 -0.08 -0.10 0.00 -1.74 0.00 0.00 39.64 38.18 1q23 n ILE 41 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1q23 h THR 42 N 3.85 0.00 0.47 7.28 2.02 -1.82 0.39 112.91 125.09 1q23 h THR 42 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1q23 h THR 42 Cb 1.69 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 1q23 h THR 42 CO 0.35 0.00 -0.22 0.00 0.37 0.00 0.00 175.52 176.02 1q23 h ALA 43 N -0.66 -0.62 -0.71 6.16 0.00 -1.87 -2.86 119.26 118.69 1q23 h ALA 43 Ca -0.03 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.84 1q23 h ALA 43 Cb 0.80 0.24 -0.13 0.00 0.00 0.00 0.00 17.79 18.70 1q23 h ALA 43 CO -0.22 -0.74 -0.21 0.35 0.00 0.00 0.00 179.25 178.43 1q23 h PHE 44 N -0.84 -0.50 -0.91 0.00 3.57 -1.48 -1.04 116.94 115.74 1q23 h PHE 44 Ca -0.06 0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.55 1q23 h PHE 44 Cb 0.57 0.33 -0.05 0.00 2.79 0.00 0.00 35.95 39.58 1q23 h PHE 44 CO -0.00 -0.33 0.60 1.25 -2.23 0.00 0.00 178.31 177.60 1q23 h LEU 45 N -0.03 0.97 -0.08 0.59 6.46 -0.14 -0.40 115.31 122.69 1q23 h LEU 45 Ca 0.33 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 58.07 1q23 h LEU 45 Cb 0.54 -0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1q23 h LEU 45 CO -0.75 0.66 0.01 0.11 -0.62 0.00 0.00 178.44 177.86 1q23 h LYS 46 N 1.12 0.13 -0.15 1.25 1.57 -1.01 0.41 116.57 119.89 1q23 h LYS 46 Ca 0.37 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 59.17 1q23 h LYS 46 Cb 0.06 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.29 1q23 h LYS 46 CO -0.12 0.34 -0.27 1.15 -0.57 0.00 0.00 179.45 179.98 1q23 h THR 47 N -0.11 0.36 -0.12 -0.16 2.02 -0.90 -0.57 112.91 113.44 1q23 h THR 47 Ca 0.02 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.24 1q23 h THR 47 Cb 0.28 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1q23 h THR 47 CO 0.00 0.00 -0.08 0.58 0.37 0.00 0.00 175.52 176.39 1q23 h VAL 48 N -0.33 0.75 -0.49 3.16 2.07 -0.69 -2.65 116.25 118.07 1q23 h VAL 48 Ca 0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.64 1q23 h VAL 48 Cb 0.49 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1q23 h VAL 48 CO -0.34 0.00 0.30 0.11 0.02 0.00 0.00 177.57 177.66 1q23 h LYS 49 N -0.09 0.60 -0.24 1.57 1.57 0.20 -2.79 116.57 117.38 1q23 h LYS 49 Ca 0.08 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.85 1q23 h LYS 49 Cb 0.20 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1q23 h LYS 49 CO -0.18 0.39 0.08 1.57 -0.57 0.00 0.00 179.45 180.74 1q23 h LYS 50 N 0.61 0.18 -0.42 3.15 2.10 -0.97 -3.05 116.57 118.17 1q23 h LYS 50 Ca 0.19 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.83 1q23 h LYS 50 Cb -0.03 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.26 1q23 h LYS 50 CO -0.07 0.12 0.00 0.09 -2.00 0.00 0.00 179.45 177.59 1q23 n ASN 51 N -5.05 1.04 -3.64 7.07 5.03 -1.01 -4.92 115.26 113.78 1q23 n ASN 51 Ca -0.02 -2.05 -0.20 0.00 0.87 0.00 0.00 54.58 53.18 1q23 n ASN 51 Cb 0.09 -0.25 -0.04 0.00 -1.02 0.00 0.00 39.78 38.56 1q23 n ASN 51 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1q23 n LYS 52 N -0.07 -0.88 -3.37 3.52 4.01 -1.15 -4.99 118.16 115.23 1q23 n LYS 52 Ca 0.04 0.00 -0.31 0.00 -0.51 0.00 0.00 58.31 57.53 1q23 n LYS 52 Cb 0.21 -1.86 -0.05 0.00 -0.51 0.00 0.00 35.03 32.82 1q23 n LYS 52 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 1q23 s HIS 53 N -3.88 3.43 0.31 2.13 3.76 -1.06 -5.07 115.29 114.91 1q23 s HIS 53 Ca 0.06 0.85 -0.30 0.00 -0.15 0.00 0.00 55.06 55.53 1q23 s HIS 53 Cb -0.03 -2.25 -0.11 0.00 1.11 0.00 0.00 32.58 31.29 1q23 s HIS 53 CO 0.58 0.23 1.58 0.15 -0.85 0.00 0.00 174.74 176.43 1q23 s LYS 54 N -3.00 4.11 0.01 1.40 -0.14 -1.26 -4.73 119.74 116.13 1q23 s LYS 54 Ca 0.47 2.60 -0.25 0.00 -1.36 0.00 0.00 55.97 57.43 1q23 s LYS 54 Cb -0.11 -3.01 -0.18 0.00 -1.68 0.00 0.00 37.83 32.85 1q23 s LYS 54 CO 0.23 -0.63 1.39 0.35 -0.76 0.00 0.00 175.35 175.94 1q23 h PHE 55 N 4.47 -0.07 -0.00 3.18 3.57 -1.98 -3.26 116.94 122.85 1q23 h PHE 55 Ca -0.48 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.03 1q23 h PHE 55 Cb 1.22 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.96 1q23 h PHE 55 CO 0.57 0.25 -0.26 -0.92 -2.23 0.00 0.00 178.31 175.73 1q23 h TYR 56 N -0.40 -0.75 -0.85 0.41 3.20 -1.99 0.68 116.97 117.27 1q23 h TYR 56 Ca -0.01 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.02 1q23 h TYR 56 Cb 0.36 0.33 -0.06 0.00 1.54 0.00 0.00 36.73 38.89 1q23 h TYR 56 CO 0.03 -0.27 0.55 -1.00 -1.64 0.00 0.00 178.16 175.83 1q23 h PRO 57 N -0.32 0.61 -0.12 1.82 0.13 -1.99 0.94 132.00 133.07 1q23 h PRO 57 Ca 0.01 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1q23 h PRO 57 Cb 0.34 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.33 1q23 h PRO 57 CO -0.17 0.40 0.03 0.00 -0.23 0.00 0.00 178.00 178.03 1q23 h ALA 58 N 1.61 0.16 -0.58 -0.56 0.00 -1.43 0.59 119.26 119.05 1q23 h ALA 58 Ca 0.42 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1q23 h ALA 58 Cb 0.72 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1q23 h ALA 58 CO -0.18 -0.21 0.30 0.35 0.00 0.00 0.00 179.25 179.51 1q23 h PHE 59 N -0.01 0.81 -0.81 0.00 3.57 0.08 -1.96 116.94 118.63 1q23 h PHE 59 Ca 0.04 -0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.60 1q23 h PHE 59 Cb 0.25 -0.26 -0.07 0.00 2.79 0.00 0.00 35.95 38.66 1q23 h PHE 59 CO 0.01 0.60 0.46 0.82 -2.23 0.00 0.00 178.31 177.97 1q23 h ILE 60 N 0.78 0.93 -0.52 1.41 2.04 -0.74 0.16 117.51 121.58 1q23 h ILE 60 Ca 0.20 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1q23 h ILE 60 Cb 0.08 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 1q23 h ILE 60 CO -0.03 0.15 0.20 -0.74 0.00 0.00 0.00 178.15 177.73 1q23 h HIS 61 N 0.79 0.80 -0.02 1.37 2.76 -0.63 0.11 115.15 120.34 1q23 h HIS 61 Ca 0.38 -0.06 0.03 0.00 -2.20 0.00 0.00 60.37 58.52 1q23 h HIS 61 Cb 0.32 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.01 1q23 h HIS 61 CO -0.06 0.66 -0.15 0.82 -1.30 0.00 0.00 177.93 177.90 1q23 h ILE 62 N 0.70 0.62 -0.58 6.26 2.04 -0.42 -0.37 117.51 125.77 1q23 h ILE 62 Ca 0.17 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.15 1q23 h ILE 62 Cb 0.21 0.62 -0.09 0.00 -0.74 0.00 0.00 36.82 36.82 1q23 h ILE 62 CO -0.01 0.00 0.07 -0.07 0.00 0.00 0.00 178.15 178.14 1q23 h LEU 63 N -0.24 -0.11 -1.41 1.44 3.38 -0.76 -0.11 115.31 117.50 1q23 h LEU 63 Ca 0.06 0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.18 1q23 h LEU 63 Cb 0.32 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1q23 h LEU 63 CO -0.16 -0.04 0.42 0.00 0.09 0.00 0.00 178.44 178.75 1q23 h ALA 64 N 1.49 1.62 -0.10 1.53 0.00 -0.17 -0.69 119.26 122.94 1q23 h ALA 64 Ca 0.30 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 1q23 h ALA 64 Cb 0.47 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1q23 h ALA 64 CO -0.43 0.32 -0.56 0.00 0.00 0.00 0.00 179.25 178.57 1q23 h ARG 65 N 0.78 0.30 0.14 0.00 3.08 0.66 -1.45 114.38 117.90 1q23 h ARG 65 Ca 0.25 -0.19 -0.31 0.00 0.07 0.00 0.00 59.98 59.80 1q23 h ARG 65 Cb 0.03 0.02 0.03 0.00 0.08 0.00 0.00 29.97 30.13 1q23 h ARG 65 CO -0.06 0.78 -1.29 -0.07 -1.07 0.00 0.00 179.97 178.26 1q23 h LEU 66 N 0.23 0.88 -1.82 3.04 3.38 -0.24 -1.61 115.31 119.17 1q23 h LEU 66 Ca 0.00 -0.83 -0.01 0.00 0.09 0.00 0.00 57.88 57.13 1q23 h LEU 66 Cb 1.06 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1q23 h LEU 66 CO 0.09 1.63 0.05 0.24 0.09 0.00 0.00 178.44 180.54 1q23 h MET 67 N 0.26 0.16 -0.31 1.13 2.86 -1.04 -1.44 114.93 116.55 1q23 h MET 67 Ca -0.20 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1q23 h MET 67 Cb 1.96 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.59 1q23 h MET 67 CO 0.25 0.14 0.00 0.09 1.06 0.00 0.00 176.91 178.44 1q23 n ASN 68 N -4.49 2.24 -0.40 1.22 3.02 -0.56 -3.44 115.26 112.85 1q23 n ASN 68 Ca -0.01 -1.87 0.11 0.00 -0.03 0.00 0.00 54.58 52.78 1q23 n ASN 68 Cb 0.11 -0.20 -0.02 0.00 -0.61 0.00 0.00 39.78 39.05 1q23 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q23 n ALA 69 N 0.70 3.78 -3.66 5.41 0.00 -0.55 -4.97 120.51 121.22 1q23 n ALA 69 Ca 0.16 -0.63 -0.08 0.00 0.00 0.00 0.00 53.44 52.88 1q23 n ALA 69 Cb 0.39 -0.79 -0.09 0.00 0.00 0.00 0.00 19.45 18.96 1q23 n ALA 69 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1q23 s HIS 70 N -2.58 -0.80 0.13 0.00 3.76 -1.21 -5.05 115.29 109.54 1q23 s HIS 70 Ca 0.17 1.55 0.29 0.00 -0.15 0.00 0.00 55.06 56.91 1q23 s HIS 70 Cb 0.18 0.33 1.15 0.00 1.11 0.00 0.00 32.58 35.35 1q23 s HIS 70 CO 0.63 -0.47 1.91 -1.35 -0.85 0.00 0.00 174.74 174.60 1q23 h PRO 71 N 7.99 0.00 0.00 8.40 0.11 -1.93 -2.78 132.00 143.79 1q23 h PRO 71 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1q23 h PRO 71 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1q23 h PRO 71 CO 0.14 0.12 0.00 -0.85 -0.21 0.00 0.00 178.00 177.20 1q23 n GLU 72 N -3.27 0.13 -0.11 1.05 0.00 -1.26 -1.85 120.64 115.34 1q23 n GLU 72 Ca 0.00 0.60 0.12 0.00 0.00 0.00 0.00 57.16 57.88 1q23 n GLU 72 Cb 0.36 -1.91 0.22 0.00 0.00 0.00 0.00 31.44 30.11 1q23 n GLU 72 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1q23 n PHE 73 N -2.19 0.28 -2.02 -1.84 0.99 -1.05 -4.37 117.46 107.26 1q23 n PHE 73 Ca -0.01 -0.14 0.04 0.00 -0.00 0.00 0.00 57.45 57.34 1q23 n PHE 73 Cb 0.05 0.00 0.08 0.00 -1.00 0.00 0.00 39.48 38.61 1q23 n PHE 73 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1q23 n ARG 74 N 1.21 0.53 -4.01 -1.08 1.74 -0.77 -4.50 116.66 109.79 1q23 n ARG 74 Ca 0.17 -2.18 -0.23 0.00 -0.77 0.00 0.00 57.85 54.84 1q23 n ARG 74 Cb 0.55 -0.67 -0.03 0.00 -1.02 0.00 0.00 32.46 31.29 1q23 n ARG 74 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1q23 s MET 75 N -1.11 3.26 0.07 5.56 -1.94 -1.24 -0.03 119.30 123.86 1q23 s MET 75 Ca 0.28 -0.79 -0.26 0.00 -1.71 0.00 0.00 55.69 53.21 1q23 s MET 75 Cb 0.29 -2.81 0.07 0.00 2.01 0.00 0.00 34.83 34.39 1q23 s MET 75 CO -0.09 0.46 0.61 0.00 -0.01 0.00 0.00 175.02 175.99 1q23 s ALA 76 N -1.92 -1.61 -0.43 3.03 0.00 -0.92 -4.53 121.76 115.38 1q23 s ALA 76 Ca 0.33 0.79 -0.22 0.00 0.00 0.00 0.00 51.96 52.87 1q23 s ALA 76 Cb -0.09 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.55 1q23 s ALA 76 CO 0.27 -0.59 0.71 1.41 0.00 0.00 0.00 175.76 177.56 1q23 s MET 77 N -2.67 3.42 -0.16 0.00 1.75 -1.26 -1.63 119.30 118.75 1q23 s MET 77 Ca -0.04 -0.15 -0.01 0.00 -1.25 0.00 0.00 55.69 54.24 1q23 s MET 77 Cb -0.01 -3.92 -0.01 0.00 2.84 0.00 0.00 34.83 33.74 1q23 s MET 77 CO -0.03 -1.01 -0.12 0.21 -0.65 0.00 0.00 175.02 173.41 1q23 s LYS 78 N 3.03 3.29 -0.61 4.11 2.20 0.94 -4.67 119.74 128.03 1q23 s LYS 78 Ca 0.27 -0.71 -0.18 0.00 -0.36 0.00 0.00 55.97 54.99 1q23 s LYS 78 Cb -0.13 -2.71 0.02 0.00 -1.51 0.00 0.00 37.83 33.51 1q23 s LYS 78 CO 0.20 0.02 0.33 -0.25 -0.36 0.00 0.00 175.35 175.29 1q23 n ASP 79 N 4.07 -1.99 -0.04 1.43 9.92 -1.26 -1.58 116.55 127.11 1q23 n ASP 79 Ca -0.19 -0.65 -0.01 0.00 -0.53 0.00 0.00 54.79 53.42 1q23 n ASP 79 Cb 0.52 -0.78 -0.00 0.00 -0.64 0.00 0.00 41.12 40.21 1q23 n ASP 79 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1q23 n GLY 80 N -1.52 0.48 3.08 0.44 0.00 -1.26 -5.01 105.19 101.39 1q23 n GLY 80 Ca -0.06 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 1q23 n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q23 s GLU 81 N -0.77 0.73 -0.04 1.61 2.02 -0.61 -5.12 118.70 116.52 1q23 s GLU 81 Ca 0.00 -0.61 -0.29 0.00 0.02 0.00 0.00 54.97 54.09 1q23 s GLU 81 Cb 0.00 -0.67 -0.03 0.00 0.10 0.00 0.00 34.13 33.53 1q23 s GLU 81 CO 0.00 0.16 0.96 -1.17 0.02 0.00 0.00 175.26 175.23 1q23 s LEU 82 N -0.97 4.33 0.09 1.80 2.96 -1.26 -0.04 118.68 125.59 1q23 s LEU 82 Ca -0.01 1.57 0.02 0.00 -0.22 0.00 0.00 54.13 55.50 1q23 s LEU 82 Cb -0.07 -3.51 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 1q23 s LEU 82 CO 0.01 -0.30 -0.08 0.54 -1.32 0.00 0.00 176.35 175.20 1q23 s VAL 83 N 1.27 0.76 -0.31 1.68 0.11 -0.64 -0.97 120.40 122.28 1q23 s VAL 83 Ca 0.49 -1.75 -0.10 0.00 -2.93 0.00 0.00 61.98 57.70 1q23 s VAL 83 Cb -0.20 -1.46 -0.01 0.00 -1.53 0.00 0.00 36.38 33.18 1q23 s VAL 83 CO 0.24 -0.72 0.16 -0.63 -3.33 0.00 0.00 175.10 170.82 1q23 s ILE 84 N -3.00 4.73 0.36 7.04 1.01 0.12 -2.16 121.20 129.30 1q23 s ILE 84 Ca 0.07 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 60.10 1q23 s ILE 84 Cb 0.01 -3.39 -0.11 0.00 0.01 0.00 0.00 42.46 38.98 1q23 s ILE 84 CO -0.03 0.08 1.49 0.26 0.00 0.00 0.00 174.94 176.74 1q23 s TRP 85 N 1.64 2.64 0.26 3.97 0.52 0.96 -1.05 118.94 127.87 1q23 s TRP 85 Ca 0.05 1.14 -0.03 0.00 0.02 0.00 0.00 56.10 57.28 1q23 s TRP 85 Cb -0.17 -4.01 0.53 0.00 -1.15 0.00 0.00 33.47 28.68 1q23 s TRP 85 CO 0.07 -3.00 1.68 -0.44 0.02 0.00 0.00 176.95 175.29 1q23 h ASP 86 N 3.26 0.06 -5.14 2.95 3.45 -0.97 -3.45 116.42 116.59 1q23 h ASP 86 Ca -0.50 0.15 -0.02 0.00 0.43 0.00 0.00 57.03 57.09 1q23 h ASP 86 Cb 1.24 0.20 -0.06 0.00 -0.56 0.00 0.00 39.33 40.14 1q23 h ASP 86 CO 0.66 -0.05 0.06 -0.94 -1.57 0.00 0.00 179.24 177.41 1q23 s SER 87 N -5.22 -0.07 0.07 6.45 1.04 -1.26 -5.04 113.70 109.67 1q23 s SER 87 Ca -0.12 -0.88 0.04 0.00 0.48 0.00 0.00 55.95 55.46 1q23 s SER 87 Cb 0.22 0.68 -0.03 0.00 0.10 0.00 0.00 66.02 67.00 1q23 s SER 87 CO 0.76 -1.31 -0.11 0.68 0.98 0.00 0.00 173.24 174.25 1q23 s VAL 88 N -3.68 0.86 -0.04 5.02 -7.23 -1.26 -4.93 120.40 109.13 1q23 s VAL 88 Ca 0.18 -1.34 0.04 0.00 -1.81 0.00 0.00 61.98 59.05 1q23 s VAL 88 Cb -0.03 -1.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.87 1q23 s VAL 88 CO 0.09 -0.39 -0.15 -1.00 -0.31 0.00 0.00 175.10 173.34 1q23 s HIS 89 N -1.71 2.68 0.06 2.82 3.76 -0.29 -4.65 115.29 117.96 1q23 s HIS 89 Ca -0.02 -0.18 -0.31 0.00 -0.15 0.00 0.00 55.06 54.41 1q23 s HIS 89 Cb -0.08 -1.61 -0.07 0.00 1.11 0.00 0.00 32.58 31.93 1q23 s HIS 89 CO 0.01 0.18 1.41 -1.25 -0.85 0.00 0.00 174.74 174.24 1q23 s PRO 90 N -0.77 4.30 -0.38 8.40 0.04 -1.25 -1.49 135.00 143.85 1q23 s PRO 90 Ca 0.12 2.04 -0.08 0.00 0.04 0.00 0.00 61.00 63.11 1q23 s PRO 90 Cb -0.11 -3.43 0.06 0.00 0.04 0.00 0.00 34.50 31.06 1q23 s PRO 90 CO 0.01 -0.52 0.19 0.00 0.04 0.00 0.00 177.00 176.72 1q23 s TYR 92 N 1.42 2.28 0.23 0.00 -0.85 0.87 -1.69 117.35 119.61 1q23 s TYR 92 Ca 0.01 -0.54 -0.12 0.00 -0.52 0.00 0.00 57.07 55.91 1q23 s TYR 92 Cb -0.21 -1.28 -0.07 0.00 0.38 0.00 0.00 41.96 40.77 1q23 s TYR 92 CO 0.03 0.52 0.59 0.95 -1.52 0.00 0.00 175.55 176.11 1q23 s THR 93 N -2.70 4.87 -0.06 -3.49 -4.23 -1.03 -0.94 115.64 108.06 1q23 s THR 93 Ca 0.31 0.64 0.03 0.00 -1.18 0.00 0.00 61.69 61.49 1q23 s THR 93 Cb 0.02 -3.64 0.01 0.00 1.34 0.00 0.00 72.50 70.23 1q23 s THR 93 CO 0.15 -0.03 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.38 1q23 s VAL 94 N -1.78 1.21 -0.18 2.29 1.01 0.82 -4.78 120.40 118.99 1q23 s VAL 94 Ca 0.47 -0.55 -0.13 0.00 0.00 0.00 0.00 61.98 61.77 1q23 s VAL 94 Cb -0.12 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 1q23 s VAL 94 CO 0.20 0.37 0.27 0.12 0.00 0.00 0.00 175.10 176.06 1q23 s PHE 95 N 0.44 3.43 -0.44 5.22 5.36 -1.26 -0.62 117.98 130.11 1q23 s PHE 95 Ca -0.11 0.53 -0.12 0.00 -0.96 0.00 0.00 56.93 56.28 1q23 s PHE 95 Cb -0.14 -2.33 0.07 0.00 -0.34 0.00 0.00 43.02 40.29 1q23 s PHE 95 CO 0.03 0.21 0.31 -1.01 -1.46 0.00 0.00 175.22 173.30 1q23 s HIS 96 N 0.58 3.30 0.30 10.12 3.76 0.23 -4.95 115.29 128.63 1q23 s HIS 96 Ca 0.15 -1.27 0.05 0.00 -0.15 0.00 0.00 55.06 53.83 1q23 s HIS 96 Cb -0.13 -3.03 0.69 0.00 1.11 0.00 0.00 32.58 31.23 1q23 s HIS 96 CO 0.03 -0.82 1.81 0.93 -0.85 0.00 0.00 174.74 175.84 1q23 h GLU 97 N 8.54 0.81 0.03 1.40 4.39 -1.97 0.13 114.58 127.91 1q23 h GLU 97 Ca -0.25 -0.05 -0.28 0.00 0.34 0.00 0.00 59.36 59.12 1q23 h GLU 97 Cb 1.09 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.53 1q23 h GLU 97 CO 0.80 0.53 -1.54 1.96 -1.16 0.00 0.00 179.01 179.60 1q23 h GLN 98 N 0.83 0.07 0.00 2.33 1.08 -1.95 -3.21 115.11 114.27 1q23 h GLN 98 Ca 0.54 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.62 1q23 h GLN 98 Cb 0.75 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.23 1q23 h GLN 98 CO -0.32 0.78 -0.73 0.25 -0.95 0.00 0.00 178.83 177.86 1q23 n THR 99 N -3.22 0.04 -3.07 -0.54 -2.24 -1.16 -4.96 114.28 99.13 1q23 n THR 99 Ca -0.14 -0.05 -0.20 0.00 -2.27 0.00 0.00 64.05 61.39 1q23 n THR 99 Cb 1.03 0.43 0.04 0.00 -2.10 0.00 0.00 70.33 69.73 1q23 n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1q23 n GLU 100 N -1.59 -5.06 -4.38 -0.78 1.02 0.45 -5.00 120.64 105.30 1q23 n GLU 100 Ca 0.04 0.79 -0.27 0.00 -0.02 0.00 0.00 57.16 57.70 1q23 n GLU 100 Cb 0.35 -5.46 -0.08 0.00 -0.02 0.00 0.00 31.44 26.23 1q23 n GLU 100 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1q23 s THR 101 N -3.15 2.01 0.11 2.62 -4.23 -1.13 -4.96 115.64 106.92 1q23 s THR 101 Ca 0.33 -1.83 0.03 0.00 -1.18 0.00 0.00 61.69 59.04 1q23 s THR 101 Cb -0.15 -2.85 -0.04 0.00 1.34 0.00 0.00 72.50 70.80 1q23 s THR 101 CO 0.41 0.00 -0.08 0.72 -0.54 0.00 0.00 174.62 175.13 1q23 s PHE 102 N -2.69 1.01 0.18 3.99 -0.12 -1.26 0.75 117.98 119.84 1q23 s PHE 102 Ca 0.34 -0.79 0.09 0.00 -0.05 0.00 0.00 56.93 56.51 1q23 s PHE 102 Cb 0.06 -0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 41.85 1q23 s PHE 102 CO 0.18 -0.05 -0.18 -1.12 -0.05 0.00 0.00 175.22 174.00 1q23 s SER 103 N -2.86 2.75 -0.24 1.98 0.01 0.21 -4.67 113.70 110.88 1q23 s SER 103 Ca 0.10 -0.90 -0.05 0.00 1.31 0.00 0.00 55.95 56.41 1q23 s SER 103 Cb 0.02 -0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.07 1q23 s SER 103 CO -0.02 -0.05 0.01 -0.44 0.41 0.00 0.00 173.24 173.15 1q23 s SER 104 N -2.83 4.65 -0.19 2.44 0.01 0.88 -0.13 113.70 118.53 1q23 s SER 104 Ca 0.18 -0.40 -0.02 0.00 1.31 0.00 0.00 55.95 57.01 1q23 s SER 104 Cb -0.05 -1.81 -0.01 0.00 0.21 0.00 0.00 66.02 64.37 1q23 s SER 104 CO 0.07 -0.05 -0.08 -0.76 0.41 0.00 0.00 173.24 172.83 1q23 s LEU 105 N 1.51 2.78 0.23 2.44 1.43 -0.11 -4.14 118.68 122.82 1q23 s LEU 105 Ca 0.05 -0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 52.63 1q23 s LEU 105 Cb -0.15 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.31 1q23 s LEU 105 CO -0.01 0.03 0.61 -1.66 0.23 0.00 0.00 176.35 175.55 1q23 s TRP 106 N 1.16 3.47 -0.01 0.29 1.48 -1.26 -0.09 118.94 123.98 1q23 s TRP 106 Ca 0.02 1.04 0.07 0.00 -1.06 0.00 0.00 56.10 56.16 1q23 s TRP 106 Cb -0.14 -2.38 -0.02 0.00 -1.16 0.00 0.00 33.47 29.77 1q23 s TRP 106 CO -0.02 0.27 -0.21 -1.12 -4.06 0.00 0.00 176.95 171.81 1q23 s SER 107 N -2.13 2.48 0.25 -2.66 0.01 -0.57 -4.98 113.70 106.10 1q23 s SER 107 Ca 0.46 -0.40 -0.30 0.00 1.31 0.00 0.00 55.95 57.02 1q23 s SER 107 Cb -0.12 -0.27 -0.11 0.00 0.21 0.00 0.00 66.02 65.73 1q23 s SER 107 CO 0.20 0.25 1.53 -0.70 0.41 0.00 0.00 173.24 174.92 1q23 s GLU 108 N -0.59 4.20 0.23 12.44 2.12 -1.26 -3.82 118.70 132.02 1q23 s GLU 108 Ca 0.08 2.43 -0.30 0.00 0.36 0.00 0.00 54.97 57.54 1q23 s GLU 108 Cb -0.08 -3.08 -0.09 0.00 0.26 0.00 0.00 34.13 31.13 1q23 s GLU 108 CO -0.00 -0.54 1.31 -0.47 -0.54 0.00 0.00 175.26 175.01 1q23 s TYR 109 N 0.23 3.22 0.03 5.30 5.04 -1.26 -4.93 117.35 124.97 1q23 s TYR 109 Ca 0.63 1.25 0.02 0.00 -2.44 0.00 0.00 57.07 56.53 1q23 s TYR 109 Cb -0.45 -3.62 -0.02 0.00 0.35 0.00 0.00 41.96 38.23 1q23 s TYR 109 CO 0.43 -1.89 -0.07 -1.01 -1.34 0.00 0.00 175.55 171.67 1q23 s HIS 110 N -0.14 0.57 0.44 4.97 3.76 -1.26 -5.03 115.29 118.60 1q23 s HIS 110 Ca 0.55 -0.37 0.24 0.00 -0.15 0.00 0.00 55.06 55.34 1q23 s HIS 110 Cb -0.37 -0.35 1.26 0.00 1.11 0.00 0.00 32.58 34.22 1q23 s HIS 110 CO 0.41 -0.07 1.77 -0.44 -0.85 0.00 0.00 174.74 175.56 1q23 h ASP 111 N 4.99 0.31 -3.54 1.40 3.32 -2.00 -3.41 116.42 117.49 1q23 h ASP 111 Ca -0.33 0.07 -0.64 0.00 0.02 0.00 0.00 57.03 56.15 1q23 h ASP 111 Cb 1.20 0.02 -0.20 0.00 0.22 0.00 0.00 39.33 40.57 1q23 h ASP 111 CO 0.44 0.04 -0.60 -0.62 -1.72 0.00 0.00 179.24 176.78 1q23 s ASP 112 N -5.17 5.35 0.22 6.45 2.15 -1.26 -4.98 116.67 119.42 1q23 s ASP 112 Ca -0.08 -0.09 -0.09 0.00 0.43 0.00 0.00 52.55 52.72 1q23 s ASP 112 Cb 0.25 -1.94 0.34 0.00 -0.30 0.00 0.00 42.92 41.27 1q23 s ASP 112 CO 0.80 0.04 1.67 0.15 -0.17 0.00 0.00 175.17 177.67 1q23 h PHE 113 N 7.67 0.07 0.03 -5.34 3.57 -1.78 0.18 116.94 121.34 1q23 h PHE 113 Ca -0.37 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.20 1q23 h PHE 113 Cb 1.18 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 39.93 1q23 h PHE 113 CO 0.64 -0.13 -0.40 0.00 -2.23 0.00 0.00 178.31 176.19 1q23 h ARG 114 N 0.17 -0.55 -0.30 1.11 2.47 -1.94 1.50 114.38 116.85 1q23 h ARG 114 Ca 0.35 0.04 0.06 0.00 -1.26 0.00 0.00 59.98 59.16 1q23 h ARG 114 Cb 0.57 0.12 -0.08 0.00 -1.65 0.00 0.00 29.97 28.94 1q23 h ARG 114 CO -0.51 -0.37 -0.45 1.96 0.56 0.00 0.00 179.97 181.16 1q23 h GLN 115 N -0.57 -0.39 -0.33 0.04 4.20 -1.82 -1.43 115.11 114.80 1q23 h GLN 115 Ca 0.04 0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1q23 h GLN 115 Cb 0.64 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 1q23 h GLN 115 CO -0.29 -0.26 0.16 0.35 -0.67 0.00 0.00 178.83 178.12 1q23 h PHE 116 N -0.41 0.48 -0.67 2.96 3.57 0.35 -1.76 116.94 121.46 1q23 h PHE 116 Ca 0.10 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1q23 h PHE 116 Cb 0.61 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.17 1q23 h PHE 116 CO -0.59 0.41 0.42 1.25 -2.23 0.00 0.00 178.31 177.57 1q23 h LEU 117 N 0.40 0.78 -0.32 0.59 6.46 0.23 -0.65 115.31 122.80 1q23 h LEU 117 Ca 0.11 -0.03 -0.11 0.00 -0.12 0.00 0.00 57.88 57.73 1q23 h LEU 117 Cb 0.11 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.84 1q23 h LEU 117 CO -0.01 0.59 -0.22 -0.74 -0.62 0.00 0.00 178.44 177.44 1q23 h HIS 118 N 0.91 0.83 -0.66 1.25 2.76 -0.86 -1.13 115.15 118.25 1q23 h HIS 118 Ca 0.24 -0.23 0.05 0.00 -2.20 0.00 0.00 60.37 58.24 1q23 h HIS 118 Cb -0.06 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 28.66 1q23 h HIS 118 CO 0.00 0.95 0.37 0.82 -1.30 0.00 0.00 177.93 178.78 1q23 h ILE 119 N 0.48 0.99 -0.16 6.26 2.04 -0.54 -2.64 117.51 123.95 1q23 h ILE 119 Ca 0.06 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 1q23 h ILE 119 Cb 0.77 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1q23 h ILE 119 CO 0.06 0.13 -0.05 0.22 0.00 0.00 0.00 178.15 178.51 1q23 h TYR 120 N 0.70 0.35 -0.96 1.37 3.20 -1.02 -1.65 116.97 118.96 1q23 h TYR 120 Ca 0.29 -0.08 0.10 0.00 3.14 0.00 0.00 58.73 62.18 1q23 h TYR 120 Cb 0.15 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.26 1q23 h TYR 120 CO -0.07 0.60 0.61 0.77 -1.64 0.00 0.00 178.16 178.44 1q23 h SER 121 N -0.00 0.89 0.35 -2.11 0.02 -1.22 0.43 113.55 111.91 1q23 h SER 121 Ca 0.04 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1q23 h SER 121 Cb 0.50 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1q23 h SER 121 CO 0.02 0.51 -0.17 1.56 -1.14 0.00 0.00 176.83 177.61 1q23 h GLN 122 N 0.97 -0.45 -0.61 3.45 4.20 -1.19 -0.62 115.11 120.87 1q23 h GLN 122 Ca 0.46 0.03 0.12 0.00 0.06 0.00 0.00 58.65 59.31 1q23 h GLN 122 Cb 0.42 0.10 -0.12 0.00 0.30 0.00 0.00 27.48 28.18 1q23 h GLN 122 CO -0.21 -0.14 -0.25 -0.44 -0.67 0.00 0.00 178.83 177.11 1q23 h ASP 123 N -0.76 -0.88 0.33 1.46 3.32 -1.02 1.06 116.42 119.94 1q23 h ASP 123 Ca -0.05 0.21 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 1q23 h ASP 123 Cb 0.51 0.49 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 1q23 h ASP 123 CO 0.08 -0.26 -0.27 0.58 -1.72 0.00 0.00 179.24 177.64 1q23 h VAL 124 N -0.09 1.11 0.13 -1.35 2.07 -0.05 0.13 116.25 118.20 1q23 h VAL 124 Ca 0.27 -0.97 -0.23 0.00 0.82 0.00 0.00 66.70 66.59 1q23 h VAL 124 Cb 0.52 1.54 0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1q23 h VAL 124 CO -0.67 0.27 -1.10 0.00 0.02 0.00 0.00 177.57 176.09 1q23 h ALA 125 N 1.73 0.02 0.00 1.67 0.00 -0.17 -0.65 119.26 121.86 1q23 h ALA 125 Ca -0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 54.91 53.98 1q23 h ALA 125 Cb 0.51 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1q23 h ALA 125 CO 0.04 0.58 -0.25 0.00 0.00 0.00 0.00 179.25 179.61 1q23 n TYR 127 N -3.77 0.00 -0.03 0.00 4.01 0.43 -4.79 117.16 113.01 1q23 n TYR 127 Ca -0.01 0.00 0.23 0.00 -0.16 0.00 0.00 57.90 57.96 1q23 n TYR 127 Cb 0.35 0.00 0.72 0.00 -0.31 0.00 0.00 39.34 40.11 1q23 n TYR 127 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1q23 h GLY 128 N 0.00 0.00 0.00 2.72 0.00 -1.19 -0.53 103.07 104.07 1q23 h GLY 128 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1q23 h GLY 128 CO 0.00 0.00 -1.39 -2.21 0.00 0.00 0.00 176.54 172.94 1q23 n GLU 129 N -3.99 0.77 -1.90 4.80 4.07 -1.26 -4.91 120.64 118.22 1q23 n GLU 129 Ca 0.12 -0.09 -0.42 0.00 -0.06 0.00 0.00 57.16 56.71 1q23 n GLU 129 Cb 0.77 -1.40 -0.03 0.00 -0.06 0.00 0.00 31.44 30.72 1q23 n GLU 129 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1q23 s ASN 130 N -3.48 6.59 0.26 4.31 3.84 -0.21 -4.96 114.94 121.29 1q23 s ASN 130 Ca -0.00 2.41 0.25 0.00 0.21 0.00 0.00 52.86 55.73 1q23 s ASN 130 Cb 0.13 -2.54 0.70 0.00 -0.55 0.00 0.00 41.25 38.99 1q23 s ASN 130 CO 0.76 -0.95 1.73 -0.07 -2.79 0.00 0.00 177.10 175.78 1q23 h LEU 131 N 9.99 0.00 -3.43 3.21 3.38 -1.92 -3.46 115.31 123.08 1q23 h LEU 131 Ca -0.43 -0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.25 1q23 h LEU 131 Cb 1.20 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.97 1q23 h LEU 131 CO 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 179.47 1q23 n ALA 132 N -1.86 -1.70 -0.03 1.53 0.00 -1.26 -4.90 120.51 112.29 1q23 n ALA 132 Ca 0.05 0.22 -0.11 0.00 0.00 0.00 0.00 53.44 53.60 1q23 n ALA 132 Cb 0.45 -0.66 -0.05 0.00 0.00 0.00 0.00 19.45 19.19 1q23 n ALA 132 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1q23 h TYR 133 N 1.03 -1.13 -3.34 0.00 3.20 -1.91 -3.32 116.97 111.50 1q23 h TYR 133 Ca -0.18 0.05 -0.70 0.00 3.14 0.00 0.00 58.73 61.04 1q23 h TYR 133 Cb 0.54 0.53 -0.36 0.00 1.54 0.00 0.00 36.73 38.98 1q23 h TYR 133 CO 0.21 -0.45 -0.19 -0.06 -1.64 0.00 0.00 178.16 176.03 1q23 s PHE 134 N -5.91 3.78 0.48 -3.82 0.40 -1.26 -0.08 117.98 111.57 1q23 s PHE 134 Ca -0.15 -3.00 0.28 0.00 -0.60 0.00 0.00 56.93 53.45 1q23 s PHE 134 Cb 0.10 -3.19 1.34 0.00 0.51 0.00 0.00 43.02 41.78 1q23 s PHE 134 CO 0.65 -0.74 1.81 -1.35 0.70 0.00 0.00 175.22 176.29 1q23 h PRO 135 N 6.13 0.17 -0.30 0.24 0.11 -1.72 0.19 132.00 136.83 1q23 h PRO 135 Ca 0.13 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 1q23 h PRO 135 Cb 0.83 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 1q23 h PRO 135 CO 0.82 0.11 0.00 1.63 -0.21 0.00 0.00 178.00 180.35 1q23 n LYS 136 N -4.39 2.95 0.00 1.05 5.02 -1.26 -5.06 118.16 116.47 1q23 n LYS 136 Ca 0.24 -2.89 0.00 0.00 -2.02 0.00 0.00 58.31 53.64 1q23 n LYS 136 Cb 1.03 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 34.16 1q23 n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1q23 n GLY 137 N -0.50 -0.55 3.18 0.72 0.00 0.68 -4.79 105.19 103.93 1q23 n GLY 137 Ca 0.23 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 45.12 1q23 n GLY 137 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1q23 s PHE 138 N 0.00 1.94 0.43 1.61 -0.12 -1.26 -4.78 117.98 115.80 1q23 s PHE 138 Ca 0.00 -0.57 0.08 0.00 -0.05 0.00 0.00 56.93 56.39 1q23 s PHE 138 Cb 0.00 -1.30 -0.00 0.00 -0.63 0.00 0.00 43.02 41.09 1q23 s PHE 138 CO 0.00 -0.19 0.49 0.96 -0.05 0.00 0.00 175.22 176.43 1q23 s ILE 139 N -0.02 2.77 -0.64 -4.49 -4.36 -1.26 -5.02 121.20 108.19 1q23 s ILE 139 Ca -0.04 -1.17 0.26 0.00 -0.26 0.00 0.00 60.65 59.44 1q23 s ILE 139 Cb -0.12 -2.94 0.29 0.00 1.25 0.00 0.00 42.46 40.94 1q23 s ILE 139 CO 0.03 0.00 1.75 -0.33 0.24 0.00 0.00 174.94 176.63 1q23 h GLU 140 N 0.80 0.00 -2.14 0.37 5.08 -2.02 -3.36 114.58 113.31 1q23 h GLU 140 Ca -0.40 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.39 1q23 h GLU 140 Cb 1.27 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.11 1q23 h GLU 140 CO 0.51 0.00 -0.82 0.27 -1.00 0.00 0.00 179.01 177.97 1q23 n ASN 141 N -2.41 2.66 -4.71 1.42 6.94 -1.26 -5.06 115.26 112.84 1q23 n ASN 141 Ca 0.05 -3.26 -0.24 0.00 -0.02 0.00 0.00 54.58 51.11 1q23 n ASN 141 Cb 0.42 -0.63 -0.06 0.00 -2.36 0.00 0.00 39.78 37.15 1q23 n ASN 141 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1q23 s MET 142 N -2.42 2.52 0.20 -3.83 1.00 -1.26 -1.13 119.30 114.38 1q23 s MET 142 Ca 0.41 -1.20 0.11 0.00 0.00 0.00 0.00 55.69 55.01 1q23 s MET 142 Cb 0.22 -2.35 -0.04 0.00 0.00 0.00 0.00 34.83 32.65 1q23 s MET 142 CO -0.08 0.41 -0.23 -0.59 0.00 0.00 0.00 175.02 174.53 1q23 s PHE 143 N -2.07 2.29 0.08 -0.03 -0.12 -0.55 -4.77 117.98 112.80 1q23 s PHE 143 Ca 0.31 -0.36 0.02 0.00 -0.05 0.00 0.00 56.93 56.85 1q23 s PHE 143 Cb -0.08 -1.12 -0.04 0.00 -0.63 0.00 0.00 43.02 41.15 1q23 s PHE 143 CO 0.21 0.52 0.14 -0.06 -0.05 0.00 0.00 175.22 175.98 1q23 s PHE 144 N -1.77 3.32 -0.02 3.49 0.40 -0.26 -0.58 117.98 122.56 1q23 s PHE 144 Ca 0.22 0.13 0.00 0.00 -0.60 0.00 0.00 56.93 56.68 1q23 s PHE 144 Cb -0.08 -1.66 0.02 0.00 0.51 0.00 0.00 43.02 41.81 1q23 s PHE 144 CO 0.10 0.54 0.01 0.08 0.70 0.00 0.00 175.22 176.66 1q23 s VAL 145 N -1.47 0.08 0.04 -0.44 1.01 -0.68 -0.59 120.40 118.33 1q23 s VAL 145 Ca 0.32 0.10 0.06 0.00 0.00 0.00 0.00 61.98 62.46 1q23 s VAL 145 Cb -0.12 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 1q23 s VAL 145 CO 0.24 0.10 -0.17 -0.94 0.00 0.00 0.00 175.10 174.34 1q23 s SER 146 N 0.81 1.98 -0.06 3.32 1.04 -0.69 -2.46 113.70 117.64 1q23 s SER 146 Ca -0.07 -0.46 -0.15 0.00 0.48 0.00 0.00 55.95 55.74 1q23 s SER 146 Cb -0.11 -0.15 -0.05 0.00 0.10 0.00 0.00 66.02 65.81 1q23 s SER 146 CO -0.02 0.10 0.40 0.00 0.98 0.00 0.00 173.24 174.70 1q23 s ALA 147 N -0.78 3.63 -0.48 5.32 0.00 -1.26 -1.42 121.76 126.78 1q23 s ALA 147 Ca 0.04 -0.26 0.05 0.00 0.00 0.00 0.00 51.96 51.79 1q23 s ALA 147 Cb -0.08 -2.44 0.20 0.00 0.00 0.00 0.00 23.12 20.80 1q23 s ALA 147 CO 0.01 0.31 0.45 -1.71 0.00 0.00 0.00 175.76 174.82 1q23 n ASN 148 N 2.55 0.68 0.00 0.00 5.15 -0.05 -4.92 115.26 118.66 1q23 n ASN 148 Ca -0.12 -2.70 0.12 0.00 -0.60 0.00 0.00 54.58 51.28 1q23 n ASN 148 Cb 0.52 -0.62 0.64 0.00 -0.53 0.00 0.00 39.78 39.79 1q23 n ASN 148 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1q23 n PRO 149 N 2.13 0.38 0.13 1.20 -0.04 -1.26 -2.63 135.00 134.90 1q23 n PRO 149 Ca 0.26 0.05 -0.01 0.00 -0.04 0.00 0.00 63.50 63.76 1q23 n PRO 149 Cb 0.46 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.53 1q23 n PRO 149 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1q23 h TRP 150 N 0.00 0.00 -3.48 0.54 6.55 -1.94 -3.40 115.95 114.22 1q23 h TRP 150 Ca 0.00 0.00 -0.36 0.00 0.95 0.00 0.00 58.89 59.48 1q23 h TRP 150 Cb 0.23 0.00 -0.34 0.00 -0.86 0.00 0.00 29.16 28.19 1q23 h TRP 150 CO 0.00 0.66 -0.75 0.08 -1.05 0.00 0.00 178.44 177.38 1q23 s VAL 151 N -3.27 0.24 -1.12 1.49 1.01 -1.22 -4.92 120.40 112.60 1q23 s VAL 151 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 61.98 61.90 1q23 s VAL 151 Cb 0.11 -0.33 0.17 0.00 0.00 0.00 0.00 36.38 36.34 1q23 s VAL 151 CO 0.76 0.16 1.31 -0.44 0.00 0.00 0.00 175.10 176.89 1q23 s SER 152 N 1.05 6.99 0.40 3.32 0.01 -1.26 -1.19 113.70 123.01 1q23 s SER 152 Ca -0.09 -2.83 -0.16 0.00 1.31 0.00 0.00 55.95 54.18 1q23 s SER 152 Cb -0.14 -2.37 -0.09 0.00 0.21 0.00 0.00 66.02 63.63 1q23 s SER 152 CO -0.02 -0.76 0.84 0.72 0.41 0.00 0.00 173.24 174.43 1q23 s PHE 153 N 1.48 3.40 -0.60 2.43 -0.12 -1.26 -4.94 117.98 118.36 1q23 s PHE 153 Ca 0.38 1.31 0.23 0.00 -0.05 0.00 0.00 56.93 58.81 1q23 s PHE 153 Cb -0.04 -2.63 0.16 0.00 -0.63 0.00 0.00 43.02 39.88 1q23 s PHE 153 CO -0.03 -0.08 1.14 0.25 -0.05 0.00 0.00 175.22 176.44 1q23 n THR 154 N -0.87 0.26 -3.94 -4.49 -2.24 -1.26 -4.66 114.28 97.08 1q23 n THR 154 Ca 0.05 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 1q23 n THR 154 Cb 0.54 0.05 -0.12 0.00 -2.10 0.00 0.00 70.33 68.70 1q23 n THR 154 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1q23 s SER 155 N -4.11 0.14 -0.15 3.42 0.15 -1.26 -4.82 113.70 107.09 1q23 s SER 155 Ca 0.04 -0.32 -0.06 0.00 0.70 0.00 0.00 55.95 56.32 1q23 s SER 155 Cb 0.14 0.10 0.07 0.00 -1.71 0.00 0.00 66.02 64.61 1q23 s SER 155 CO 0.77 -0.23 0.31 0.12 1.20 0.00 0.00 173.24 175.41 1q23 s PHE 156 N -1.06 -0.52 -0.05 3.44 5.36 -1.26 -5.11 117.98 118.78 1q23 s PHE 156 Ca -0.12 1.11 -0.13 0.00 -0.96 0.00 0.00 56.93 56.83 1q23 s PHE 156 Cb -0.07 0.09 0.02 0.00 -0.34 0.00 0.00 43.02 42.72 1q23 s PHE 156 CO -0.00 -0.37 0.31 0.16 -1.46 0.00 0.00 175.22 173.86 1q23 s ASP 157 N 2.19 -0.23 -0.15 6.13 1.47 -1.26 -4.74 116.67 120.08 1q23 s ASP 157 Ca -0.02 0.25 -0.11 0.00 1.18 0.00 0.00 52.55 53.84 1q23 s ASP 157 Cb -0.11 0.42 -0.05 0.00 -0.34 0.00 0.00 42.92 42.84 1q23 s ASP 157 CO -0.10 -0.34 0.22 -0.22 0.68 0.00 0.00 175.17 175.41 1q23 s LEU 158 N -0.87 4.29 -0.42 2.11 0.20 -1.26 -5.04 118.68 117.68 1q23 s LEU 158 Ca -0.10 0.45 0.04 0.00 0.69 0.00 0.00 54.13 55.22 1q23 s LEU 158 Cb -0.04 -2.24 0.11 0.00 -0.43 0.00 0.00 46.19 43.59 1q23 s LEU 158 CO 0.03 0.21 0.15 0.21 -0.29 0.00 0.00 176.35 176.67 1q23 s ASN 159 N -0.04 4.49 0.02 3.68 3.04 -1.26 -4.88 114.94 120.00 1q23 s ASN 159 Ca 0.14 -2.55 -0.30 0.00 0.04 0.00 0.00 52.86 50.19 1q23 s ASN 159 Cb -0.12 -1.58 -0.06 0.00 -1.54 0.00 0.00 41.25 37.94 1q23 s ASN 159 CO 0.03 -0.31 1.46 -0.69 -3.04 0.00 0.00 177.10 174.55 1q23 s VAL 160 N 0.36 3.55 0.31 -5.21 1.01 -1.26 -4.95 120.40 114.21 1q23 s VAL 160 Ca 0.14 0.95 0.05 0.00 0.00 0.00 0.00 61.98 63.12 1q23 s VAL 160 Cb -0.22 -3.61 0.09 0.00 0.00 0.00 0.00 36.38 32.63 1q23 s VAL 160 CO -0.05 0.00 1.77 0.00 0.00 0.00 0.00 175.10 176.82 1q23 h ALA 161 N 7.91 1.21 -3.71 5.51 0.00 -2.06 -3.39 119.26 124.73 1q23 h ALA 161 Ca -0.39 -0.32 -0.67 0.00 0.00 0.00 0.00 54.91 53.54 1q23 h ALA 161 Cb 1.18 -0.11 -0.39 0.00 0.00 0.00 0.00 17.79 18.48 1q23 h ALA 161 CO 0.91 0.51 -0.74 -0.80 0.00 0.00 0.00 179.25 179.13 1q23 s ASN 162 N -6.83 4.70 0.00 0.00 -0.87 -1.26 -4.98 114.94 105.70 1q23 s ASN 162 Ca -0.06 -1.89 0.24 0.00 -1.57 0.00 0.00 52.86 49.58 1q23 s ASN 162 Cb 0.14 -1.62 0.67 0.00 -0.02 0.00 0.00 41.25 40.43 1q23 s ASN 162 CO 0.77 -0.33 1.52 1.15 -2.57 0.00 0.00 177.10 177.65 1q23 n MET 163 N 4.33 1.97 -1.68 -0.60 0.00 -1.26 -4.85 117.12 115.02 1q23 n MET 163 Ca -0.02 -1.43 -0.45 0.00 0.00 0.00 0.00 57.70 55.80 1q23 n MET 163 Cb 0.42 -1.45 -0.04 0.00 0.00 0.00 0.00 33.22 32.15 1q23 n MET 163 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1q23 n ASP 164 N 0.69 3.42 -1.64 3.17 8.00 -1.26 -1.17 116.55 127.75 1q23 n ASP 164 Ca 0.17 1.07 -0.12 0.00 0.71 0.00 0.00 54.79 56.62 1q23 n ASP 164 Cb 0.44 -1.47 -0.04 0.00 -0.02 0.00 0.00 41.12 40.03 1q23 n ASP 164 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1q23 n ASN 165 N 3.79 -3.23 -4.49 -2.24 3.02 -1.26 -4.88 115.26 105.97 1q23 n ASN 165 Ca 0.17 0.27 -0.44 0.00 -0.03 0.00 0.00 54.58 54.55 1q23 n ASN 165 Cb 0.31 -2.98 -0.00 0.00 -0.61 0.00 0.00 39.78 36.49 1q23 n ASN 165 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1q23 s PHE 166 N -2.14 3.33 -2.35 3.10 5.36 -0.32 -4.63 117.98 120.34 1q23 s PHE 166 Ca 0.00 -2.00 0.21 0.00 -0.96 0.00 0.00 56.93 54.19 1q23 s PHE 166 Cb 0.00 -4.41 0.09 0.00 -0.34 0.00 0.00 43.02 38.36 1q23 s PHE 166 CO 0.00 -1.49 1.12 1.19 -1.46 0.00 0.00 175.22 174.58 1q23 n PHE 167 N 6.27 0.00 -2.53 10.12 3.72 -1.26 -4.32 117.46 129.45 1q23 n PHE 167 Ca 0.39 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.36 1q23 n PHE 167 Cb 0.44 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.95 1q23 n PHE 167 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1q23 s ALA 168 N -2.05 3.52 0.32 4.37 0.00 -1.26 -4.70 121.76 121.96 1q23 s ALA 168 Ca 0.22 0.49 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 1q23 s ALA 168 Cb 0.18 -3.52 -0.12 0.00 0.00 0.00 0.00 23.12 19.66 1q23 s ALA 168 CO 0.39 -0.82 1.40 -2.30 0.00 0.00 0.00 175.76 174.43 1q23 n PRO 169 N 5.50 2.31 -3.88 0.00 -0.02 -1.26 -4.81 135.00 132.84 1q23 n PRO 169 Ca 0.11 0.82 -0.35 0.00 -2.02 0.00 0.00 63.50 62.05 1q23 n PRO 169 Cb 0.47 -2.47 -0.14 0.00 -0.02 0.00 0.00 33.50 31.33 1q23 n PRO 169 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1q23 s VAL 170 N -0.70 3.43 -0.02 -1.45 1.01 -0.69 -1.10 120.40 120.88 1q23 s VAL 170 Ca 0.59 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 1q23 s VAL 170 Cb -0.55 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1q23 s VAL 170 CO 0.58 0.32 0.15 -0.36 0.00 0.00 0.00 175.10 175.79 1q23 s PHE 171 N 1.46 3.50 -0.06 5.22 0.40 0.24 -0.32 117.98 128.42 1q23 s PHE 171 Ca 0.04 0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.73 1q23 s PHE 171 Cb -0.15 -1.82 0.02 0.00 0.51 0.00 0.00 43.02 41.58 1q23 s PHE 171 CO -0.02 0.64 -0.05 0.99 0.70 0.00 0.00 175.22 177.47 1q23 s THR 172 N -1.25 0.66 -0.04 0.64 2.01 -0.09 -1.71 115.64 115.86 1q23 s THR 172 Ca 0.24 -0.16 -0.00 0.00 0.31 0.00 0.00 61.69 62.09 1q23 s THR 172 Cb -0.12 -0.69 -0.03 0.00 0.01 0.00 0.00 72.50 71.66 1q23 s THR 172 CO 0.15 0.27 0.01 -0.04 -0.69 0.00 0.00 174.62 174.32 1q23 s MET 173 N 1.15 2.90 0.12 4.92 1.00 -0.51 -1.09 119.30 127.79 1q23 s MET 173 Ca -0.07 -0.51 0.01 0.00 0.00 0.00 0.00 55.69 55.12 1q23 s MET 173 Cb -0.14 -2.74 0.01 0.00 0.00 0.00 0.00 34.83 31.96 1q23 s MET 173 CO -0.01 0.66 0.08 0.41 0.00 0.00 0.00 175.02 176.16 1q23 n GLY 174 N 1.70 3.12 3.64 -0.03 0.00 0.19 -0.88 105.19 112.94 1q23 n GLY 174 Ca -0.16 -2.20 -0.43 0.00 0.00 0.00 0.00 46.02 43.23 1q23 n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1q23 s LYS 175 N -2.47 4.08 0.90 1.61 2.20 -0.34 -4.51 119.74 121.21 1q23 s LYS 175 Ca 0.06 1.38 -0.11 0.00 -0.36 0.00 0.00 55.97 56.94 1q23 s LYS 175 Cb -0.00 -3.80 0.13 0.00 -1.51 0.00 0.00 37.83 32.65 1q23 s LYS 175 CO 0.04 -0.91 1.10 1.52 -0.36 0.00 0.00 175.35 176.74 1q23 s TYR 176 N 3.88 2.06 0.05 4.03 -0.85 -1.26 -4.26 117.35 121.00 1q23 s TYR 176 Ca 0.53 1.49 -0.27 0.00 -0.52 0.00 0.00 57.07 58.30 1q23 s TYR 176 Cb -0.18 -3.18 0.09 0.00 0.38 0.00 0.00 41.96 39.08 1q23 s TYR 176 CO 0.18 -2.54 0.85 1.52 -1.52 0.00 0.00 175.55 174.04 1q23 s TYR 177 N -2.78 -0.33 -0.07 -3.49 -0.85 -0.56 -4.99 117.35 104.28 1q23 s TYR 177 Ca 0.64 0.15 -0.21 0.00 -0.52 0.00 0.00 57.07 57.13 1q23 s TYR 177 Cb -0.20 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.66 1q23 s TYR 177 CO 0.58 -0.65 0.62 0.99 -1.52 0.00 0.00 175.55 175.56 1q23 s THR 178 N -3.26 5.05 -0.25 -3.49 2.01 -1.26 -1.07 115.64 113.37 1q23 s THR 178 Ca 0.06 1.27 0.01 0.00 0.31 0.00 0.00 61.69 63.34 1q23 s THR 178 Cb -0.01 -3.96 0.07 0.00 0.01 0.00 0.00 72.50 68.61 1q23 s THR 178 CO -0.07 0.31 -0.02 -1.58 -0.69 0.00 0.00 174.62 172.56 1q23 s GLN 179 N 0.52 1.48 0.99 4.92 0.74 -1.01 -4.96 119.66 122.35 1q23 s GLN 179 Ca 0.33 -1.09 0.00 0.00 0.05 0.00 0.00 55.36 54.65 1q23 s GLN 179 Cb -0.17 -2.58 0.00 0.00 1.10 0.00 0.00 33.01 31.36 1q23 s GLN 179 CO 0.16 -0.68 0.00 0.41 -0.55 0.00 0.00 175.29 174.63 1q23 n GLY 180 N 4.65 1.89 0.12 2.59 0.00 -1.26 -0.20 105.19 112.99 1q23 n GLY 180 Ca -0.09 0.53 0.13 0.00 0.00 0.00 0.00 46.02 46.59 1q23 n GLY 180 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1q23 n ASP 181 N 4.89 0.67 -4.90 1.61 9.92 -1.26 -4.93 116.55 122.55 1q23 n ASP 181 Ca 0.00 -0.52 -0.31 0.00 -0.53 0.00 0.00 54.79 53.43 1q23 n ASP 181 Cb 0.00 0.08 -0.05 0.00 -0.64 0.00 0.00 41.12 40.51 1q23 n ASP 181 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1q23 s LYS 182 N -2.69 3.63 -0.25 -1.24 1.02 0.72 -5.02 119.74 115.91 1q23 s LYS 182 Ca 0.20 -0.06 -0.07 0.00 0.02 0.00 0.00 55.97 56.05 1q23 s LYS 182 Cb 0.19 -2.83 -0.03 0.00 -0.52 0.00 0.00 37.83 34.64 1q23 s LYS 182 CO 0.57 0.45 0.07 0.08 -0.92 0.00 0.00 175.35 175.60 1q23 s VAL 183 N -1.68 4.37 0.10 3.17 1.01 -1.26 -2.40 120.40 123.70 1q23 s VAL 183 Ca 0.42 -0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.30 1q23 s VAL 183 Cb -0.12 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1q23 s VAL 183 CO 0.25 0.34 -0.01 -0.76 0.00 0.00 0.00 175.10 174.91 1q23 s LEU 184 N 1.56 3.40 -0.05 3.92 1.43 -0.23 0.15 118.68 128.85 1q23 s LEU 184 Ca 0.06 -0.22 -0.00 0.00 -1.03 0.00 0.00 54.13 52.94 1q23 s LEU 184 Cb -0.15 -2.13 0.03 0.00 0.03 0.00 0.00 46.19 43.96 1q23 s LEU 184 CO 0.04 0.17 -0.02 -0.32 0.23 0.00 0.00 176.35 176.45 1q23 s MET 185 N -2.36 0.68 0.16 1.70 1.75 0.48 -1.50 119.30 120.21 1q23 s MET 185 Ca 0.25 0.01 -0.32 0.00 -1.25 0.00 0.00 55.69 54.38 1q23 s MET 185 Cb -0.11 -0.86 -0.11 0.00 2.84 0.00 0.00 34.83 36.59 1q23 s MET 185 CO 0.18 -0.18 1.71 -2.14 -0.65 0.00 0.00 175.02 173.94 1q23 s PRO 186 N 1.38 4.15 -0.04 4.11 0.02 -1.26 0.22 135.00 143.59 1q23 s PRO 186 Ca -0.04 2.53 0.01 0.00 0.02 0.00 0.00 61.00 63.51 1q23 s PRO 186 Cb -0.13 -3.28 0.02 0.00 0.02 0.00 0.00 34.50 31.13 1q23 s PRO 186 CO -0.03 -0.75 -0.02 -1.17 -0.33 0.00 0.00 177.00 174.71 1q23 s LEU 187 N 1.73 1.19 0.11 -5.54 0.20 0.59 -0.63 118.68 116.33 1q23 s LEU 187 Ca 0.75 -0.07 0.08 0.00 0.69 0.00 0.00 54.13 55.59 1q23 s LEU 187 Cb -0.47 -0.32 -0.04 0.00 -0.43 0.00 0.00 46.19 44.94 1q23 s LEU 187 CO 0.33 -0.09 -0.20 0.00 -0.29 0.00 0.00 176.35 176.10 1q23 s ALA 188 N 1.03 1.81 -0.05 5.97 0.00 -0.25 -0.22 121.76 130.05 1q23 s ALA 188 Ca -0.10 -1.27 -0.00 0.00 0.00 0.00 0.00 51.96 50.59 1q23 s ALA 188 Cb -0.14 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.78 1q23 s ALA 188 CO -0.01 0.33 -0.01 -1.50 0.00 0.00 0.00 175.76 174.57 1q23 s ILE 189 N -1.31 0.35 -0.23 0.00 1.10 -0.54 -0.92 121.20 119.65 1q23 s ILE 189 Ca 0.07 0.07 -0.10 0.00 -0.51 0.00 0.00 60.65 60.19 1q23 s ILE 189 Cb -0.09 -0.46 -0.05 0.00 0.15 0.00 0.00 42.46 42.00 1q23 s ILE 189 CO 0.04 0.22 0.15 -1.58 -2.11 0.00 0.00 174.94 171.67 1q23 s GLN 190 N 1.53 4.09 0.22 3.50 -0.44 0.56 -1.87 119.66 127.27 1q23 s GLN 190 Ca -0.02 -0.26 0.03 0.00 -2.50 0.00 0.00 55.36 52.61 1q23 s GLN 190 Cb -0.13 -3.51 -0.05 0.00 -1.64 0.00 0.00 33.01 27.68 1q23 s GLN 190 CO -0.03 0.12 0.01 0.14 0.50 0.00 0.00 175.29 176.03 1q23 s VAL 191 N 0.89 0.90 -0.07 1.34 -7.23 -0.77 -1.70 120.40 113.76 1q23 s VAL 191 Ca 0.08 -2.02 -0.12 0.00 -1.81 0.00 0.00 61.98 58.11 1q23 s VAL 191 Cb -0.13 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 1q23 s VAL 191 CO 0.03 -0.31 0.29 -2.28 -0.31 0.00 0.00 175.10 172.51 1q23 s HIS 192 N -3.51 3.64 0.07 2.82 2.46 -1.26 -1.65 115.29 117.85 1q23 s HIS 192 Ca 0.29 0.75 0.22 0.00 0.47 0.00 0.00 55.06 56.79 1q23 s HIS 192 Cb 0.06 -2.16 0.75 0.00 -0.13 0.00 0.00 32.58 31.10 1q23 s HIS 192 CO 0.08 0.61 1.75 1.25 -2.47 0.00 0.00 174.74 175.97 1q23 h HIS 193 N 5.14 0.00 -0.58 3.88 2.76 -1.36 -2.38 115.15 122.61 1q23 h HIS 193 Ca -0.51 0.00 0.13 0.00 -2.20 0.00 0.00 60.37 57.79 1q23 h HIS 193 Cb 1.21 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.14 1q23 h HIS 193 CO 0.71 0.26 0.40 0.00 -1.30 0.00 0.00 177.93 178.01 1q23 h ALA 194 N 1.74 2.24 0.00 5.26 0.00 -1.80 -3.16 119.26 123.54 1q23 h ALA 194 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1q23 h ALA 194 Cb 0.86 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1q23 h ALA 194 CO 0.03 -0.40 -0.25 1.33 0.00 0.00 0.00 179.25 179.97 1q23 n VAL 195 N -4.44 0.00 -3.85 0.00 0.24 -1.11 -4.47 118.33 104.70 1q23 n VAL 195 Ca 0.10 -0.39 -0.15 0.00 -2.04 0.00 0.00 64.34 61.86 1q23 n VAL 195 Cb 0.50 0.92 -0.15 0.00 -1.47 0.00 0.00 33.84 33.63 1q23 n VAL 195 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1q23 s ASP 197 N 0.74 5.12 0.27 0.00 -0.00 -1.26 -4.26 116.67 117.28 1q23 s ASP 197 Ca -0.07 -0.81 -0.00 0.00 -0.00 0.00 0.00 52.55 51.67 1q23 s ASP 197 Cb -0.10 -0.07 0.52 0.00 -0.00 0.00 0.00 42.92 43.28 1q23 s ASP 197 CO -0.02 -1.02 1.81 1.23 -0.00 0.00 0.00 175.17 177.17 1q23 h GLY 198 N 0.57 1.52 0.52 0.21 0.00 -1.99 -2.22 103.07 101.68 1q23 h GLY 198 Ca -0.36 -0.36 0.03 0.00 0.00 0.00 0.00 47.33 46.64 1q23 h GLY 198 CO 0.48 0.10 -0.16 -2.75 0.00 0.00 0.00 176.54 174.22 1q23 h PHE 199 N 0.86 -0.40 -0.01 5.60 3.04 -1.98 0.18 116.94 124.23 1q23 h PHE 199 Ca 0.47 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.48 1q23 h PHE 199 Cb 0.52 0.19 -0.05 0.00 2.56 0.00 0.00 35.95 39.17 1q23 h PHE 199 CO -0.03 -0.23 -0.31 0.45 -2.02 0.00 0.00 178.31 176.17 1q23 h HIS 200 N -0.22 -0.86 0.15 0.41 3.86 -1.80 0.32 115.15 117.01 1q23 h HIS 200 Ca 0.08 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 1q23 h HIS 200 Cb 0.33 0.38 0.00 0.00 1.06 0.00 0.00 27.41 29.18 1q23 h HIS 200 CO -0.25 -0.40 -0.07 0.28 0.86 0.00 0.00 177.93 178.35 1q23 h VAL 201 N -0.46 0.86 -0.91 2.45 2.07 -1.46 -1.78 116.25 117.02 1q23 h VAL 201 Ca 0.06 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.65 1q23 h VAL 201 Cb 0.55 0.87 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 1q23 h VAL 201 CO -0.27 0.00 0.56 1.23 0.02 0.00 0.00 177.57 179.12 1q23 h GLY 202 N -0.21 1.41 1.15 2.17 0.00 -0.47 -0.46 103.07 106.67 1q23 h GLY 202 Ca -0.02 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 1q23 h GLY 202 CO 0.03 0.22 0.37 -0.09 0.00 0.00 0.00 176.54 177.07 1q23 h ARG 203 N 0.96 1.09 -0.29 4.80 2.43 -0.76 -0.36 114.38 122.25 1q23 h ARG 203 Ca 0.42 -0.15 -0.08 0.00 -0.81 0.00 0.00 59.98 59.36 1q23 h ARG 203 Cb 0.29 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1q23 h ARG 203 CO -0.21 0.84 -0.11 1.98 -1.51 0.00 0.00 179.97 180.96 1q23 h MET 204 N 1.09 0.59 -0.15 0.20 4.05 -0.67 0.29 114.93 120.34 1q23 h MET 204 Ca 0.26 -0.25 -0.14 0.00 -0.28 0.00 0.00 59.70 59.30 1q23 h MET 204 Cb 0.11 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1q23 h MET 204 CO -0.03 0.81 -0.50 -0.07 0.23 0.00 0.00 176.91 177.34 1q23 h LEU 205 N 0.34 0.43 -0.39 3.39 3.38 -0.58 0.16 115.31 122.04 1q23 h LEU 205 Ca 0.07 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 1q23 h LEU 205 Cb 0.62 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1q23 h LEU 205 CO 0.04 0.86 -0.19 0.78 0.09 0.00 0.00 178.44 180.02 1q23 h ASN 206 N 0.31 0.85 -0.40 -0.43 2.35 -0.86 -2.29 115.58 115.12 1q23 h ASN 206 Ca 0.01 -0.41 -0.05 0.00 -0.55 0.00 0.00 56.30 55.31 1q23 h ASN 206 Cb 1.00 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 39.11 1q23 h ASN 206 CO 0.09 1.07 0.08 -0.33 -1.65 0.00 0.00 177.43 176.69 1q23 h GLU 207 N 0.64 0.72 -0.81 0.81 5.08 -0.59 -2.45 114.58 117.98 1q23 h GLU 207 Ca 0.09 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1q23 h GLU 207 Cb 0.75 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 1q23 h GLU 207 CO 0.06 0.68 0.37 1.25 -1.00 0.00 0.00 179.01 180.37 1q23 h LEU 208 N 0.69 1.08 -0.41 1.33 5.85 -0.39 -1.33 115.31 122.13 1q23 h LEU 208 Ca 0.15 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1q23 h LEU 208 Cb 0.31 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1q23 h LEU 208 CO 0.00 0.92 0.23 -0.61 -0.34 0.00 0.00 178.44 178.65 1q23 h GLN 209 N 1.16 0.58 0.37 1.25 5.75 -1.22 -1.37 115.11 121.63 1q23 h GLN 209 Ca 0.28 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.71 1q23 h GLN 209 Cb 0.15 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.55 1q23 h GLN 209 CO -0.03 0.46 -0.46 1.96 -2.65 0.00 0.00 178.83 178.10 1q23 h GLN 210 N 0.54 -0.84 -0.76 1.69 4.20 -0.96 -1.61 115.11 117.37 1q23 h GLN 210 Ca 0.15 0.06 0.16 0.00 0.06 0.00 0.00 58.65 59.08 1q23 h GLN 210 Cb 0.04 0.19 -0.05 0.00 0.30 0.00 0.00 27.48 27.97 1q23 h GLN 210 CO -0.02 -0.56 0.51 1.88 -0.67 0.00 0.00 178.83 179.97 1q23 h TYR 211 N -0.87 0.40 -0.17 2.96 0.99 -1.27 0.13 116.97 119.14 1q23 h TYR 211 Ca -0.03 0.01 -0.21 0.00 2.00 0.00 0.00 58.73 60.50 1q23 h TYR 211 Cb 0.79 -0.13 0.01 0.00 1.00 0.00 0.00 36.73 38.40 1q23 h TYR 211 CO -0.28 0.14 -0.71 0.00 -0.00 0.00 0.00 178.16 177.31 1q23 h ASP 213 N 0.51 0.00 -0.65 0.00 3.32 -0.27 -2.95 116.42 116.38 1q23 h ASP 213 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1q23 h ASP 213 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 1q23 h ASP 213 CO 0.15 0.62 0.00 -0.62 -1.72 0.00 0.00 179.24 177.67 1q23 n GLU 214 N -3.57 2.75 -3.34 3.56 1.02 0.34 -4.77 120.64 116.62 1q23 n GLU 214 Ca -0.00 -2.45 -0.36 0.00 -0.02 0.00 0.00 57.16 54.33 1q23 n GLU 214 Cb 0.67 -1.59 -0.06 0.00 -0.02 0.00 0.00 31.44 30.44 1q23 n GLU 214 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1q23 s TRP 215 N -1.26 3.65 -0.39 -0.32 -0.00 -1.04 -4.98 118.94 114.60 1q23 s TRP 215 Ca 0.45 1.11 0.12 0.00 -0.00 0.00 0.00 56.10 57.78 1q23 s TRP 215 Cb 0.25 -2.40 0.31 0.00 -0.00 0.00 0.00 33.47 31.63 1q23 s TRP 215 CO 0.29 0.47 1.24 1.04 -0.00 0.00 0.00 176.95 179.98 1q23 n GLN 216 N 1.02 2.66 -0.90 5.86 6.02 -1.26 -4.92 117.38 125.85 1q23 n GLN 216 Ca -0.07 -2.27 0.00 0.00 -0.01 0.00 0.00 57.00 54.65 1q23 n GLN 216 Cb 0.52 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.34 1q23 n GLN 216 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1q23 n GLY 217 N -0.31 0.23 0.70 1.08 0.00 -1.26 -5.08 105.19 100.55 1q23 n GLY 217 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 1q23 n GLY 217 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93