#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q23 s THR 6 N 0.00 -0.78 -0.37 7.28 -4.23 -1.26 -4.95 115.64 111.32 1q23 s THR 6 Ca 0.00 0.10 0.03 0.00 -1.18 0.00 0.00 61.69 60.65 1q23 s THR 6 Cb 0.00 -0.80 0.31 0.00 1.34 0.00 0.00 72.50 73.35 1q23 s THR 6 CO 0.00 0.04 1.25 0.61 -0.54 0.00 0.00 174.62 175.98 1q23 n GLY 7 N 5.41 -0.90 3.25 3.99 0.00 -1.26 -5.13 105.19 110.56 1q23 n GLY 7 Ca -0.10 0.62 -0.12 0.00 0.00 0.00 0.00 46.02 46.43 1q23 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1q23 s TYR 8 N 0.18 -0.12 0.13 1.61 -0.85 -1.26 -0.77 117.35 116.26 1q23 s TYR 8 Ca 0.23 0.01 0.03 0.00 -0.52 0.00 0.00 57.07 56.83 1q23 s TYR 8 Cb 0.27 0.10 -0.04 0.00 0.38 0.00 0.00 41.96 42.68 1q23 s TYR 8 CO -0.15 -0.50 0.19 0.95 -1.52 0.00 0.00 175.55 174.53 1q23 s THR 9 N -2.43 4.93 -0.12 -3.49 -4.23 0.33 -4.90 115.64 105.73 1q23 s THR 9 Ca -0.06 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1q23 s THR 9 Cb -0.01 -3.49 -0.02 0.00 1.34 0.00 0.00 72.50 70.32 1q23 s THR 9 CO -0.03 -0.03 -0.13 0.28 -0.54 0.00 0.00 174.62 174.18 1q23 s THR 10 N -1.65 3.10 -0.13 3.99 -1.32 -1.26 -0.39 115.64 117.97 1q23 s THR 10 Ca 0.33 -0.66 -0.05 0.00 -1.21 0.00 0.00 61.69 60.10 1q23 s THR 10 Cb -0.11 -2.29 -0.04 0.00 -1.51 0.00 0.00 72.50 68.55 1q23 s THR 10 CO 0.26 0.53 0.06 -0.69 -2.21 0.00 0.00 174.62 172.57 1q23 s VAL 11 N 0.18 4.83 -0.25 5.08 1.01 -0.31 -4.98 120.40 125.96 1q23 s VAL 11 Ca -0.07 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.73 1q23 s VAL 11 Cb -0.15 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1q23 s VAL 11 CO 0.05 0.55 0.31 -0.62 0.00 0.00 0.00 175.10 175.39 1q23 s ASP 12 N -0.44 6.22 0.10 3.32 3.68 -1.26 -4.80 116.67 123.49 1q23 s ASP 12 Ca 0.10 0.25 0.16 0.00 2.13 0.00 0.00 52.55 55.19 1q23 s ASP 12 Cb -0.12 -2.18 -0.11 0.00 -1.45 0.00 0.00 42.92 39.06 1q23 s ASP 12 CO 0.02 -0.10 0.94 0.40 0.13 0.00 0.00 175.17 176.55 1q23 h ILE 13 N 5.26 0.59 -0.99 4.11 2.04 -1.97 -3.41 117.51 123.14 1q23 h ILE 13 Ca -0.34 -2.08 0.20 0.00 1.00 0.00 0.00 64.86 63.64 1q23 h ILE 13 Cb 1.17 2.12 -0.10 0.00 -0.74 0.00 0.00 36.82 39.27 1q23 h ILE 13 CO 0.64 0.34 0.62 0.77 0.00 0.00 0.00 178.15 180.51 1q23 h SER 14 N 0.00 0.70 -0.20 1.72 4.64 -2.00 0.18 113.55 118.59 1q23 h SER 14 Ca -0.13 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1q23 h SER 14 Cb 1.56 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.62 1q23 h SER 14 CO 0.05 0.24 0.00 0.00 -0.87 0.00 0.00 176.83 176.25 1q23 n GLN 15 N -4.72 1.91 -1.67 4.77 6.02 -1.26 -4.99 117.38 117.43 1q23 n GLN 15 Ca 0.23 -1.83 -0.47 0.00 -0.01 0.00 0.00 57.00 54.92 1q23 n GLN 15 Cb 0.62 -1.37 -0.04 0.00 1.02 0.00 0.00 30.24 30.47 1q23 n GLN 15 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 1q23 n TRP 16 N 1.03 2.30 0.33 1.08 -0.00 0.63 -4.89 117.44 117.92 1q23 n TRP 16 Ca 0.13 0.13 0.14 0.00 -0.00 0.00 0.00 57.50 57.91 1q23 n TRP 16 Cb 0.47 -2.60 0.77 0.00 -0.00 0.00 0.00 31.31 29.95 1q23 n TRP 16 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1q23 h HIS 17 N 7.54 0.00 -0.49 5.87 3.86 -1.94 -0.07 115.15 129.92 1q23 h HIS 17 Ca -0.47 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.74 1q23 h HIS 17 Cb 1.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 1q23 h HIS 17 CO 0.75 0.00 0.00 0.54 0.86 0.00 0.00 177.93 180.08 1q23 n ARG 18 N -2.85 3.29 -0.33 2.45 1.74 -1.26 -4.71 116.66 115.00 1q23 n ARG 18 Ca -0.02 -2.64 0.06 0.00 -0.77 0.00 0.00 57.85 54.48 1q23 n ARG 18 Cb 0.41 -1.70 0.16 0.00 -1.02 0.00 0.00 32.46 30.30 1q23 n ARG 18 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1q23 h LYS 19 N 3.05 0.01 0.09 5.56 1.63 -1.26 0.25 116.57 125.90 1q23 h LYS 19 Ca 0.00 -0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.48 1q23 h LYS 19 Cb 1.23 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.84 1q23 h LYS 19 CO 0.16 0.01 -1.68 1.49 -3.45 0.00 0.00 179.45 175.97 1q23 h GLU 20 N 0.01 0.19 -0.39 1.90 4.81 -1.84 -2.29 114.58 116.97 1q23 h GLU 20 Ca 0.47 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 1q23 h GLU 20 Cb 0.78 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.23 1q23 h GLU 20 CO -0.93 0.98 0.13 0.45 -0.73 0.00 0.00 179.01 178.91 1q23 h HIS 21 N 0.05 0.23 -0.49 0.92 3.86 -1.76 -2.69 115.15 115.27 1q23 h HIS 21 Ca -0.29 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 58.92 1q23 h HIS 21 Cb 2.01 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 30.42 1q23 h HIS 21 CO 0.05 0.08 0.23 0.35 0.86 0.00 0.00 177.93 179.51 1q23 h PHE 22 N 0.28 0.72 0.05 2.45 3.04 -0.90 -0.88 116.94 121.70 1q23 h PHE 22 Ca 0.18 -0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.09 1q23 h PHE 22 Cb 0.17 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.46 1q23 h PHE 22 CO -0.15 0.57 -0.02 0.93 -2.02 0.00 0.00 178.31 177.62 1q23 h GLU 23 N 0.65 -0.06 -0.22 1.11 5.08 -1.21 -0.10 114.58 119.83 1q23 h GLU 23 Ca 0.17 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1q23 h GLU 23 Cb 0.13 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1q23 h GLU 23 CO -0.02 0.06 0.07 0.00 -1.00 0.00 0.00 179.01 178.12 1q23 h ALA 24 N 0.79 0.24 0.00 3.43 0.00 -1.34 -1.24 119.26 121.15 1q23 h ALA 24 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1q23 h ALA 24 Cb 0.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1q23 h ALA 24 CO 0.01 -0.35 0.00 1.19 0.00 0.00 0.00 179.25 180.10 1q23 n PHE 25 N -5.05 0.00 0.93 0.00 0.99 -0.35 -1.31 117.46 112.67 1q23 n PHE 25 Ca -0.02 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.55 1q23 n PHE 25 Cb 0.08 -0.15 0.28 0.00 -1.00 0.00 0.00 39.48 38.69 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 -1.15 2.13 0.00 -1.08 1.13 -0.07 -4.29 117.38 114.05 1q23 n GLN 26 Ca 0.09 -1.67 0.00 0.00 -1.94 0.00 0.00 57.00 53.48 1q23 n GLN 26 Cb 0.09 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 28.97 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 0.95 0.00 0.07 1.08 3.41 -0.43 -4.94 113.62 113.75 1q23 n SER 27 Ca 0.17 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.75 1q23 n SER 27 Cb 0.49 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 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 1.09 -0.67 -3.33 -1.51 -1.45 -3.09 116.25 107.29 1q23 h VAL 28 Ca 0.00 -2.67 -0.14 0.00 -1.23 0.00 0.00 66.70 62.66 1q23 h VAL 28 Cb 0.00 2.50 -0.08 0.00 -2.13 0.00 0.00 31.29 31.58 1q23 h VAL 28 CO 0.00 0.62 0.17 0.00 -1.23 0.00 0.00 177.57 177.14 1q23 n ALA 29 N -2.35 4.31 -1.68 5.19 0.00 -0.61 -5.02 120.51 120.35 1q23 n ALA 29 Ca -0.04 -2.12 -0.45 0.00 0.00 0.00 0.00 53.44 50.84 1q23 n ALA 29 Cb 0.87 -1.21 -0.04 0.00 0.00 0.00 0.00 19.45 19.08 1q23 n ALA 29 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1q23 n GLN 30 N 0.15 2.44 -3.75 0.00 7.27 -1.17 -4.59 117.38 117.73 1q23 n GLN 30 Ca 0.35 0.89 -0.09 0.00 0.07 0.00 0.00 57.00 58.22 1q23 n GLN 30 Cb 1.30 -2.73 -0.03 0.00 2.41 0.00 0.00 30.24 31.20 1q23 n GLN 30 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1q23 s THR 32 N -3.88 1.08 -0.06 0.00 -1.32 -1.26 -1.59 115.64 108.60 1q23 s THR 32 Ca 0.09 -1.57 -0.12 0.00 -1.21 0.00 0.00 61.69 58.89 1q23 s THR 32 Cb -0.04 -1.31 0.02 0.00 -1.51 0.00 0.00 72.50 69.66 1q23 s THR 32 CO 0.01 -0.44 0.28 -0.72 -2.21 0.00 0.00 174.62 171.54 1q23 s TYR 33 N -2.05 -0.22 0.20 9.09 -0.85 -1.03 -4.91 117.35 117.58 1q23 s TYR 33 Ca 0.04 0.46 0.09 0.00 -0.52 0.00 0.00 57.07 57.14 1q23 s TYR 33 Cb -0.05 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.33 1q23 s TYR 33 CO 0.01 -0.27 -0.09 -0.80 -1.52 0.00 0.00 175.55 172.89 1q23 s ASN 34 N -0.65 4.26 -0.19 -0.18 -0.87 -1.26 -2.17 114.94 113.87 1q23 s ASN 34 Ca -0.07 -0.61 -0.14 0.00 -1.57 0.00 0.00 52.86 50.47 1q23 s ASN 34 Cb -0.04 -0.72 0.06 0.00 -0.02 0.00 0.00 41.25 40.53 1q23 s ASN 34 CO 0.02 0.09 0.49 -1.58 -2.57 0.00 0.00 177.10 173.54 1q23 s GLN 35 N -2.98 0.52 -0.01 -0.60 0.74 -0.51 -4.98 119.66 111.84 1q23 s GLN 35 Ca 0.26 0.79 0.04 0.00 0.05 0.00 0.00 55.36 56.50 1q23 s GLN 35 Cb -0.08 0.15 -0.03 0.00 1.10 0.00 0.00 33.01 34.15 1q23 s GLN 35 CO 0.16 -0.11 -0.12 0.99 -0.55 0.00 0.00 175.29 175.65 1q23 s THR 36 N 0.85 3.23 0.17 -0.34 2.01 -1.26 -0.72 115.64 119.59 1q23 s THR 36 Ca -0.05 -0.83 0.07 0.00 0.31 0.00 0.00 61.69 61.19 1q23 s THR 36 Cb -0.05 -2.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 1q23 s THR 36 CO -0.07 0.47 -0.14 0.54 -0.69 0.00 0.00 174.62 174.73 1q23 s VAL 37 N -0.87 1.56 -0.92 3.82 0.11 0.16 -4.99 120.40 119.26 1q23 s VAL 37 Ca 0.14 -2.03 -0.13 0.00 -2.93 0.00 0.00 61.98 57.03 1q23 s VAL 37 Cb -0.11 -1.87 0.24 0.00 -1.53 0.00 0.00 36.38 33.11 1q23 s VAL 37 CO 0.04 -0.54 0.89 -1.10 -3.33 0.00 0.00 175.10 171.05 1q23 s GLN 38 N -3.33 3.80 0.35 1.54 -1.52 -1.26 -0.89 119.66 118.35 1q23 s GLN 38 Ca 0.17 -2.70 -0.29 0.00 -1.95 0.00 0.00 55.36 50.60 1q23 s GLN 38 Cb -0.02 -4.48 -0.11 0.00 -0.22 0.00 0.00 33.01 28.18 1q23 s GLN 38 CO 0.05 -1.29 1.49 -1.17 -0.25 0.00 0.00 175.29 174.12 1q23 s LEU 39 N -0.25 4.34 -0.78 2.90 0.20 0.53 -4.66 118.68 120.96 1q23 s LEU 39 Ca 0.22 2.97 -0.22 0.00 0.69 0.00 0.00 54.13 57.79 1q23 s LEU 39 Cb -0.10 -3.66 0.08 0.00 -0.43 0.00 0.00 46.19 42.08 1q23 s LEU 39 CO -0.09 -0.83 1.11 -0.62 -0.29 0.00 0.00 176.35 175.63 1q23 s ASP 40 N -0.03 6.33 -0.07 3.68 3.68 -1.26 -0.11 116.67 128.90 1q23 s ASP 40 Ca 0.55 -1.25 0.14 0.00 2.13 0.00 0.00 52.55 54.11 1q23 s ASP 40 Cb -0.46 -2.45 0.51 0.00 -1.45 0.00 0.00 42.92 39.07 1q23 s ASP 40 CO 0.58 -1.40 1.38 2.30 0.13 0.00 0.00 175.17 178.16 1q23 n ILE 41 N 5.99 1.20 0.04 4.11 -5.35 0.87 -4.63 119.36 121.59 1q23 n ILE 41 Ca 0.09 -0.82 -0.11 0.00 -0.27 0.00 0.00 62.75 61.64 1q23 n ILE 41 Cb 0.47 0.07 -0.04 0.00 -1.74 0.00 0.00 39.64 38.41 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 2.97 0.47 -0.20 7.28 2.02 -1.65 0.47 112.91 124.27 1q23 h THR 42 Ca 0.00 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.99 1q23 h THR 42 Cb 1.04 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1q23 h THR 42 CO 0.14 0.00 -0.63 0.00 0.37 0.00 0.00 175.52 175.40 1q23 h ALA 43 N 0.55 0.51 -0.69 6.16 0.00 -1.87 -2.81 119.26 121.11 1q23 h ALA 43 Ca 0.07 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 1q23 h ALA 43 Cb 0.44 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1q23 h ALA 43 CO -0.23 0.70 0.21 0.35 0.00 0.00 0.00 179.25 180.27 1q23 h PHE 44 N 0.52 1.12 -0.47 0.00 3.57 -1.45 0.06 116.94 120.30 1q23 h PHE 44 Ca -0.01 -0.12 -0.10 0.00 3.53 0.00 0.00 57.97 61.27 1q23 h PHE 44 Cb 1.22 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 1q23 h PHE 44 CO 0.06 0.90 -0.10 1.25 -2.23 0.00 0.00 178.31 178.20 1q23 h LEU 45 N 1.02 0.90 0.69 0.59 6.46 -0.94 0.33 115.31 124.36 1q23 h LEU 45 Ca 0.22 -0.35 -0.03 0.00 -0.12 0.00 0.00 57.88 57.60 1q23 h LEU 45 Cb 0.32 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.00 1q23 h LEU 45 CO -0.01 1.04 -0.40 0.11 -0.62 0.00 0.00 178.44 178.57 1q23 h LYS 46 N 0.74 -0.98 -0.83 1.25 1.57 -1.29 0.18 116.57 117.21 1q23 h LYS 46 Ca 0.12 0.07 0.21 0.00 -1.87 0.00 0.00 60.65 59.18 1q23 h LYS 46 Cb 0.64 0.22 -0.14 0.00 0.08 0.00 0.00 32.23 33.03 1q23 h LYS 46 CO 0.04 -0.65 0.12 1.15 -0.57 0.00 0.00 179.45 179.54 1q23 h THR 47 N -1.01 0.31 -0.42 -0.16 2.02 -0.70 0.10 112.91 113.05 1q23 h THR 47 Ca -0.09 -0.05 -0.10 0.00 0.77 0.00 0.00 66.41 66.94 1q23 h THR 47 Cb 0.81 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1q23 h THR 47 CO 0.11 0.03 -0.13 0.58 0.37 0.00 0.00 175.52 176.48 1q23 h VAL 48 N 0.15 1.28 -0.14 3.16 2.07 0.03 -3.01 116.25 119.78 1q23 h VAL 48 Ca 0.49 -1.24 -0.18 0.00 0.82 0.00 0.00 66.70 66.59 1q23 h VAL 48 Cb 0.94 1.20 0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1q23 h VAL 48 CO -0.68 0.42 -0.61 0.11 0.02 0.00 0.00 177.57 176.84 1q23 h LYS 49 N 0.65 0.66 0.01 1.57 1.57 -0.12 -0.29 116.57 120.63 1q23 h LYS 49 Ca 0.10 -0.52 -0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1q23 h LYS 49 Cb 0.67 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1q23 h LYS 49 CO 0.05 1.14 -0.01 1.57 -0.57 0.00 0.00 179.45 181.63 1q23 h LYS 50 N 0.34 -0.02 0.00 3.15 2.10 -0.85 -3.38 116.57 117.91 1q23 h LYS 50 Ca -0.04 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.46 1q23 h LYS 50 Cb 1.24 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.67 1q23 h LYS 50 CO 0.13 0.18 -0.08 0.09 -2.00 0.00 0.00 179.45 177.77 1q23 n ASN 51 N -5.01 -2.94 -3.81 7.07 3.02 -1.14 -4.99 115.26 107.46 1q23 n ASN 51 Ca -0.08 -0.38 -0.28 0.00 -0.03 0.00 0.00 54.58 53.82 1q23 n ASN 51 Cb 0.12 -0.43 -0.12 0.00 -0.61 0.00 0.00 39.78 38.74 1q23 n ASN 51 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1q23 s LYS 52 N -3.87 2.18 0.27 3.52 1.02 -1.25 -4.88 119.74 116.72 1q23 s LYS 52 Ca 0.29 -3.11 0.06 0.00 0.02 0.00 0.00 55.97 53.22 1q23 s LYS 52 Cb -0.05 -3.07 -0.03 0.00 -0.52 0.00 0.00 37.83 34.16 1q23 s LYS 52 CO 0.24 -1.30 0.33 -1.01 -0.92 0.00 0.00 175.35 172.70 1q23 s HIS 53 N -1.16 3.27 0.08 3.18 3.76 -0.12 -5.05 115.29 119.25 1q23 s HIS 53 Ca 0.26 -0.10 -0.20 0.00 -0.15 0.00 0.00 55.06 54.87 1q23 s HIS 53 Cb -0.04 -1.62 -0.07 0.00 1.11 0.00 0.00 32.58 31.96 1q23 s HIS 53 CO -0.17 0.36 0.59 -1.59 -0.85 0.00 0.00 174.74 173.09 1q23 s LYS 54 N -3.98 4.24 0.05 1.40 -2.85 -1.26 -4.82 119.74 112.52 1q23 s LYS 54 Ca 0.36 0.78 -0.31 0.00 -1.00 0.00 0.00 55.97 55.80 1q23 s LYS 54 Cb -0.09 -3.24 -0.18 0.00 -2.06 0.00 0.00 37.83 32.27 1q23 s LYS 54 CO 0.28 0.63 1.45 0.35 0.10 0.00 0.00 175.35 178.16 1q23 h PHE 55 N 4.50 -0.83 -0.05 1.78 3.57 -1.98 -3.09 116.94 120.84 1q23 h PHE 55 Ca -0.49 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.00 1q23 h PHE 55 Cb 1.21 0.28 -0.04 0.00 2.79 0.00 0.00 35.95 40.19 1q23 h PHE 55 CO 0.68 -0.49 -0.35 -0.92 -2.23 0.00 0.00 178.31 174.99 1q23 h TYR 56 N -1.02 -1.05 -0.97 0.41 3.20 -1.99 -0.84 116.97 114.71 1q23 h TYR 56 Ca -0.09 0.04 0.15 0.00 3.14 0.00 0.00 58.73 61.96 1q23 h TYR 56 Cb 0.72 0.46 -0.09 0.00 1.54 0.00 0.00 36.73 39.36 1q23 h TYR 56 CO -0.01 -0.36 0.59 -1.00 -1.64 0.00 0.00 178.16 175.74 1q23 h PRO 57 N -0.41 0.82 -0.14 1.82 0.13 -2.00 0.20 132.00 132.43 1q23 h PRO 57 Ca 0.02 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.12 1q23 h PRO 57 Cb 0.46 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.37 1q23 h PRO 57 CO -0.26 0.54 -0.03 0.00 -0.23 0.00 0.00 178.00 178.02 1q23 h ALA 58 N 1.58 0.09 -0.34 -0.56 0.00 -1.17 -0.25 119.26 118.60 1q23 h ALA 58 Ca 0.52 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.39 1q23 h ALA 58 Cb 0.66 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1q23 h ALA 58 CO -0.32 -0.48 -0.16 0.35 0.00 0.00 0.00 179.25 178.64 1q23 h PHE 59 N -0.00 0.82 -0.67 0.00 3.57 -0.48 -2.57 116.94 117.61 1q23 h PHE 59 Ca 0.07 -0.20 0.11 0.00 3.53 0.00 0.00 57.97 61.47 1q23 h PHE 59 Cb 0.10 -0.19 -0.08 0.00 2.79 0.00 0.00 35.95 38.57 1q23 h PHE 59 CO -0.17 0.91 0.26 0.82 -2.23 0.00 0.00 178.31 177.90 1q23 h ILE 60 N 0.50 0.74 -0.46 1.41 2.04 -0.81 -0.56 117.51 120.37 1q23 h ILE 60 Ca 0.08 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1q23 h ILE 60 Cb 0.69 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1q23 h ILE 60 CO 0.05 0.08 0.23 -0.74 0.00 0.00 0.00 178.15 177.77 1q23 h HIS 61 N 0.44 0.65 -0.04 1.37 2.76 -0.88 -0.35 115.15 119.10 1q23 h HIS 61 Ca 0.35 -0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.52 1q23 h HIS 61 Cb 0.45 -0.20 -0.04 0.00 1.55 0.00 0.00 27.41 29.17 1q23 h HIS 61 CO -0.16 0.51 -0.18 0.82 -1.30 0.00 0.00 177.93 177.62 1q23 h ILE 62 N 0.60 0.55 -0.22 6.26 2.04 -1.05 0.56 117.51 126.25 1q23 h ILE 62 Ca 0.16 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.08 1q23 h ILE 62 Cb 0.10 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 36.66 1q23 h ILE 62 CO -0.02 0.00 -0.27 -0.07 0.00 0.00 0.00 178.15 177.79 1q23 h LEU 63 N -0.28 -0.86 -0.84 1.44 3.38 -0.65 -2.34 115.31 115.16 1q23 h LEU 63 Ca 0.07 0.14 0.11 0.00 0.09 0.00 0.00 57.88 58.29 1q23 h LEU 63 Cb 0.37 0.39 -0.08 0.00 0.09 0.00 0.00 40.66 41.43 1q23 h LEU 63 CO -0.20 -0.31 0.47 0.00 0.09 0.00 0.00 178.44 178.49 1q23 h ALA 64 N 0.68 1.22 -0.80 1.53 0.00 -0.89 0.10 119.26 121.10 1q23 h ALA 64 Ca 0.13 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1q23 h ALA 64 Cb 0.49 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1q23 h ALA 64 CO -0.38 0.06 0.52 0.00 0.00 0.00 0.00 179.25 179.46 1q23 h ARG 65 N 0.77 0.91 -0.08 0.00 3.08 -0.42 -0.84 114.38 117.79 1q23 h ARG 65 Ca 0.42 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 60.25 1q23 h ARG 65 Cb 0.43 -0.21 0.01 0.00 0.08 0.00 0.00 29.97 30.29 1q23 h ARG 65 CO -0.27 0.60 -0.58 -0.07 -1.07 0.00 0.00 179.97 178.58 1q23 h LEU 66 N 0.94 0.65 -0.71 3.04 3.38 -0.44 -2.38 115.31 119.78 1q23 h LEU 66 Ca 0.33 -0.67 0.09 0.00 0.09 0.00 0.00 57.88 57.72 1q23 h LEU 66 Cb 0.12 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 1q23 h LEU 66 CO -0.11 1.22 0.37 0.24 0.09 0.00 0.00 178.44 180.25 1q23 h MET 67 N 0.13 0.61 0.00 1.13 2.86 -0.64 -2.50 114.93 116.51 1q23 h MET 67 Ca -0.05 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1q23 h MET 67 Cb 1.24 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.76 1q23 h MET 67 CO 0.12 0.41 0.00 0.09 1.06 0.00 0.00 176.91 178.58 1q23 n ASN 68 N -4.84 0.00 -0.03 1.22 3.02 -0.34 -2.76 115.26 111.53 1q23 n ASN 68 Ca 0.11 -1.71 0.01 0.00 -0.03 0.00 0.00 54.58 52.95 1q23 n ASN 68 Cb 0.26 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 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 -0.60 2.37 -3.63 5.41 0.00 -0.92 -4.96 120.51 118.18 1q23 n ALA 69 Ca 0.05 -0.34 -0.28 0.00 0.00 0.00 0.00 53.44 52.87 1q23 n ALA 69 Cb 0.02 -0.04 -0.16 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.46 0.59 0.25 0.00 3.76 -1.11 -5.03 115.29 113.28 1q23 s HIS 70 Ca 0.01 -0.75 0.30 0.00 -0.15 0.00 0.00 55.06 54.47 1q23 s HIS 70 Cb 0.01 -0.94 1.34 0.00 1.11 0.00 0.00 32.58 34.11 1q23 s HIS 70 CO 0.02 -0.66 1.99 -1.00 -0.85 0.00 0.00 174.74 174.24 1q23 h PRO 71 N 8.34 0.00 0.00 8.40 0.13 -1.91 -2.09 132.00 144.87 1q23 h PRO 71 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1q23 h PRO 71 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1q23 h PRO 71 CO 0.36 0.10 0.00 -0.85 -0.23 0.00 0.00 178.00 177.39 1q23 n GLU 72 N -3.33 0.02 0.00 0.86 0.00 -1.26 -0.29 120.64 116.65 1q23 n GLU 72 Ca -0.01 0.36 0.10 0.00 0.00 0.00 0.00 57.16 57.62 1q23 n GLU 72 Cb 0.31 -1.50 0.04 0.00 0.00 0.00 0.00 31.44 30.29 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 -1.40 0.00 -1.21 -1.84 3.01 -0.78 -4.37 117.46 110.87 1q23 n PHE 73 Ca 0.01 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.56 1q23 n PHE 73 Cb 0.03 0.00 0.16 0.00 -0.01 0.00 0.00 39.48 39.66 1q23 n PHE 73 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1q23 n ARG 74 N 0.55 1.39 -2.49 -1.08 1.74 0.61 -4.54 116.66 112.82 1q23 n ARG 74 Ca 0.10 -2.77 -0.32 0.00 -0.77 0.00 0.00 57.85 54.09 1q23 n ARG 74 Cb 0.47 -1.54 -0.04 0.00 -1.02 0.00 0.00 32.46 30.33 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 -2.97 3.93 0.03 5.56 -1.94 -1.15 -1.12 119.30 121.63 1q23 s MET 75 Ca 0.34 0.87 -0.20 0.00 -1.71 0.00 0.00 55.69 55.00 1q23 s MET 75 Cb 0.30 -2.18 0.04 0.00 2.01 0.00 0.00 34.83 35.00 1q23 s MET 75 CO 0.01 -0.22 0.44 0.00 -0.01 0.00 0.00 175.02 175.24 1q23 s ALA 76 N -2.56 -1.11 -0.00 3.03 0.00 -0.70 -4.51 121.76 115.91 1q23 s ALA 76 Ca 0.58 0.44 -0.18 0.00 0.00 0.00 0.00 51.96 52.79 1q23 s ALA 76 Cb -0.10 0.31 -0.06 0.00 0.00 0.00 0.00 23.12 23.27 1q23 s ALA 76 CO 0.31 -0.44 0.51 -1.64 0.00 0.00 0.00 175.76 174.49 1q23 s MET 77 N -2.29 4.17 -0.23 0.00 -1.94 -1.26 -0.90 119.30 116.85 1q23 s MET 77 Ca -0.06 0.58 -0.03 0.00 -1.71 0.00 0.00 55.69 54.47 1q23 s MET 77 Cb -0.01 -3.29 0.12 0.00 2.01 0.00 0.00 34.83 33.65 1q23 s MET 77 CO -0.01 0.50 0.30 0.21 -0.01 0.00 0.00 175.02 176.01 1q23 s LYS 78 N -0.56 0.28 -1.70 2.03 2.47 -0.05 -4.85 119.74 117.36 1q23 s LYS 78 Ca 0.27 0.29 -0.18 0.00 -1.56 0.00 0.00 55.97 54.79 1q23 s LYS 78 Cb -0.18 -0.83 0.15 0.00 -1.46 0.00 0.00 37.83 35.52 1q23 s LYS 78 CO 0.15 -0.71 0.79 -0.25 0.16 0.00 0.00 175.35 175.50 1q23 n ASP 79 N 5.34 -3.32 0.00 1.43 10.43 -1.26 -0.46 116.55 128.70 1q23 n ASP 79 Ca -0.04 -1.00 0.00 0.00 2.57 0.00 0.00 54.79 56.31 1q23 n ASP 79 Cb 0.49 -2.80 0.00 0.00 1.84 0.00 0.00 41.12 40.65 1q23 n ASP 79 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1q23 n GLY 80 N -1.42 1.08 3.49 0.44 0.00 -1.26 -5.05 105.19 102.48 1q23 n GLY 80 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.61 2.92 0.10 1.61 0.41 0.39 -5.09 118.70 118.43 1q23 s GLU 81 Ca 0.00 -0.62 -0.31 0.00 -0.41 0.00 0.00 54.97 53.63 1q23 s GLU 81 Cb 0.00 -2.57 -0.10 0.00 -1.78 0.00 0.00 34.13 29.68 1q23 s GLU 81 CO 0.00 0.50 1.87 -1.17 -0.49 0.00 0.00 175.26 175.98 1q23 s LEU 82 N -0.39 4.41 0.14 1.80 2.96 -1.26 -0.87 118.68 125.47 1q23 s LEU 82 Ca 0.05 2.73 0.06 0.00 -0.22 0.00 0.00 54.13 56.75 1q23 s LEU 82 Cb -0.12 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1q23 s LEU 82 CO 0.02 -1.02 -0.13 -0.69 -1.32 0.00 0.00 176.35 173.21 1q23 s VAL 83 N 3.27 1.33 -0.11 1.68 1.01 -0.07 -1.16 120.40 126.35 1q23 s VAL 83 Ca 0.83 -1.91 0.01 0.00 0.00 0.00 0.00 61.98 60.92 1q23 s VAL 83 Cb -0.45 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.24 1q23 s VAL 83 CO 0.38 -0.56 -0.13 -0.63 0.00 0.00 0.00 175.10 174.16 1q23 s ILE 84 N -2.67 1.35 0.37 2.22 1.01 0.47 -1.72 121.20 122.23 1q23 s ILE 84 Ca 0.14 -0.54 -0.26 0.00 0.00 0.00 0.00 60.65 59.98 1q23 s ILE 84 Cb -0.02 -1.26 -0.09 0.00 0.01 0.00 0.00 42.46 41.10 1q23 s ILE 84 CO 0.03 0.41 1.17 0.26 0.00 0.00 0.00 174.94 176.82 1q23 s TRP 85 N 1.18 3.16 0.32 3.97 0.23 -0.28 0.12 118.94 127.64 1q23 s TRP 85 Ca -0.03 1.56 0.04 0.00 -2.03 0.00 0.00 56.10 55.64 1q23 s TRP 85 Cb -0.14 -3.41 0.66 0.00 0.03 0.00 0.00 33.47 30.60 1q23 s TRP 85 CO -0.04 -1.25 1.87 -0.44 0.96 0.00 0.00 176.95 178.05 1q23 h ASP 86 N 2.94 0.81 -4.07 2.95 3.45 -1.30 -3.45 116.42 117.77 1q23 h ASP 86 Ca -0.48 0.04 -0.15 0.00 0.43 0.00 0.00 57.03 56.87 1q23 h ASP 86 Cb 1.23 -0.13 -0.24 0.00 -0.56 0.00 0.00 39.33 39.63 1q23 h ASP 86 CO 0.64 0.45 -0.37 -0.55 -1.57 0.00 0.00 179.24 177.84 1q23 s SER 87 N -5.80 -0.27 0.05 6.45 0.15 -1.26 -5.06 113.70 107.96 1q23 s SER 87 Ca -0.11 0.47 0.09 0.00 0.70 0.00 0.00 55.95 57.11 1q23 s SER 87 Cb 0.22 0.54 -0.03 0.00 -1.71 0.00 0.00 66.02 65.03 1q23 s SER 87 CO 0.80 -0.17 -0.26 0.68 1.20 0.00 0.00 173.24 175.49 1q23 s VAL 88 N -0.14 2.14 -0.00 4.45 -7.23 -1.26 -4.88 120.40 113.47 1q23 s VAL 88 Ca -0.03 -1.40 0.01 0.00 -1.81 0.00 0.00 61.98 58.76 1q23 s VAL 88 Cb -0.03 -1.83 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 1q23 s VAL 88 CO 0.01 0.36 -0.00 -1.00 -0.31 0.00 0.00 175.10 174.15 1q23 s HIS 89 N -0.81 3.07 0.18 2.82 3.76 -0.42 -4.62 115.29 119.26 1q23 s HIS 89 Ca 0.12 0.08 -0.30 0.00 -0.15 0.00 0.00 55.06 54.80 1q23 s HIS 89 Cb -0.10 -1.67 -0.08 0.00 1.11 0.00 0.00 32.58 31.84 1q23 s HIS 89 CO 0.02 0.46 1.25 -1.25 -0.85 0.00 0.00 174.74 174.37 1q23 s PRO 90 N -1.54 4.44 -0.31 8.40 0.04 -1.22 -1.49 135.00 143.31 1q23 s PRO 90 Ca 0.19 1.95 -0.00 0.00 0.04 0.00 0.00 61.00 63.18 1q23 s PRO 90 Cb -0.11 -3.23 0.06 0.00 0.04 0.00 0.00 34.50 31.26 1q23 s PRO 90 CO 0.10 -0.19 0.00 0.00 0.04 0.00 0.00 177.00 176.96 1q23 s TYR 92 N 1.17 2.45 0.08 0.00 -0.85 -0.95 -0.12 117.35 119.13 1q23 s TYR 92 Ca -0.03 -0.31 -0.22 0.00 -0.52 0.00 0.00 57.07 55.99 1q23 s TYR 92 Cb -0.20 -1.11 -0.07 0.00 0.38 0.00 0.00 41.96 40.96 1q23 s TYR 92 CO -0.03 0.66 0.67 0.95 -1.52 0.00 0.00 175.55 176.29 1q23 s THR 93 N -2.45 4.66 -0.07 -3.49 -4.23 -0.86 -2.26 115.64 106.93 1q23 s THR 93 Ca 0.31 1.45 0.02 0.00 -1.18 0.00 0.00 61.69 62.28 1q23 s THR 93 Cb -0.05 -4.02 -0.03 0.00 1.34 0.00 0.00 72.50 69.75 1q23 s THR 93 CO 0.17 0.48 -0.11 0.54 -0.54 0.00 0.00 174.62 175.17 1q23 s VAL 94 N -0.75 3.35 -0.19 2.29 0.11 0.21 -4.79 120.40 120.63 1q23 s VAL 94 Ca 0.33 -0.60 -0.06 0.00 -2.93 0.00 0.00 61.98 58.72 1q23 s VAL 94 Cb -0.21 -2.36 -0.03 0.00 -1.53 0.00 0.00 36.38 32.26 1q23 s VAL 94 CO 0.22 0.58 0.03 0.12 -3.33 0.00 0.00 175.10 172.71 1q23 s PHE 95 N -0.55 3.11 -0.49 1.54 5.36 -1.26 -0.76 117.98 124.94 1q23 s PHE 95 Ca 0.08 -0.24 -0.11 0.00 -0.96 0.00 0.00 56.93 55.69 1q23 s PHE 95 Cb -0.12 -2.08 0.12 0.00 -0.34 0.00 0.00 43.02 40.60 1q23 s PHE 95 CO 0.02 -0.09 0.39 -1.01 -1.46 0.00 0.00 175.22 173.06 1q23 s HIS 96 N 0.78 3.37 0.21 10.12 3.76 0.21 -4.99 115.29 128.75 1q23 s HIS 96 Ca 0.02 -1.68 0.00 0.00 -0.15 0.00 0.00 55.06 53.25 1q23 s HIS 96 Cb -0.14 -3.56 0.17 0.00 1.11 0.00 0.00 32.58 30.16 1q23 s HIS 96 CO 0.02 -0.99 1.52 1.05 -0.85 0.00 0.00 174.74 175.49 1q23 h GLU 97 N 8.58 0.40 -0.73 1.40 4.11 -1.97 -0.56 114.58 125.80 1q23 h GLU 97 Ca -0.24 -0.27 0.11 0.00 0.07 0.00 0.00 59.36 59.04 1q23 h GLU 97 Cb 1.08 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.29 1q23 h GLU 97 CO 0.91 0.87 0.34 1.96 0.07 0.00 0.00 179.01 183.17 1q23 h GLN 98 N 0.30 0.54 -0.10 1.06 1.08 -1.95 -2.46 115.11 113.59 1q23 h GLN 98 Ca -0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1q23 h GLN 98 Cb 1.12 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.42 1q23 h GLN 98 CO 0.10 0.36 0.00 0.25 -0.95 0.00 0.00 178.83 178.59 1q23 n THR 99 N -4.90 0.11 -3.94 -0.54 -2.24 -1.16 -4.98 114.28 96.63 1q23 n THR 99 Ca 0.12 -0.55 -0.26 0.00 -2.27 0.00 0.00 64.05 61.09 1q23 n THR 99 Cb 0.32 1.35 -0.01 0.00 -2.10 0.00 0.00 70.33 69.90 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 1.26 -3.60 -4.49 -0.78 1.02 -0.26 -5.00 120.64 108.80 1q23 n GLU 100 Ca 0.14 0.44 -0.23 0.00 -0.02 0.00 0.00 57.16 57.49 1q23 n GLU 100 Cb 0.55 -4.70 -0.10 0.00 -0.02 0.00 0.00 31.44 27.17 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 -3.85 1.27 0.06 2.62 -4.23 -0.97 -4.99 115.64 105.55 1q23 s THR 101 Ca 0.08 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.61 1q23 s THR 101 Cb -0.04 -2.77 -0.03 0.00 1.34 0.00 0.00 72.50 71.00 1q23 s THR 101 CO 0.88 0.00 -0.07 0.72 -0.54 0.00 0.00 174.62 175.61 1q23 s PHE 102 N -3.19 0.72 0.08 3.99 -0.12 -1.26 0.68 117.98 118.89 1q23 s PHE 102 Ca 0.34 -0.63 0.09 0.00 -0.05 0.00 0.00 56.93 56.69 1q23 s PHE 102 Cb 0.08 -0.43 -0.03 0.00 -0.63 0.00 0.00 43.02 42.01 1q23 s PHE 102 CO 0.15 -0.11 -0.25 -1.12 -0.05 0.00 0.00 175.22 173.85 1q23 s SER 103 N -2.01 2.99 -0.45 1.98 0.01 0.06 -4.72 113.70 111.57 1q23 s SER 103 Ca -0.04 -0.65 -0.16 0.00 1.31 0.00 0.00 55.95 56.42 1q23 s SER 103 Cb -0.05 -0.22 0.05 0.00 0.21 0.00 0.00 66.02 66.00 1q23 s SER 103 CO -0.01 0.18 0.38 -0.44 0.41 0.00 0.00 173.24 173.75 1q23 s SER 104 N -1.63 6.14 0.03 2.44 0.01 0.00 0.64 113.70 121.33 1q23 s SER 104 Ca 0.11 -1.10 0.04 0.00 1.31 0.00 0.00 55.95 56.32 1q23 s SER 104 Cb -0.10 -2.18 -0.03 0.00 0.21 0.00 0.00 66.02 63.91 1q23 s SER 104 CO 0.04 -0.58 -0.09 -1.48 0.41 0.00 0.00 173.24 171.54 1q23 s LEU 105 N 1.75 3.07 0.07 2.44 2.34 -0.96 -4.25 118.68 123.15 1q23 s LEU 105 Ca 0.06 -0.22 0.01 0.00 0.06 0.00 0.00 54.13 54.03 1q23 s LEU 105 Cb -0.21 -1.79 -0.04 0.00 -0.56 0.00 0.00 46.19 43.59 1q23 s LEU 105 CO 0.09 0.26 0.20 -1.66 -1.06 0.00 0.00 176.35 174.17 1q23 s TRP 106 N -1.03 3.47 -0.00 3.48 1.48 -1.26 -2.23 118.94 122.84 1q23 s TRP 106 Ca 0.18 0.21 0.06 0.00 -1.06 0.00 0.00 56.10 55.49 1q23 s TRP 106 Cb -0.11 -1.73 -0.02 0.00 -1.16 0.00 0.00 33.47 30.45 1q23 s TRP 106 CO 0.08 0.57 -0.19 -1.12 -4.06 0.00 0.00 176.95 172.24 1q23 s SER 107 N -2.55 2.24 -0.06 -2.66 0.01 -1.01 -4.98 113.70 104.69 1q23 s SER 107 Ca 0.34 -0.37 -0.31 0.00 1.31 0.00 0.00 55.95 56.91 1q23 s SER 107 Cb -0.13 -0.24 -0.10 0.00 0.21 0.00 0.00 66.02 65.77 1q23 s SER 107 CO 0.27 0.22 1.99 1.21 0.41 0.00 0.00 173.24 177.34 1q23 n GLU 108 N 2.47 2.43 -1.72 12.44 2.13 -1.26 -3.40 120.64 133.73 1q23 n GLU 108 Ca -0.15 0.86 -0.43 0.00 0.66 0.00 0.00 57.16 58.10 1q23 n GLU 108 Cb 0.53 -2.89 -0.02 0.00 0.27 0.00 0.00 31.44 29.33 1q23 n GLU 108 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1q23 n TYR 109 N 7.91 2.62 -3.99 4.31 9.36 -1.26 -4.94 117.16 131.17 1q23 n TYR 109 Ca 0.23 0.30 -0.16 0.00 3.32 0.00 0.00 57.90 61.59 1q23 n TYR 109 Cb 0.37 -2.56 -0.15 0.00 -0.63 0.00 0.00 39.34 36.36 1q23 n TYR 109 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 1q23 s HIS 110 N 0.08 0.30 -0.12 2.98 5.65 -1.26 -5.04 115.29 117.88 1q23 s HIS 110 Ca 0.66 -0.03 0.30 0.00 0.25 0.00 0.00 55.06 56.24 1q23 s HIS 110 Cb -0.55 -0.30 1.23 0.00 -1.18 0.00 0.00 32.58 31.78 1q23 s HIS 110 CO 0.48 -0.07 1.88 0.38 -0.65 0.00 0.00 174.74 176.76 1q23 h ASP 111 N 6.69 0.00 -3.54 9.88 2.03 -1.99 -3.41 116.42 126.08 1q23 h ASP 111 Ca -0.35 0.00 -0.62 0.00 -0.73 0.00 0.00 57.03 55.33 1q23 h ASP 111 Cb 1.16 0.00 -0.12 0.00 -0.83 0.00 0.00 39.33 39.54 1q23 h ASP 111 CO 0.49 0.00 0.19 -0.62 -1.03 0.00 0.00 179.24 178.27 1q23 s ASP 112 N -5.14 6.49 0.24 4.15 -1.08 -1.26 -4.95 116.67 115.12 1q23 s ASP 112 Ca 0.02 0.32 -0.09 0.00 -0.52 0.00 0.00 52.55 52.28 1q23 s ASP 112 Cb 0.09 -2.34 0.40 0.00 -1.46 0.00 0.00 42.92 39.60 1q23 s ASP 112 CO 0.49 -0.57 1.62 0.15 0.52 0.00 0.00 175.17 177.37 1q23 h PHE 113 N 8.34 -0.22 -0.28 -5.34 3.57 -1.98 0.18 116.94 121.20 1q23 h PHE 113 Ca -0.26 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.29 1q23 h PHE 113 Cb 1.11 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 1q23 h PHE 113 CO 0.76 -0.30 0.14 0.00 -2.23 0.00 0.00 178.31 176.69 1q23 h ARG 114 N 0.05 0.39 -0.86 1.11 3.08 -1.95 0.69 114.38 116.89 1q23 h ARG 114 Ca 0.40 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.38 1q23 h ARG 114 Cb 0.67 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.61 1q23 h ARG 114 CO -0.74 0.37 0.47 1.96 -1.07 0.00 0.00 179.97 180.96 1q23 h GLN 115 N 0.32 1.21 -0.21 0.04 1.08 -1.69 0.06 115.11 115.92 1q23 h GLN 115 Ca 0.10 -0.14 -0.10 0.00 -1.45 0.00 0.00 58.65 57.06 1q23 h GLN 115 Cb 0.09 -0.24 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1q23 h GLN 115 CO -0.01 0.88 -0.24 0.35 -0.95 0.00 0.00 178.83 178.86 1q23 h PHE 116 N 1.21 0.65 -0.94 2.96 3.57 0.45 -1.33 116.94 123.51 1q23 h PHE 116 Ca 0.30 -0.20 0.10 0.00 3.53 0.00 0.00 57.97 61.70 1q23 h PHE 116 Cb 0.03 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 38.56 1q23 h PHE 116 CO 0.01 0.90 0.60 1.25 -2.23 0.00 0.00 178.31 178.84 1q23 h LEU 117 N 0.22 0.87 -0.40 0.59 6.46 0.49 0.15 115.31 123.69 1q23 h LEU 117 Ca 0.03 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1q23 h LEU 117 Cb 0.80 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.56 1q23 h LEU 117 CO 0.06 0.50 0.18 -0.74 -0.62 0.00 0.00 178.44 177.82 1q23 h HIS 118 N 0.96 0.59 -0.51 1.25 2.76 -0.53 0.44 115.15 120.11 1q23 h HIS 118 Ca 0.44 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.54 1q23 h HIS 118 Cb 0.40 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 1q23 h HIS 118 CO -0.00 0.50 0.17 0.82 -1.30 0.00 0.00 177.93 178.12 1q23 h ILE 119 N 0.50 1.23 -0.37 6.26 5.03 -0.57 -2.82 117.51 126.77 1q23 h ILE 119 Ca 0.14 -0.75 0.08 0.00 -0.12 0.00 0.00 64.86 64.20 1q23 h ILE 119 Cb 0.15 0.76 -0.08 0.00 -3.03 0.00 0.00 36.82 34.62 1q23 h ILE 119 CO -0.01 0.28 -0.18 0.22 -0.68 0.00 0.00 178.15 177.77 1q23 h TYR 120 N 0.69 -0.46 -0.32 1.37 3.20 -0.48 0.15 116.97 121.13 1q23 h TYR 120 Ca 0.16 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1q23 h TYR 120 Cb 0.26 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 1q23 h TYR 120 CO 0.01 -0.26 -0.07 0.77 -1.64 0.00 0.00 178.16 176.97 1q23 h SER 121 N -0.12 0.49 0.18 -2.11 0.02 -0.80 -0.43 113.55 110.78 1q23 h SER 121 Ca 0.18 -0.11 -0.17 0.00 -0.84 0.00 0.00 61.79 60.85 1q23 h SER 121 Cb 0.40 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1q23 h SER 121 CO -0.45 0.61 -0.64 -0.61 -1.14 0.00 0.00 176.83 174.61 1q23 h GLN 122 N 0.48 0.44 -0.08 3.45 5.75 -1.24 -1.29 115.11 122.62 1q23 h GLN 122 Ca 0.10 -0.32 -0.16 0.00 -0.15 0.00 0.00 58.65 58.12 1q23 h GLN 122 Cb 0.43 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 1q23 h GLN 122 CO 0.02 0.94 -0.65 -0.44 -2.65 0.00 0.00 178.83 176.04 1q23 h ASP 123 N 0.32 0.38 0.47 -0.69 3.32 -0.05 -2.28 116.42 117.89 1q23 h ASP 123 Ca -0.01 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 1q23 h ASP 123 Cb 1.19 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1q23 h ASP 123 CO 0.11 0.93 -0.22 0.58 -1.72 0.00 0.00 179.24 178.92 1q23 h VAL 124 N 0.24 0.00 -1.32 -1.35 2.07 -1.03 -2.25 116.25 112.60 1q23 h VAL 124 Ca -0.01 -0.24 0.47 0.00 0.82 0.00 0.00 66.70 67.73 1q23 h VAL 124 Cb 1.19 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.82 1q23 h VAL 124 CO 0.11 0.00 0.83 0.00 0.02 0.00 0.00 177.57 178.53 1q23 n ALA 125 N -2.50 1.31 -0.07 1.67 0.00 -0.49 0.22 120.51 120.64 1q23 n ALA 125 Ca -0.08 0.88 -0.08 0.00 0.00 0.00 0.00 53.44 54.17 1q23 n ALA 125 Cb 0.25 -1.05 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 1q23 n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q23 n TYR 127 N -4.62 0.15 0.29 0.00 4.01 -0.85 -4.63 117.16 111.52 1q23 n TYR 127 Ca -0.11 -0.08 0.16 0.00 -0.16 0.00 0.00 57.90 57.72 1q23 n TYR 127 Cb 0.30 0.00 0.94 0.00 -0.31 0.00 0.00 39.34 40.27 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 4.67 0.00 -2.07 2.72 0.00 0.25 -2.06 103.07 106.58 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 0.00 1.18 0.00 0.00 0.00 176.54 177.72 1q23 n GLU 129 N -3.78 2.87 -2.73 4.80 -0.58 -1.26 -4.95 120.64 115.01 1q23 n GLU 129 Ca -0.03 -2.42 -0.42 0.00 -0.42 0.00 0.00 57.16 53.88 1q23 n GLU 129 Cb 0.10 -1.47 -0.03 0.00 -0.57 0.00 0.00 31.44 29.47 1q23 n GLU 129 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1q23 s ASN 130 N -1.02 7.31 0.00 1.62 3.84 -0.78 -4.96 114.94 120.95 1q23 s ASN 130 Ca 0.38 1.59 0.17 0.00 0.21 0.00 0.00 52.86 55.20 1q23 s ASN 130 Cb 0.20 -2.56 0.50 0.00 -0.55 0.00 0.00 41.25 38.85 1q23 s ASN 130 CO 0.24 -0.31 1.40 0.18 -2.79 0.00 0.00 177.10 175.83 1q23 n LEU 131 N 4.24 2.27 -4.67 3.21 4.77 -1.26 -4.86 117.00 120.70 1q23 n LEU 131 Ca 0.06 -1.07 -0.39 0.00 -0.03 0.00 0.00 56.01 54.59 1q23 n LEU 131 Cb 0.50 -0.23 0.04 0.00 -2.33 0.00 0.00 43.42 41.40 1q23 n LEU 131 CO 0.52 0.53 0.73 0.00 -1.33 0.00 0.00 177.39 177.84 1q23 n ALA 132 N 0.73 0.75 -0.15 -1.18 0.00 -1.26 -4.90 120.51 114.49 1q23 n ALA 132 Ca 0.16 0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.59 1q23 n ALA 132 Cb 0.38 -2.20 -0.01 0.00 0.00 0.00 0.00 19.45 17.62 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 1.06 0.81 -3.15 0.00 3.20 -1.90 -3.34 116.97 113.64 1q23 h TYR 133 Ca -0.49 -0.13 -0.64 0.00 3.14 0.00 0.00 58.73 60.61 1q23 h TYR 133 Cb 1.34 -0.21 -0.41 0.00 1.54 0.00 0.00 36.73 38.98 1q23 h TYR 133 CO 0.42 0.80 -0.48 -0.06 -1.64 0.00 0.00 178.16 177.19 1q23 s PHE 134 N -5.05 3.62 0.11 -3.82 0.40 -1.26 -0.82 117.98 111.15 1q23 s PHE 134 Ca -0.13 -3.27 -0.28 0.00 -0.60 0.00 0.00 56.93 52.65 1q23 s PHE 134 Cb 0.11 -2.83 -0.10 0.00 0.51 0.00 0.00 43.02 40.71 1q23 s PHE 134 CO 0.80 -0.59 1.63 -1.35 0.70 0.00 0.00 175.22 176.40 1q23 h PRO 135 N 5.59 -0.54 0.00 0.24 0.11 -1.74 0.81 132.00 136.48 1q23 h PRO 135 Ca 0.13 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1q23 h PRO 135 Cb 0.77 0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1q23 h PRO 135 CO 0.74 -0.36 0.00 1.63 -0.21 0.00 0.00 178.00 179.80 1q23 n LYS 136 N -5.40 0.79 -0.32 1.05 5.02 -1.26 -5.00 118.16 113.03 1q23 n LYS 136 Ca -0.08 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.26 1q23 n LYS 136 Cb 0.31 -1.15 -0.01 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 0.37 -1.54 3.12 0.72 0.00 0.28 -4.89 105.19 103.25 1q23 n GLY 137 Ca 0.06 -1.45 -0.31 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.47 2.41 0.41 1.61 -0.12 -1.26 -4.80 117.98 114.76 1q23 s PHE 138 Ca 0.00 -1.21 -0.02 0.00 -0.05 0.00 0.00 56.93 55.66 1q23 s PHE 138 Cb 0.00 -1.67 -0.03 0.00 -0.63 0.00 0.00 43.02 40.69 1q23 s PHE 138 CO 0.00 -0.58 0.65 0.96 -0.05 0.00 0.00 175.22 176.20 1q23 s ILE 139 N 0.92 4.91 0.01 -4.49 -4.36 -1.26 -5.03 121.20 111.91 1q23 s ILE 139 Ca -0.06 -0.23 0.22 0.00 -0.26 0.00 0.00 60.65 60.32 1q23 s ILE 139 Cb -0.15 -3.82 0.21 0.00 1.25 0.00 0.00 42.46 39.95 1q23 s ILE 139 CO -0.03 -0.64 1.72 -0.33 0.24 0.00 0.00 174.94 175.91 1q23 h GLU 140 N 0.52 0.00 -2.76 0.37 5.08 -2.02 -3.36 114.58 112.40 1q23 h GLU 140 Ca -0.48 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.25 1q23 h GLU 140 Cb 1.22 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.06 1q23 h GLU 140 CO 0.61 0.26 -0.48 0.27 -1.00 0.00 0.00 179.01 178.67 1q23 n ASN 141 N -3.32 3.56 -4.25 1.42 6.94 -1.26 -5.03 115.26 113.33 1q23 n ASN 141 Ca 0.01 -3.30 -0.21 0.00 -0.02 0.00 0.00 54.58 51.05 1q23 n ASN 141 Cb 0.51 -0.77 -0.12 0.00 -2.36 0.00 0.00 39.78 37.03 1q23 n ASN 141 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1q23 s MET 142 N -1.90 1.04 0.29 -3.83 0.23 -1.26 -1.29 119.30 112.57 1q23 s MET 142 Ca 0.31 -1.15 0.09 0.00 -1.03 0.00 0.00 55.69 53.91 1q23 s MET 142 Cb 0.03 -1.14 -0.04 0.00 -1.53 0.00 0.00 34.83 32.15 1q23 s MET 142 CO -0.10 0.25 0.06 -0.59 -2.03 0.00 0.00 175.02 172.61 1q23 s PHE 143 N -1.48 2.74 -0.04 3.16 -0.12 -0.56 -4.71 117.98 116.98 1q23 s PHE 143 Ca 0.06 -0.26 0.02 0.00 -0.05 0.00 0.00 56.93 56.70 1q23 s PHE 143 Cb -0.09 -1.35 -0.03 0.00 -0.63 0.00 0.00 43.02 40.92 1q23 s PHE 143 CO 0.04 0.53 -0.07 -0.06 -0.05 0.00 0.00 175.22 175.60 1q23 s PHE 144 N -2.34 2.91 -0.07 3.49 0.40 -0.27 0.83 117.98 122.92 1q23 s PHE 144 Ca 0.33 -0.01 -0.01 0.00 -0.60 0.00 0.00 56.93 56.64 1q23 s PHE 144 Cb -0.05 -1.66 0.03 0.00 0.51 0.00 0.00 43.02 41.84 1q23 s PHE 144 CO 0.21 0.34 -0.00 0.08 0.70 0.00 0.00 175.22 176.56 1q23 s VAL 145 N -0.89 0.39 -0.15 -0.44 1.01 0.83 -1.58 120.40 119.57 1q23 s VAL 145 Ca 0.14 0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 1q23 s VAL 145 Cb -0.11 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.68 1q23 s VAL 145 CO 0.04 0.26 0.19 -0.94 0.00 0.00 0.00 175.10 174.65 1q23 s SER 146 N 1.94 6.37 -0.40 3.32 1.04 -0.20 -2.03 113.70 123.73 1q23 s SER 146 Ca 0.05 0.43 -0.19 0.00 0.48 0.00 0.00 55.95 56.71 1q23 s SER 146 Cb -0.12 -2.11 0.01 0.00 0.10 0.00 0.00 66.02 63.90 1q23 s SER 146 CO -0.05 0.26 0.56 0.00 0.98 0.00 0.00 173.24 175.00 1q23 s ALA 147 N -0.25 3.41 -0.72 5.32 0.00 -1.26 0.30 121.76 128.57 1q23 s ALA 147 Ca 0.13 -1.16 0.04 0.00 0.00 0.00 0.00 51.96 50.98 1q23 s ALA 147 Cb -0.12 -3.15 0.21 0.00 0.00 0.00 0.00 23.12 20.05 1q23 s ALA 147 CO 0.03 -1.52 0.65 -1.71 0.00 0.00 0.00 175.76 173.20 1q23 n ASN 148 N 5.96 3.52 0.00 0.00 4.05 0.29 -4.94 115.26 124.14 1q23 n ASN 148 Ca -0.04 -3.30 0.14 0.00 0.45 0.00 0.00 54.58 51.84 1q23 n ASN 148 Cb 0.48 -0.77 0.79 0.00 1.23 0.00 0.00 39.78 41.51 1q23 n ASN 148 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1q23 n PRO 149 N 1.57 0.68 0.09 1.20 -0.04 -1.26 -3.13 135.00 134.10 1q23 n PRO 149 Ca 0.24 0.01 -0.15 0.00 -0.04 0.00 0.00 63.50 63.56 1q23 n PRO 149 Cb 0.37 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.24 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 0.53 -3.80 0.54 6.55 -1.94 -3.40 115.95 114.44 1q23 h TRP 150 Ca 0.00 -0.34 -0.68 0.00 0.95 0.00 0.00 58.89 58.81 1q23 h TRP 150 Cb 0.12 -0.04 -0.30 0.00 -0.86 0.00 0.00 29.16 28.08 1q23 h TRP 150 CO 0.00 1.22 -0.85 0.08 -1.05 0.00 0.00 178.44 177.84 1q23 s VAL 151 N -2.92 2.34 -1.23 1.49 1.01 -1.24 -4.86 120.40 114.99 1q23 s VAL 151 Ca -0.05 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.88 1q23 s VAL 151 Cb 0.08 -1.89 0.18 0.00 0.00 0.00 0.00 36.38 34.75 1q23 s VAL 151 CO 0.87 0.56 1.65 -1.20 0.00 0.00 0.00 175.10 176.98 1q23 n SER 152 N 3.05 5.26 -4.80 3.32 7.64 -1.26 -0.91 113.62 125.92 1q23 n SER 152 Ca -0.18 -3.08 -0.34 0.00 1.01 0.00 0.00 58.87 56.28 1q23 n SER 152 Cb 0.52 -1.49 -0.04 0.00 -1.01 0.00 0.00 64.21 62.19 1q23 n SER 152 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1q23 s PHE 153 N 0.53 3.11 -1.20 1.43 -0.12 -1.26 -4.96 117.98 115.50 1q23 s PHE 153 Ca 0.40 1.60 0.22 0.00 -0.05 0.00 0.00 56.93 59.09 1q23 s PHE 153 Cb 0.04 -3.05 -0.15 0.00 -0.63 0.00 0.00 43.02 39.23 1q23 s PHE 153 CO 0.01 -0.67 0.96 0.25 -0.05 0.00 0.00 175.22 175.72 1q23 n THR 154 N -0.70 0.00 -3.93 -4.49 -2.24 -1.26 -4.69 114.28 96.97 1q23 n THR 154 Ca 0.08 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.67 1q23 n THR 154 Cb 0.52 1.01 -0.15 0.00 -2.10 0.00 0.00 70.33 69.62 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 -2.90 0.20 -0.04 3.42 0.15 -1.26 -4.84 113.70 108.43 1q23 s SER 155 Ca 0.10 -0.02 -0.01 0.00 0.70 0.00 0.00 55.95 56.72 1q23 s SER 155 Cb 0.16 -0.05 0.03 0.00 -1.71 0.00 0.00 66.02 64.45 1q23 s SER 155 CO 0.80 -0.02 0.04 0.12 1.20 0.00 0.00 173.24 175.39 1q23 s PHE 156 N 0.25 0.14 -0.05 3.44 5.36 -1.26 -5.11 117.98 120.74 1q23 s PHE 156 Ca -0.02 0.15 0.01 0.00 -0.96 0.00 0.00 56.93 56.11 1q23 s PHE 156 Cb -0.04 -0.43 0.02 0.00 -0.34 0.00 0.00 43.02 42.23 1q23 s PHE 156 CO -0.01 -0.16 -0.06 -0.51 -1.46 0.00 0.00 175.22 173.02 1q23 s ASP 157 N 1.67 1.15 -0.19 6.13 1.01 -1.26 -4.63 116.67 120.55 1q23 s ASP 157 Ca -0.01 -0.16 -0.12 0.00 0.71 0.00 0.00 52.55 52.97 1q23 s ASP 157 Cb -0.13 -0.53 -0.05 0.00 1.01 0.00 0.00 42.92 43.23 1q23 s ASP 157 CO -0.03 -0.04 0.20 -0.22 0.21 0.00 0.00 175.17 175.29 1q23 s LEU 158 N 0.90 4.20 -0.54 1.23 0.20 -1.26 -5.06 118.68 118.36 1q23 s LEU 158 Ca -0.11 0.32 0.04 0.00 0.69 0.00 0.00 54.13 55.07 1q23 s LEU 158 Cb -0.15 -2.21 0.15 0.00 -0.43 0.00 0.00 46.19 43.55 1q23 s LEU 158 CO 0.01 0.12 0.33 0.21 -0.29 0.00 0.00 176.35 176.72 1q23 s ASN 159 N 0.53 3.99 0.17 3.68 3.04 -1.26 -4.93 114.94 120.17 1q23 s ASN 159 Ca 0.11 -3.14 -0.30 0.00 0.04 0.00 0.00 52.86 49.57 1q23 s ASN 159 Cb -0.12 -1.34 -0.08 0.00 -1.54 0.00 0.00 41.25 38.17 1q23 s ASN 159 CO 0.01 -0.19 1.28 -0.69 -3.04 0.00 0.00 177.10 174.47 1q23 s VAL 160 N -0.39 3.39 0.15 -5.21 1.01 -1.26 -4.99 120.40 113.10 1q23 s VAL 160 Ca 0.21 1.11 -0.04 0.00 0.00 0.00 0.00 61.98 63.26 1q23 s VAL 160 Cb -0.17 -3.71 -0.14 0.00 0.00 0.00 0.00 36.38 32.36 1q23 s VAL 160 CO -0.06 0.15 1.37 0.00 0.00 0.00 0.00 175.10 176.56 1q23 h ALA 161 N 5.68 0.48 -3.74 5.51 0.00 -2.06 -3.40 119.26 121.72 1q23 h ALA 161 Ca -0.44 -0.65 -0.65 0.00 0.00 0.00 0.00 54.91 53.18 1q23 h ALA 161 Cb 1.21 -0.04 -0.38 0.00 0.00 0.00 0.00 17.79 18.58 1q23 h ALA 161 CO 0.78 0.78 -0.78 1.21 0.00 0.00 0.00 179.25 181.24 1q23 s ASN 162 N -7.03 4.34 -0.22 0.00 3.04 -1.26 -4.97 114.94 108.84 1q23 s ASN 162 Ca -0.06 -1.50 0.14 0.00 0.04 0.00 0.00 52.86 51.48 1q23 s ASN 162 Cb 0.10 -1.44 0.81 0.00 -1.54 0.00 0.00 41.25 39.17 1q23 s ASN 162 CO 0.86 -0.25 1.73 1.15 -3.04 0.00 0.00 177.10 177.55 1q23 n MET 163 N 4.47 4.76 -1.90 0.43 0.00 -1.26 -4.85 117.12 118.77 1q23 n MET 163 Ca -0.09 -3.10 -0.43 0.00 0.00 0.00 0.00 57.70 54.08 1q23 n MET 163 Cb 0.43 -2.23 -0.03 0.00 0.00 0.00 0.00 33.22 31.39 1q23 n MET 163 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1q23 s ASP 164 N -0.78 6.31 -1.11 3.17 1.01 -1.26 -2.28 116.67 121.74 1q23 s ASP 164 Ca 0.54 2.06 0.00 0.00 0.71 0.00 0.00 52.55 55.86 1q23 s ASP 164 Cb 0.40 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.81 1q23 s ASP 164 CO 0.17 -1.25 0.00 0.59 0.21 0.00 0.00 175.17 174.89 1q23 n ASN 165 N 8.45 -4.93 -4.50 0.27 3.02 -1.26 -4.90 115.26 111.41 1q23 n ASN 165 Ca 0.20 0.26 -0.43 0.00 -0.03 0.00 0.00 54.58 54.58 1q23 n ASN 165 Cb 0.44 -3.35 -0.02 0.00 -0.61 0.00 0.00 39.78 36.24 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 -2.16 2.94 -0.65 3.10 5.36 -0.96 -4.60 117.98 121.00 1q23 s PHE 166 Ca 0.00 -1.34 0.21 0.00 -0.96 0.00 0.00 56.93 54.84 1q23 s PHE 166 Cb 0.00 -4.48 -0.26 0.00 -0.34 0.00 0.00 43.02 37.93 1q23 s PHE 166 CO 0.00 -1.66 0.74 1.19 -1.46 0.00 0.00 175.22 174.02 1q23 n PHE 167 N 7.42 0.00 -2.07 10.12 3.72 -1.26 -4.41 117.46 130.98 1q23 n PHE 167 Ca 0.32 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.29 1q23 n PHE 167 Cb 0.49 -0.17 -0.03 0.00 -0.94 0.00 0.00 39.48 38.82 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 -3.15 3.63 0.56 4.37 0.00 -1.26 -4.73 121.76 121.17 1q23 s ALA 168 Ca 0.02 0.93 -0.21 0.00 0.00 0.00 0.00 51.96 52.71 1q23 s ALA 168 Cb 0.15 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1q23 s ALA 168 CO 0.87 -1.24 1.26 -1.25 0.00 0.00 0.00 175.76 175.41 1q23 s PRO 169 N 3.44 3.13 -0.20 0.00 0.05 -1.26 -4.84 135.00 135.32 1q23 s PRO 169 Ca 0.70 1.99 -0.02 0.00 0.05 0.00 0.00 61.00 63.72 1q23 s PRO 169 Cb -0.33 -2.13 0.01 0.00 0.05 0.00 0.00 34.50 32.10 1q23 s PRO 169 CO 0.28 -1.12 -0.11 0.08 0.05 0.00 0.00 177.00 176.18 1q23 s VAL 170 N -1.46 2.78 -0.05 -0.36 1.01 -0.97 -1.12 120.40 120.24 1q23 s VAL 170 Ca 0.73 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1q23 s VAL 170 Cb -0.34 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 1q23 s VAL 170 CO 0.39 0.47 -0.08 -0.36 0.00 0.00 0.00 175.10 175.52 1q23 s PHE 171 N 1.39 2.88 -0.10 5.22 0.40 -0.61 -0.53 117.98 126.62 1q23 s PHE 171 Ca 0.05 -0.03 -0.00 0.00 -0.60 0.00 0.00 56.93 56.35 1q23 s PHE 171 Cb -0.14 -1.67 0.02 0.00 0.51 0.00 0.00 43.02 41.75 1q23 s PHE 171 CO -0.08 0.32 -0.07 0.99 0.70 0.00 0.00 175.22 177.08 1q23 s THR 172 N -0.84 0.93 0.03 0.64 2.01 -0.53 -1.04 115.64 116.84 1q23 s THR 172 Ca 0.13 -0.25 -0.09 0.00 0.31 0.00 0.00 61.69 61.79 1q23 s THR 172 Cb -0.11 -0.96 -0.05 0.00 0.01 0.00 0.00 72.50 71.39 1q23 s THR 172 CO 0.03 0.35 0.34 -0.04 -0.69 0.00 0.00 174.62 174.61 1q23 s MET 173 N 1.57 3.71 0.52 4.92 1.00 0.15 -1.34 119.30 129.83 1q23 s MET 173 Ca 0.02 0.12 0.08 0.00 0.00 0.00 0.00 55.69 55.90 1q23 s MET 173 Cb -0.13 -3.08 0.08 0.00 0.00 0.00 0.00 34.83 31.70 1q23 s MET 173 CO -0.06 0.63 0.64 0.41 0.00 0.00 0.00 175.02 176.64 1q23 n GLY 174 N 1.21 2.17 3.69 -0.03 0.00 0.62 -0.55 105.19 112.30 1q23 n GLY 174 Ca -0.11 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.26 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 -4.32 4.39 0.82 1.61 2.20 -0.09 -4.49 119.74 119.86 1q23 s LYS 175 Ca 0.49 1.23 -0.11 0.00 -0.36 0.00 0.00 55.97 57.22 1q23 s LYS 175 Cb -0.04 -3.54 0.08 0.00 -1.51 0.00 0.00 37.83 32.82 1q23 s LYS 175 CO 0.31 -0.27 1.09 1.52 -0.36 0.00 0.00 175.35 177.64 1q23 s TYR 176 N 1.90 2.58 0.24 4.03 -0.85 -1.26 -4.25 117.35 119.73 1q23 s TYR 176 Ca 0.44 1.35 -0.15 0.00 -0.52 0.00 0.00 57.07 58.19 1q23 s TYR 176 Cb -0.18 -3.09 0.01 0.00 0.38 0.00 0.00 41.96 39.08 1q23 s TYR 176 CO 0.17 -1.97 0.52 1.52 -1.52 0.00 0.00 175.55 174.27 1q23 s TYR 177 N -2.98 0.17 -0.09 -3.49 -0.85 -0.23 -4.99 117.35 104.89 1q23 s TYR 177 Ca 0.62 -0.55 -0.15 0.00 -0.52 0.00 0.00 57.07 56.47 1q23 s TYR 177 Cb -0.17 0.31 -0.05 0.00 0.38 0.00 0.00 41.96 42.43 1q23 s TYR 177 CO 0.56 -1.01 0.36 -0.08 -1.52 0.00 0.00 175.55 173.86 1q23 s THR 178 N -3.97 5.20 -0.18 -3.49 -1.32 -1.26 -2.00 115.64 108.62 1q23 s THR 178 Ca 0.17 0.71 -0.04 0.00 -1.21 0.00 0.00 61.69 61.32 1q23 s THR 178 Cb -0.01 -3.68 0.07 0.00 -1.51 0.00 0.00 72.50 67.37 1q23 s THR 178 CO 0.06 0.46 0.14 -1.58 -2.21 0.00 0.00 174.62 171.49 1q23 s GLN 179 N -0.17 0.10 2.24 7.08 0.74 -0.14 -4.97 119.66 124.55 1q23 s GLN 179 Ca 0.21 0.06 0.00 0.00 0.05 0.00 0.00 55.36 55.68 1q23 s GLN 179 Cb -0.15 -1.51 0.00 0.00 1.10 0.00 0.00 33.01 32.46 1q23 s GLN 179 CO 0.09 -0.64 0.00 0.41 -0.55 0.00 0.00 175.29 174.59 1q23 n GLY 180 N 5.30 2.75 0.62 2.59 0.00 -1.26 -1.42 105.19 113.76 1q23 n GLY 180 Ca -0.06 0.27 0.09 0.00 0.00 0.00 0.00 46.02 46.31 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 3.88 1.83 -4.67 1.61 8.00 -1.26 -4.88 116.55 121.05 1q23 n ASP 181 Ca 0.00 -1.83 -0.30 0.00 0.71 0.00 0.00 54.79 53.36 1q23 n ASP 181 Cb 0.00 -0.17 -0.08 0.00 -0.02 0.00 0.00 41.12 40.85 1q23 n ASP 181 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1q23 s LYS 182 N -1.67 2.52 -0.21 -1.24 1.02 -0.51 -5.03 119.74 114.62 1q23 s LYS 182 Ca 0.29 -0.84 -0.08 0.00 0.02 0.00 0.00 55.97 55.37 1q23 s LYS 182 Cb 0.16 -2.52 -0.04 0.00 -0.52 0.00 0.00 37.83 34.90 1q23 s LYS 182 CO 0.22 0.55 0.08 0.08 -0.92 0.00 0.00 175.35 175.36 1q23 s VAL 183 N -1.27 4.75 -0.03 3.17 1.01 -1.26 -0.96 120.40 125.80 1q23 s VAL 183 Ca 0.24 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.26 1q23 s VAL 183 Cb -0.12 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 1q23 s VAL 183 CO 0.17 0.41 -0.25 -0.76 0.00 0.00 0.00 175.10 174.66 1q23 s LEU 184 N 0.83 2.05 -0.14 3.92 1.43 -0.85 -0.09 118.68 125.83 1q23 s LEU 184 Ca 0.04 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 1q23 s LEU 184 Cb -0.13 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.77 1q23 s LEU 184 CO 0.02 0.29 -0.17 -0.32 0.23 0.00 0.00 176.35 176.40 1q23 s MET 185 N -0.44 2.57 0.28 1.70 1.75 0.85 -1.07 119.30 124.94 1q23 s MET 185 Ca 0.05 -0.68 -0.30 0.00 -1.25 0.00 0.00 55.69 53.51 1q23 s MET 185 Cb -0.11 -2.20 -0.13 0.00 2.84 0.00 0.00 34.83 35.23 1q23 s MET 185 CO 0.01 -0.13 1.46 -2.30 -0.65 0.00 0.00 175.02 173.40 1q23 n PRO 186 N 4.43 2.29 -3.62 4.11 -0.02 -1.26 -0.35 135.00 140.57 1q23 n PRO 186 Ca -0.19 0.81 -0.16 0.00 -2.02 0.00 0.00 63.50 61.94 1q23 n PRO 186 Cb 0.51 -2.50 -0.14 0.00 -0.02 0.00 0.00 33.50 31.34 1q23 n PRO 186 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1q23 s LEU 187 N -0.33 -0.14 0.17 2.45 2.96 -0.07 -0.27 118.68 123.44 1q23 s LEU 187 Ca 0.64 0.26 0.05 0.00 -0.22 0.00 0.00 54.13 54.87 1q23 s LEU 187 Cb -0.58 0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.49 1q23 s LEU 187 CO 0.52 -0.26 0.14 0.00 -1.32 0.00 0.00 176.35 175.43 1q23 s ALA 188 N 2.34 3.58 -0.09 5.97 0.00 -0.45 -0.67 121.76 132.45 1q23 s ALA 188 Ca 0.03 -1.22 -0.04 0.00 0.00 0.00 0.00 51.96 50.73 1q23 s ALA 188 Cb -0.13 -1.37 0.04 0.00 0.00 0.00 0.00 23.12 21.66 1q23 s ALA 188 CO -0.08 0.49 0.20 -1.50 0.00 0.00 0.00 175.76 174.87 1q23 s ILE 189 N -1.77 -0.04 -0.11 0.00 1.10 0.11 -1.46 121.20 119.03 1q23 s ILE 189 Ca 0.31 0.14 0.02 0.00 -0.51 0.00 0.00 60.65 60.62 1q23 s ILE 189 Cb -0.10 -0.31 -0.01 0.00 0.15 0.00 0.00 42.46 42.19 1q23 s ILE 189 CO 0.24 0.06 -0.19 -1.58 -2.11 0.00 0.00 174.94 171.36 1q23 s GLN 190 N 1.10 3.12 0.19 3.50 -0.44 0.31 -1.43 119.66 126.00 1q23 s GLN 190 Ca -0.08 -0.79 0.03 0.00 -2.50 0.00 0.00 55.36 52.02 1q23 s GLN 190 Cb -0.10 -2.43 -0.05 0.00 -1.64 0.00 0.00 33.01 28.79 1q23 s GLN 190 CO -0.07 0.24 -0.03 0.14 0.50 0.00 0.00 175.29 176.08 1q23 s VAL 191 N 0.23 0.97 0.02 1.34 -7.23 -0.92 -2.30 120.40 112.51 1q23 s VAL 191 Ca -0.12 -2.02 -0.19 0.00 -1.81 0.00 0.00 61.98 57.83 1q23 s VAL 191 Cb -0.16 -2.15 -0.06 0.00 0.56 0.00 0.00 36.38 34.57 1q23 s VAL 191 CO 0.07 -0.48 0.56 -2.28 -0.31 0.00 0.00 175.10 172.65 1q23 s HIS 192 N -3.46 3.73 0.47 2.82 2.46 -1.26 -2.46 115.29 117.58 1q23 s HIS 192 Ca 0.24 1.19 0.17 0.00 0.47 0.00 0.00 55.06 57.13 1q23 s HIS 192 Cb 0.05 -2.52 1.16 0.00 -0.13 0.00 0.00 32.58 31.13 1q23 s HIS 192 CO 0.05 0.47 2.05 1.25 -2.47 0.00 0.00 174.74 176.09 1q23 h HIS 193 N 5.14 0.00 -0.62 3.88 2.76 -1.46 -2.68 115.15 122.18 1q23 h HIS 193 Ca -0.47 0.00 0.12 0.00 -2.20 0.00 0.00 60.37 57.82 1q23 h HIS 193 Cb 1.21 0.00 -0.09 0.00 1.55 0.00 0.00 27.41 30.07 1q23 h HIS 193 CO 0.67 0.13 0.10 0.00 -1.30 0.00 0.00 177.93 177.53 1q23 h ALA 194 N 1.87 0.71 0.00 5.26 0.00 -1.78 -3.11 119.26 122.20 1q23 h ALA 194 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1q23 h ALA 194 Cb 0.25 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1q23 h ALA 194 CO 0.02 -0.33 -1.34 1.33 0.00 0.00 0.00 179.25 178.93 1q23 n VAL 195 N -5.17 0.06 -3.79 0.00 0.24 -1.11 -4.62 118.33 103.95 1q23 n VAL 195 Ca 0.09 -0.25 -0.18 0.00 -2.04 0.00 0.00 64.34 61.96 1q23 n VAL 195 Cb 0.35 0.41 -0.17 0.00 -1.47 0.00 0.00 33.84 32.95 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 1.54 5.60 0.37 0.00 -0.00 -1.26 -4.19 116.67 118.73 1q23 s ASP 197 Ca -0.03 -0.22 0.18 0.00 -0.00 0.00 0.00 52.55 52.48 1q23 s ASP 197 Cb -0.13 -0.86 1.12 0.00 -0.00 0.00 0.00 42.92 43.05 1q23 s ASP 197 CO -0.03 -0.83 1.70 1.23 -0.00 0.00 0.00 175.17 177.25 1q23 h GLY 198 N 0.49 1.61 0.74 0.21 0.00 -1.99 -2.05 103.07 102.07 1q23 h GLY 198 Ca -0.42 -0.22 0.04 0.00 0.00 0.00 0.00 47.33 46.73 1q23 h GLY 198 CO 0.49 -0.31 0.24 -2.75 0.00 0.00 0.00 176.54 174.21 1q23 h PHE 199 N 0.35 0.44 -0.55 5.60 3.04 -1.97 -0.45 116.94 123.40 1q23 h PHE 199 Ca 0.69 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.62 1q23 h PHE 199 Cb 1.70 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 40.06 1q23 h PHE 199 CO -0.01 0.21 0.22 0.45 -2.02 0.00 0.00 178.31 177.17 1q23 h HIS 200 N 0.47 0.84 -0.26 0.41 -0.00 -1.76 0.30 115.15 115.15 1q23 h HIS 200 Ca 0.21 -0.06 -0.20 0.00 -0.00 0.00 0.00 60.37 60.32 1q23 h HIS 200 Cb 0.12 -0.25 0.00 0.00 -0.00 0.00 0.00 27.41 27.28 1q23 h HIS 200 CO -0.10 0.69 -0.60 0.28 -0.00 0.00 0.00 177.93 178.19 1q23 h VAL 201 N 0.76 1.27 -0.18 2.45 2.07 -1.28 -1.40 116.25 119.94 1q23 h VAL 201 Ca 0.18 -1.79 -0.13 0.00 0.82 0.00 0.00 66.70 65.79 1q23 h VAL 201 Cb 0.20 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1q23 h VAL 201 CO -0.01 0.58 -0.44 1.23 0.02 0.00 0.00 177.57 178.94 1q23 h GLY 202 N 0.64 0.46 1.03 2.17 0.00 -0.92 0.57 103.07 107.02 1q23 h GLY 202 Ca -0.00 -0.47 -0.15 0.00 0.00 0.00 0.00 47.33 46.71 1q23 h GLY 202 CO 0.13 0.43 -0.41 -0.09 0.00 0.00 0.00 176.54 176.60 1q23 h ARG 203 N 0.35 0.76 0.02 4.80 2.43 -0.35 -1.67 114.38 120.71 1q23 h ARG 203 Ca 0.03 -0.45 -0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1q23 h ARG 203 Cb 0.91 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1q23 h ARG 203 CO 0.08 1.08 -0.01 1.98 -1.51 0.00 0.00 179.97 181.59 1q23 h MET 204 N 0.50 -0.02 -0.69 0.20 4.05 -0.71 0.45 114.93 118.71 1q23 h MET 204 Ca 0.03 0.00 0.10 0.00 -0.28 0.00 0.00 59.70 59.55 1q23 h MET 204 Cb 1.01 0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 31.74 1q23 h MET 204 CO 0.09 0.30 0.31 -0.07 0.23 0.00 0.00 176.91 177.78 1q23 h LEU 205 N -0.35 0.38 -1.02 3.39 3.38 0.09 0.73 115.31 121.90 1q23 h LEU 205 Ca -0.00 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1q23 h LEU 205 Cb 0.34 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 1q23 h LEU 205 CO 0.00 0.21 0.47 0.78 0.09 0.00 0.00 178.44 179.99 1q23 h ASN 206 N 0.53 1.03 0.32 -0.43 2.35 -1.09 -1.91 115.58 116.38 1q23 h ASN 206 Ca 0.35 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.89 1q23 h ASN 206 Cb 0.40 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1q23 h ASN 206 CO -0.29 0.82 -0.51 -0.33 -1.65 0.00 0.00 177.43 175.46 1q23 h GLU 207 N 1.16 0.21 -0.49 0.81 5.08 0.00 -2.83 114.58 118.53 1q23 h GLU 207 Ca 0.30 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1q23 h GLU 207 Cb 0.01 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1q23 h GLU 207 CO -0.05 0.67 0.26 1.25 -1.00 0.00 0.00 179.01 180.15 1q23 h LEU 208 N 0.17 0.62 0.21 1.33 5.85 -0.22 0.19 115.31 123.45 1q23 h LEU 208 Ca 0.01 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1q23 h LEU 208 Cb 0.96 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1q23 h LEU 208 CO 0.08 0.54 -0.10 -0.61 -0.34 0.00 0.00 178.44 178.01 1q23 h GLN 209 N 0.65 -0.27 -0.42 1.25 5.75 -1.29 -0.86 115.11 119.92 1q23 h GLN 209 Ca 0.17 0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.77 1q23 h GLN 209 Cb 0.06 0.06 -0.07 0.00 1.07 0.00 0.00 27.48 28.61 1q23 h GLN 209 CO -0.03 -0.16 0.01 1.96 -2.65 0.00 0.00 178.83 177.96 1q23 h GLN 210 N -0.30 0.11 -0.88 1.69 4.20 -1.33 -2.27 115.11 116.33 1q23 h GLN 210 Ca -0.03 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1q23 h GLN 210 Cb 0.23 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 1q23 h GLN 210 CO 0.05 0.07 0.55 1.88 -0.67 0.00 0.00 178.83 180.71 1q23 h TYR 211 N 0.11 1.13 -0.21 2.96 -1.99 -0.76 -1.69 116.97 116.52 1q23 h TYR 211 Ca 0.21 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 60.92 1q23 h TYR 211 Cb 0.30 -0.38 -0.01 0.00 2.00 0.00 0.00 36.73 38.64 1q23 h TYR 211 CO -0.27 0.74 0.03 0.00 -0.00 0.00 0.00 178.16 178.65 1q23 n ASP 213 N -4.73 0.64 0.00 0.00 8.00 -0.87 -3.24 116.55 116.35 1q23 n ASP 213 Ca -0.04 0.67 0.00 0.00 0.71 0.00 0.00 54.79 56.13 1q23 n ASP 213 Cb 0.20 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.50 1q23 n ASP 213 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1q23 n GLU 214 N -2.22 1.34 -2.06 -1.24 0.28 -0.67 -4.91 120.64 111.15 1q23 n GLU 214 Ca 0.02 -1.02 -0.42 0.00 -0.16 0.00 0.00 57.16 55.58 1q23 n GLU 214 Cb 0.21 -0.93 -0.03 0.00 1.43 0.00 0.00 31.44 32.13 1q23 n GLU 214 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 177.13 176.51 1q23 s TRP 215 N -0.55 3.12 -1.88 -1.84 -0.00 -0.78 -5.04 118.94 111.97 1q23 s TRP 215 Ca 0.00 0.94 0.15 0.00 -0.00 0.00 0.00 56.10 57.19 1q23 s TRP 215 Cb 0.00 -3.78 0.12 0.00 -0.00 0.00 0.00 33.47 29.81 1q23 s TRP 215 CO 0.00 -2.66 0.98 1.04 -0.00 0.00 0.00 176.95 176.31