#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q23 s GLY 7 N 0.00 1.61 0.18 3.41 0.00 -1.26 -5.01 107.32 106.25 1q23 s GLY 7 Ca 0.00 -0.39 -0.23 0.00 0.00 0.00 0.00 44.72 44.10 1q23 s GLY 7 CO 0.00 -0.09 0.63 -2.52 0.00 0.00 0.00 173.10 171.12 1q23 s TYR 8 N -3.16 -0.46 -0.16 1.90 -0.85 -1.26 -2.52 117.35 110.84 1q23 s TYR 8 Ca 0.55 0.20 -0.03 0.00 -0.52 0.00 0.00 57.07 57.28 1q23 s TYR 8 Cb -0.11 0.59 -0.02 0.00 0.38 0.00 0.00 41.96 42.80 1q23 s TYR 8 CO 0.50 -0.92 -0.07 -0.08 -1.52 0.00 0.00 175.55 173.46 1q23 s THR 9 N -3.77 3.54 -0.03 -3.49 -1.32 0.43 -4.89 115.64 106.11 1q23 s THR 9 Ca 0.03 -0.47 -0.29 0.00 -1.21 0.00 0.00 61.69 59.75 1q23 s THR 9 Cb -0.02 -2.55 -0.03 0.00 -1.51 0.00 0.00 72.50 68.40 1q23 s THR 9 CO -0.09 0.49 0.95 -0.89 -2.21 0.00 0.00 174.62 172.87 1q23 s THR 10 N 0.59 4.87 0.19 5.08 2.01 -1.26 0.21 115.64 127.33 1q23 s THR 10 Ca -0.04 1.99 -0.30 0.00 0.31 0.00 0.00 61.69 63.65 1q23 s THR 10 Cb -0.15 -4.29 -0.08 0.00 0.01 0.00 0.00 72.50 67.99 1q23 s THR 10 CO 0.03 0.14 1.17 -0.69 -0.69 0.00 0.00 174.62 174.58 1q23 s VAL 11 N 1.18 3.60 -0.80 3.82 1.01 -0.24 -4.93 120.40 124.04 1q23 s VAL 11 Ca 0.50 1.38 -0.24 0.00 0.00 0.00 0.00 61.98 63.62 1q23 s VAL 11 Cb -0.20 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.36 1q23 s VAL 11 CO 0.25 0.23 1.21 -0.62 0.00 0.00 0.00 175.10 176.17 1q23 s ASP 12 N 0.00 6.30 0.06 3.32 3.68 -1.26 -4.88 116.67 123.88 1q23 s ASP 12 Ca 0.51 -1.03 -0.25 0.00 2.13 0.00 0.00 52.55 53.92 1q23 s ASP 12 Cb -0.32 -2.50 -0.17 0.00 -1.45 0.00 0.00 42.92 38.48 1q23 s ASP 12 CO 0.37 -1.56 1.58 0.40 0.13 0.00 0.00 175.17 176.10 1q23 h ILE 13 N 6.16 1.02 -0.24 4.11 1.08 -1.96 -2.77 117.51 124.92 1q23 h ILE 13 Ca -0.12 -0.31 0.07 0.00 -0.39 0.00 0.00 64.86 64.11 1q23 h ILE 13 Cb 1.04 1.23 -0.01 0.00 -3.07 0.00 0.00 36.82 36.02 1q23 h ILE 13 CO 1.26 0.08 0.64 0.77 -0.69 0.00 0.00 178.15 180.21 1q23 h SER 14 N -0.23 0.00 -0.01 1.72 4.64 -2.01 0.11 113.55 117.76 1q23 h SER 14 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1q23 h SER 14 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1q23 h SER 14 CO 0.02 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.93 1q23 n GLN 15 N -3.04 1.00 -2.73 4.77 1.13 -1.06 -4.96 117.38 112.49 1q23 n GLN 15 Ca 0.04 -1.15 -0.42 0.00 -1.94 0.00 0.00 57.00 53.54 1q23 n GLN 15 Cb 0.74 -1.23 -0.03 0.00 0.11 0.00 0.00 30.24 29.83 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 -1.16 3.62 0.52 1.08 -0.00 0.37 -4.93 118.94 118.44 1q23 s TRP 16 Ca 0.14 1.64 0.41 0.00 -0.00 0.00 0.00 56.10 58.29 1q23 s TRP 16 Cb 0.10 -3.11 2.22 0.00 -0.00 0.00 0.00 33.47 32.69 1q23 s TRP 16 CO 0.19 -0.05 2.26 0.45 -0.00 0.00 0.00 176.95 179.80 1q23 h HIS 17 N 6.86 0.00 -0.65 5.86 3.86 -1.93 -1.97 115.15 127.18 1q23 h HIS 17 Ca -0.39 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.82 1q23 h HIS 17 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 1q23 h HIS 17 CO 0.68 0.00 0.00 0.54 0.86 0.00 0.00 177.93 180.01 1q23 n ARG 18 N -2.97 3.73 -0.15 2.45 1.74 -1.26 -4.70 116.66 115.50 1q23 n ARG 18 Ca -0.03 -2.89 -0.05 0.00 -0.77 0.00 0.00 57.85 54.11 1q23 n ARG 18 Cb 0.08 -1.89 -0.04 0.00 -1.02 0.00 0.00 32.46 29.58 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 4.08 -0.05 -0.83 5.56 3.64 -1.62 0.11 116.57 127.46 1q23 h LYS 19 Ca 0.00 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1q23 h LYS 19 Cb 1.45 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 33.22 1q23 h LYS 19 CO 0.23 -0.03 0.50 0.93 -2.27 0.00 0.00 179.45 178.81 1q23 h GLU 20 N -0.05 0.89 0.17 1.90 5.08 -1.86 -1.82 114.58 118.88 1q23 h GLU 20 Ca 0.06 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1q23 h GLU 20 Cb 0.21 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1q23 h GLU 20 CO -0.38 0.59 -0.46 0.45 -1.00 0.00 0.00 179.01 178.21 1q23 h HIS 21 N 0.91 -1.30 -0.53 4.33 3.86 -1.78 -0.76 115.15 119.88 1q23 h HIS 21 Ca 0.37 0.03 0.11 0.00 -1.16 0.00 0.00 60.37 59.71 1q23 h HIS 21 Cb 0.19 0.55 -0.10 0.00 1.06 0.00 0.00 27.41 29.11 1q23 h HIS 21 CO -0.04 -0.56 -0.10 0.35 0.86 0.00 0.00 177.93 178.45 1q23 h PHE 22 N -0.72 -0.21 -0.47 2.45 3.04 -0.66 0.72 116.94 121.08 1q23 h PHE 22 Ca 0.00 0.05 -0.10 0.00 3.98 0.00 0.00 57.97 61.90 1q23 h PHE 22 Cb 0.73 0.18 -0.01 0.00 2.56 0.00 0.00 35.95 39.40 1q23 h PHE 22 CO -0.38 -0.20 -0.11 0.93 -2.02 0.00 0.00 178.31 176.53 1q23 h GLU 23 N 0.03 0.91 -0.54 1.11 5.08 -0.94 -0.22 114.58 120.02 1q23 h GLU 23 Ca 0.26 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 1q23 h GLU 23 Cb 0.40 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1q23 h GLU 23 CO -0.52 1.00 0.13 0.00 -1.00 0.00 0.00 179.01 178.62 1q23 h ALA 24 N 0.88 0.71 0.00 3.43 0.00 -0.14 -3.07 119.26 121.07 1q23 h ALA 24 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1q23 h ALA 24 Cb 0.66 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1q23 h ALA 24 CO 0.05 0.41 0.00 1.19 0.00 0.00 0.00 179.25 180.90 1q23 n PHE 25 N -4.41 0.16 1.10 0.00 0.99 0.24 -1.31 117.46 114.22 1q23 n PHE 25 Ca 0.02 0.05 0.12 0.00 -0.00 0.00 0.00 57.45 57.64 1q23 n PHE 25 Cb 0.23 -0.58 0.25 0.00 -1.00 0.00 0.00 39.48 38.37 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 -1.63 0.41 0.00 -1.08 1.13 -0.15 -3.95 117.38 112.12 1q23 n GLN 26 Ca 0.05 -0.26 0.00 0.00 -1.94 0.00 0.00 57.00 54.85 1q23 n GLN 26 Cb 0.28 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.14 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 -1.06 0.00 0.01 1.08 3.41 -0.54 -4.87 113.62 111.64 1q23 n SER 27 Ca 0.08 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.59 1q23 n SER 27 Cb 0.35 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.33 1q23 n SER 27 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1q23 h VAL 28 N 0.00 1.33 -0.57 -3.33 3.04 -1.77 -2.38 116.25 112.57 1q23 h VAL 28 Ca 0.00 -1.90 0.00 0.00 -1.01 0.00 0.00 66.70 63.79 1q23 h VAL 28 Cb 0.00 1.87 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 1q23 h VAL 28 CO 0.00 0.59 0.00 0.00 -1.01 0.00 0.00 177.57 177.15 1q23 n ALA 29 N -2.53 3.87 -1.78 3.17 0.00 -0.43 -5.02 120.51 117.80 1q23 n ALA 29 Ca -0.04 -1.94 -0.41 0.00 0.00 0.00 0.00 53.44 51.05 1q23 n ALA 29 Cb 0.65 -1.11 -0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 -2.77 4.10 -0.10 0.00 0.74 -0.90 -4.62 119.66 116.11 1q23 s GLN 30 Ca 0.55 2.60 -0.31 0.00 0.05 0.00 0.00 55.36 58.24 1q23 s GLN 30 Cb 0.42 -2.97 0.12 0.00 1.10 0.00 0.00 33.01 31.68 1q23 s GLN 30 CO 0.16 -0.57 1.02 0.00 -0.55 0.00 0.00 175.29 175.35 1q23 s THR 32 N -2.51 2.46 -0.12 0.00 2.01 -1.26 -0.97 115.64 115.25 1q23 s THR 32 Ca 0.05 -2.36 -0.16 0.00 0.31 0.00 0.00 61.69 59.53 1q23 s THR 32 Cb -0.01 -2.38 0.04 0.00 0.01 0.00 0.00 72.50 70.17 1q23 s THR 32 CO -0.06 -0.36 0.43 -0.72 -0.69 0.00 0.00 174.62 173.21 1q23 s TYR 33 N -2.52 -0.43 0.08 4.92 -0.85 -0.77 -4.92 117.35 112.86 1q23 s TYR 33 Ca 0.30 0.97 0.09 0.00 -0.52 0.00 0.00 57.07 57.91 1q23 s TYR 33 Cb -0.04 0.17 -0.03 0.00 0.38 0.00 0.00 41.96 42.44 1q23 s TYR 33 CO 0.15 -0.29 -0.25 -0.80 -1.52 0.00 0.00 175.55 172.85 1q23 s ASN 34 N -0.21 2.97 -0.03 -0.18 0.02 -1.26 -1.53 114.94 114.72 1q23 s ASN 34 Ca -0.04 -0.64 -0.04 0.00 -1.02 0.00 0.00 52.86 51.12 1q23 s ASN 34 Cb -0.03 -0.23 0.01 0.00 0.02 0.00 0.00 41.25 41.02 1q23 s ASN 34 CO 0.02 0.18 0.11 -1.10 0.02 0.00 0.00 177.10 176.33 1q23 s GLN 35 N -1.59 0.22 0.00 -0.60 -0.21 -0.83 -5.00 119.66 111.66 1q23 s GLN 35 Ca 0.11 -0.02 0.07 0.00 0.02 0.00 0.00 55.36 55.54 1q23 s GLN 35 Cb -0.10 0.10 -0.02 0.00 1.00 0.00 0.00 33.01 33.99 1q23 s GLN 35 CO 0.04 -0.04 -0.23 0.99 -2.12 0.00 0.00 175.29 173.93 1q23 s THR 36 N -0.37 1.82 0.14 -0.19 2.01 -1.26 -0.82 115.64 116.97 1q23 s THR 36 Ca -0.04 -1.08 0.06 0.00 0.31 0.00 0.00 61.69 60.93 1q23 s THR 36 Cb -0.03 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 1q23 s THR 36 CO 0.00 0.42 -0.14 0.54 -0.69 0.00 0.00 174.62 174.76 1q23 s VAL 37 N -0.63 1.38 -1.16 3.82 0.11 0.13 -4.96 120.40 119.08 1q23 s VAL 37 Ca 0.09 -1.83 -0.14 0.00 -2.93 0.00 0.00 61.98 57.17 1q23 s VAL 37 Cb -0.09 -1.65 0.18 0.00 -1.53 0.00 0.00 36.38 33.29 1q23 s VAL 37 CO 0.00 -0.48 1.36 -1.10 -3.33 0.00 0.00 175.10 171.55 1q23 s GLN 38 N -2.94 4.03 0.43 1.54 -1.52 -1.26 -0.29 119.66 119.64 1q23 s GLN 38 Ca 0.12 -2.53 -0.25 0.00 -1.95 0.00 0.00 55.36 50.75 1q23 s GLN 38 Cb -0.03 -4.99 -0.10 0.00 -0.22 0.00 0.00 33.01 27.67 1q23 s GLN 38 CO 0.03 -1.72 1.22 -0.11 -0.25 0.00 0.00 175.29 174.46 1q23 n LEU 39 N 5.50 3.78 -4.48 2.90 0.00 -0.91 -4.68 117.00 119.11 1q23 n LEU 39 Ca 0.34 1.09 -0.43 0.00 0.00 0.00 0.00 56.01 57.00 1q23 n LEU 39 Cb 0.43 -1.47 -0.06 0.00 0.00 0.00 0.00 43.42 42.32 1q23 n LEU 39 CO 0.59 -0.82 0.44 -0.62 0.00 0.00 0.00 177.39 176.97 1q23 s ASP 40 N -0.59 6.27 0.00 1.96 3.68 -1.26 -0.40 116.67 126.33 1q23 s ASP 40 Ca 0.62 -0.67 0.17 0.00 2.13 0.00 0.00 52.55 54.80 1q23 s ASP 40 Cb -0.52 -2.33 0.46 0.00 -1.45 0.00 0.00 42.92 39.08 1q23 s ASP 40 CO 0.57 -0.95 1.38 2.30 0.13 0.00 0.00 175.17 178.60 1q23 n ILE 41 N 5.80 0.91 -0.13 4.11 -5.35 0.16 -4.68 119.36 120.17 1q23 n ILE 41 Ca -0.04 -0.96 -0.04 0.00 -0.27 0.00 0.00 62.75 61.45 1q23 n ILE 41 Cb 0.46 0.58 -0.03 0.00 -1.74 0.00 0.00 39.64 38.91 1q23 n ILE 41 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1q23 n THR 42 N 1.11 -0.22 -0.02 7.28 -1.04 -1.03 0.63 114.28 121.00 1q23 n THR 42 Ca 0.18 1.34 -0.13 0.00 -2.04 0.00 0.00 64.05 63.40 1q23 n THR 42 Cb 0.52 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 1q23 n THR 42 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1q23 h ALA 43 N -0.22 0.54 -0.18 2.41 0.00 -1.86 -2.93 119.26 117.02 1q23 h ALA 43 Ca 0.05 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1q23 h ALA 43 Cb 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1q23 h ALA 43 CO -0.30 0.70 0.09 0.35 0.00 0.00 0.00 179.25 180.09 1q23 h PHE 44 N 0.50 0.26 -0.21 0.00 3.57 -1.13 -1.11 116.94 118.82 1q23 h PHE 44 Ca -0.01 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1q23 h PHE 44 Cb 1.20 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.85 1q23 h PHE 44 CO 0.06 0.26 0.02 1.25 -2.23 0.00 0.00 178.31 177.67 1q23 h LEU 45 N 0.18 0.28 0.04 0.59 6.46 0.20 -1.62 115.31 121.45 1q23 h LEU 45 Ca 0.06 -0.03 -0.28 0.00 -0.12 0.00 0.00 57.88 57.51 1q23 h LEU 45 Cb 0.09 -0.07 0.02 0.00 -0.73 0.00 0.00 40.66 39.97 1q23 h LEU 45 CO -0.01 0.32 -1.15 0.11 -0.62 0.00 0.00 178.44 177.09 1q23 h LYS 46 N 0.31 0.59 -0.94 1.25 1.57 -1.30 -0.92 116.57 117.13 1q23 h LYS 46 Ca 0.07 -0.73 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 1q23 h LYS 46 Cb 0.18 0.23 -0.05 0.00 0.08 0.00 0.00 32.23 32.68 1q23 h LYS 46 CO 0.00 1.32 0.60 1.15 -0.57 0.00 0.00 179.45 181.95 1q23 h THR 47 N 0.29 1.25 -0.07 -0.16 2.02 -0.95 -1.23 112.91 114.05 1q23 h THR 47 Ca -0.15 -0.49 -0.04 0.00 0.77 0.00 0.00 66.41 66.50 1q23 h THR 47 Cb 1.82 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1q23 h THR 47 CO 0.22 0.25 -0.11 0.58 0.37 0.00 0.00 175.52 176.83 1q23 h VAL 48 N 1.28 1.40 -0.46 3.16 2.07 -0.83 -2.77 116.25 120.10 1q23 h VAL 48 Ca 0.34 -1.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 1q23 h VAL 48 Cb -0.11 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1q23 h VAL 48 CO -0.07 0.38 0.21 0.11 0.02 0.00 0.00 177.57 178.22 1q23 h LYS 49 N -0.27 0.66 0.00 1.57 1.57 -1.17 -1.32 116.57 117.62 1q23 h LYS 49 Ca 0.01 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 1q23 h LYS 49 Cb 0.66 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1q23 h LYS 49 CO 0.02 0.58 -0.20 1.57 -0.57 0.00 0.00 179.45 180.85 1q23 h LYS 50 N 0.59 0.00 -0.53 3.15 2.10 -1.23 -2.44 116.57 118.22 1q23 h LYS 50 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 1q23 h LYS 50 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1q23 h LYS 50 CO -0.02 0.20 0.00 0.09 -2.00 0.00 0.00 179.45 177.73 1q23 n ASN 51 N -3.63 3.59 -3.87 7.07 5.03 -1.05 -4.99 115.26 117.41 1q23 n ASN 51 Ca -0.01 -1.98 -0.24 0.00 0.87 0.00 0.00 54.58 53.22 1q23 n ASN 51 Cb 0.33 -0.35 -0.00 0.00 -1.02 0.00 0.00 39.78 38.74 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 1.42 -3.71 -3.21 3.52 5.02 -0.74 -4.98 118.16 115.49 1q23 n LYS 52 Ca 0.20 0.47 -0.24 0.00 -2.02 0.00 0.00 58.31 56.72 1q23 n LYS 52 Cb 0.58 -4.71 -0.01 0.00 -0.02 0.00 0.00 35.03 30.88 1q23 n LYS 52 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1q23 s HIS 53 N -3.87 3.47 0.09 2.13 3.76 -0.57 -5.05 115.29 115.25 1q23 s HIS 53 Ca 0.01 0.41 -0.26 0.00 -0.15 0.00 0.00 55.06 55.07 1q23 s HIS 53 Cb -0.00 -2.01 -0.06 0.00 1.11 0.00 0.00 32.58 31.61 1q23 s HIS 53 CO 0.87 -0.01 0.81 0.15 -0.85 0.00 0.00 174.74 175.71 1q23 s LYS 54 N -4.42 4.56 0.15 1.40 1.02 -1.26 -4.74 119.74 116.45 1q23 s LYS 54 Ca 0.42 1.16 -0.13 0.00 0.02 0.00 0.00 55.97 57.45 1q23 s LYS 54 Cb -0.10 -3.34 0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1q23 s LYS 54 CO 0.38 0.33 1.67 0.35 -0.92 0.00 0.00 175.35 177.16 1q23 h PHE 55 N 5.35 0.86 0.38 3.18 3.57 -1.98 -2.82 116.94 125.48 1q23 h PHE 55 Ca -0.44 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 60.94 1q23 h PHE 55 Cb 1.21 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1q23 h PHE 55 CO 0.65 0.75 -0.18 -0.92 -2.23 0.00 0.00 178.31 176.38 1q23 h TYR 56 N 0.71 -0.48 -0.34 0.41 3.20 -1.98 0.80 116.97 119.29 1q23 h TYR 56 Ca 0.16 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1q23 h TYR 56 Cb 0.32 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 1q23 h TYR 56 CO 0.02 -0.15 0.05 -1.00 -1.64 0.00 0.00 178.16 175.44 1q23 h PRO 57 N -0.87 0.51 -0.51 1.82 0.13 -2.00 0.16 132.00 131.24 1q23 h PRO 57 Ca -0.05 -0.09 0.02 0.00 -0.87 0.00 0.00 66.00 65.01 1q23 h PRO 57 Cb 0.54 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.55 1q23 h PRO 57 CO 0.09 0.50 0.30 0.00 -0.23 0.00 0.00 178.00 178.66 1q23 h ALA 58 N 1.57 0.65 -0.36 -0.56 0.00 -1.16 -2.21 119.26 117.19 1q23 h ALA 58 Ca 0.11 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1q23 h ALA 58 Cb 0.24 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1q23 h ALA 58 CO 0.00 0.01 0.05 0.35 0.00 0.00 0.00 179.25 179.66 1q23 h PHE 59 N 0.61 0.64 -0.46 0.00 3.57 -0.57 -2.88 116.94 117.84 1q23 h PHE 59 Ca 0.21 -0.09 0.10 0.00 3.53 0.00 0.00 57.97 61.71 1q23 h PHE 59 Cb 0.02 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 1q23 h PHE 59 CO -0.07 0.66 0.32 0.82 -2.23 0.00 0.00 178.31 177.81 1q23 h ILE 60 N 0.43 0.86 -0.01 1.41 2.04 -0.45 -0.80 117.51 121.00 1q23 h ILE 60 Ca 0.11 -0.07 -0.25 0.00 1.00 0.00 0.00 64.86 65.65 1q23 h ILE 60 Cb 0.37 0.65 0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1q23 h ILE 60 CO 0.01 0.04 -0.99 -0.74 0.00 0.00 0.00 178.15 176.46 1q23 h HIS 61 N 0.20 0.88 -0.23 1.37 2.76 -1.20 0.10 115.15 119.03 1q23 h HIS 61 Ca 0.22 -0.48 -0.01 0.00 -2.20 0.00 0.00 60.37 57.90 1q23 h HIS 61 Cb 0.60 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 1q23 h HIS 61 CO -0.00 1.30 0.11 0.82 -1.30 0.00 0.00 177.93 178.87 1q23 h ILE 62 N 0.34 1.13 -1.01 6.26 2.04 -1.20 0.85 117.51 125.92 1q23 h ILE 62 Ca -0.11 -0.38 0.24 0.00 1.00 0.00 0.00 64.86 65.61 1q23 h ILE 62 Cb 1.64 0.96 -0.11 0.00 -0.74 0.00 0.00 36.82 38.57 1q23 h ILE 62 CO 0.19 0.13 0.62 -0.07 0.00 0.00 0.00 178.15 179.02 1q23 h LEU 63 N 0.25 0.62 0.09 1.44 3.38 -0.94 -2.40 115.31 117.74 1q23 h LEU 63 Ca 0.08 0.11 -0.28 0.00 0.09 0.00 0.00 57.88 57.88 1q23 h LEU 63 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1q23 h LEU 63 CO -0.01 0.15 -1.35 0.00 0.09 0.00 0.00 178.44 177.31 1q23 h ALA 64 N 1.67 0.28 -0.74 1.53 0.00 -0.16 -1.31 119.26 120.53 1q23 h ALA 64 Ca 0.61 -1.03 0.06 0.00 0.00 0.00 0.00 54.91 54.54 1q23 h ALA 64 Cb 1.23 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 1q23 h ALA 64 CO -0.38 1.15 0.43 0.00 0.00 0.00 0.00 179.25 180.45 1q23 h ARG 65 N 0.05 0.77 -0.18 0.00 3.08 -0.62 -2.55 114.38 114.93 1q23 h ARG 65 Ca -0.17 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.82 1q23 h ARG 65 Cb 1.95 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.82 1q23 h ARG 65 CO 0.16 0.51 0.03 -0.07 -1.07 0.00 0.00 179.97 179.53 1q23 h LEU 66 N 0.79 0.28 -2.34 3.04 3.38 -0.91 -1.24 115.31 118.31 1q23 h LEU 66 Ca 0.33 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1q23 h LEU 66 Cb 0.18 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1q23 h LEU 66 CO -0.18 0.46 -0.02 0.24 0.09 0.00 0.00 178.44 179.04 1q23 h MET 67 N 0.08 0.00 -0.02 1.13 2.86 -1.25 -2.73 114.93 115.00 1q23 h MET 67 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1q23 h MET 67 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1q23 h MET 67 CO 0.00 0.02 -0.19 0.09 1.06 0.00 0.00 176.91 177.90 1q23 n ASN 68 N -3.20 2.51 -0.13 1.22 3.02 -0.57 -3.83 115.26 114.28 1q23 n ASN 68 Ca -0.02 -1.76 0.11 0.00 -0.03 0.00 0.00 54.58 52.89 1q23 n ASN 68 Cb 0.17 0.20 0.11 0.00 -0.61 0.00 0.00 39.78 39.65 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 0.74 3.85 -3.68 5.41 0.00 -0.59 -4.97 120.51 121.26 1q23 n ALA 69 Ca 0.11 -0.49 -0.16 0.00 0.00 0.00 0.00 53.44 52.90 1q23 n ALA 69 Cb 0.52 -0.95 -0.15 0.00 0.00 0.00 0.00 19.45 18.86 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 -2.81 -0.21 0.42 0.00 3.76 -1.22 -5.06 115.29 110.18 1q23 s HIS 70 Ca 0.14 0.64 0.12 0.00 -0.15 0.00 0.00 55.06 55.80 1q23 s HIS 70 Cb 0.17 -0.21 0.91 0.00 1.11 0.00 0.00 32.58 34.56 1q23 s HIS 70 CO 0.70 -0.27 1.97 -1.00 -0.85 0.00 0.00 174.74 175.29 1q23 h PRO 71 N 8.21 0.15 -0.68 8.40 0.13 -1.93 -2.78 132.00 143.49 1q23 h PRO 71 Ca -0.17 -0.03 0.20 0.00 -0.87 0.00 0.00 66.00 65.13 1q23 h PRO 71 Cb 1.12 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 1q23 h PRO 71 CO 0.18 0.27 0.69 1.05 -0.23 0.00 0.00 178.00 179.96 1q23 h GLU 72 N 0.14 0.00 -0.00 0.86 9.09 -1.94 0.23 114.58 122.96 1q23 h GLU 72 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 1q23 h GLU 72 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.40 1q23 h GLU 72 CO 0.02 0.00 -0.07 1.19 0.05 0.00 0.00 179.01 180.20 1q23 n PHE 73 N -3.67 0.00 -1.41 2.06 3.01 -1.05 -4.14 117.46 112.27 1q23 n PHE 73 Ca 0.14 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.67 1q23 n PHE 73 Cb 0.94 -0.16 0.17 0.00 -0.01 0.00 0.00 39.48 40.42 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 -0.93 1.35 -3.22 -1.08 1.74 0.81 -4.60 116.66 110.73 1q23 n ARG 74 Ca 0.16 -2.87 -0.26 0.00 -0.77 0.00 0.00 57.85 54.11 1q23 n ARG 74 Cb 0.25 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 30.20 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 -2.87 3.53 0.09 5.56 -1.94 -1.23 -0.48 119.30 121.97 1q23 s MET 75 Ca 0.34 -0.14 -0.26 0.00 -1.71 0.00 0.00 55.69 53.92 1q23 s MET 75 Cb 0.32 -2.60 0.08 0.00 2.01 0.00 0.00 34.83 34.64 1q23 s MET 75 CO -0.03 0.10 0.78 0.00 -0.01 0.00 0.00 175.02 175.86 1q23 s ALA 76 N -2.34 -1.68 -0.33 3.03 0.00 -0.86 -4.59 121.76 115.00 1q23 s ALA 76 Ca 0.42 0.63 -0.11 0.00 0.00 0.00 0.00 51.96 52.90 1q23 s ALA 76 Cb -0.10 0.64 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 1q23 s ALA 76 CO 0.36 -0.78 0.19 1.41 0.00 0.00 0.00 175.76 176.94 1q23 s MET 77 N -3.42 3.38 -0.21 0.00 1.75 -1.26 -1.10 119.30 118.44 1q23 s MET 77 Ca 0.05 -0.70 0.01 0.00 -1.25 0.00 0.00 55.69 53.80 1q23 s MET 77 Cb -0.01 -3.68 0.03 0.00 2.84 0.00 0.00 34.83 34.01 1q23 s MET 77 CO -0.08 -0.44 -0.15 0.21 -0.65 0.00 0.00 175.02 173.90 1q23 s LYS 78 N 1.66 2.80 -1.28 4.11 2.20 0.19 -4.75 119.74 124.67 1q23 s LYS 78 Ca 0.05 -0.97 -0.08 0.00 -0.36 0.00 0.00 55.97 54.61 1q23 s LYS 78 Cb -0.17 -2.72 -0.00 0.00 -1.51 0.00 0.00 37.83 33.43 1q23 s LYS 78 CO 0.08 -0.32 0.62 -0.25 -0.36 0.00 0.00 175.35 175.12 1q23 n ASP 79 N 4.59 -2.46 0.00 1.43 10.43 -1.26 -1.23 116.55 128.05 1q23 n ASP 79 Ca -0.19 -0.97 0.00 0.00 2.57 0.00 0.00 54.79 56.20 1q23 n ASP 79 Cb 0.48 -3.39 0.00 0.00 1.84 0.00 0.00 41.12 40.05 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 -1.78 0.56 3.44 0.44 0.00 -1.26 -5.00 105.19 101.59 1q23 n GLY 80 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.48 2.30 0.18 1.61 2.02 -0.36 -5.10 118.70 118.87 1q23 s GLU 81 Ca 0.00 -0.82 -0.30 0.00 0.02 0.00 0.00 54.97 53.87 1q23 s GLU 81 Cb 0.00 -2.26 -0.08 0.00 0.10 0.00 0.00 34.13 31.89 1q23 s GLU 81 CO 0.00 0.59 1.06 -1.17 0.02 0.00 0.00 175.26 175.75 1q23 s LEU 82 N -0.94 4.52 0.03 1.80 2.96 -1.26 0.54 118.68 126.33 1q23 s LEU 82 Ca 0.12 2.04 -0.01 0.00 -0.22 0.00 0.00 54.13 56.06 1q23 s LEU 82 Cb -0.10 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 1q23 s LEU 82 CO 0.02 -0.14 -0.01 0.54 -1.32 0.00 0.00 176.35 175.44 1q23 s VAL 83 N -0.40 0.15 -0.18 1.68 0.11 -0.26 -1.08 120.40 120.43 1q23 s VAL 83 Ca 0.47 -1.25 -0.02 0.00 -2.93 0.00 0.00 61.98 58.26 1q23 s VAL 83 Cb -0.28 -0.80 -0.01 0.00 -1.53 0.00 0.00 36.38 33.76 1q23 s VAL 83 CO 0.34 -0.69 -0.10 -0.63 -3.33 0.00 0.00 175.10 170.70 1q23 s ILE 84 N -2.49 3.12 0.30 7.04 1.01 0.56 -2.04 121.20 128.71 1q23 s ILE 84 Ca -0.06 -0.60 -0.29 0.00 0.00 0.00 0.00 60.65 59.69 1q23 s ILE 84 Cb -0.02 -2.37 -0.10 0.00 0.01 0.00 0.00 42.46 39.98 1q23 s ILE 84 CO -0.05 0.48 1.40 0.26 0.00 0.00 0.00 174.94 177.04 1q23 s TRP 85 N 0.95 2.96 0.37 3.97 0.52 0.37 -0.43 118.94 127.65 1q23 s TRP 85 Ca -0.02 1.18 0.15 0.00 0.02 0.00 0.00 56.10 57.44 1q23 s TRP 85 Cb -0.15 -3.81 1.00 0.00 -1.15 0.00 0.00 33.47 29.37 1q23 s TRP 85 CO -0.00 -2.44 1.78 -0.44 0.02 0.00 0.00 176.95 175.86 1q23 h ASP 86 N 4.11 0.54 -5.16 2.95 3.45 -1.83 -3.44 116.42 117.03 1q23 h ASP 86 Ca -0.48 0.09 -0.06 0.00 0.43 0.00 0.00 57.03 57.01 1q23 h ASP 86 Cb 1.22 -0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.88 1q23 h ASP 86 CO 0.71 0.14 -0.13 -0.44 -1.57 0.00 0.00 179.24 177.95 1q23 s SER 87 N -5.35 -0.12 0.08 6.45 0.01 -1.26 -5.07 113.70 108.44 1q23 s SER 87 Ca -0.09 -0.63 0.02 0.00 1.31 0.00 0.00 55.95 56.56 1q23 s SER 87 Cb 0.25 0.50 -0.03 0.00 0.21 0.00 0.00 66.02 66.95 1q23 s SER 87 CO 0.80 -0.96 -0.08 0.68 0.41 0.00 0.00 173.24 174.08 1q23 s VAL 88 N -3.91 0.69 -0.06 3.43 -7.23 -1.26 -4.91 120.40 107.16 1q23 s VAL 88 Ca 0.12 -1.57 0.04 0.00 -1.81 0.00 0.00 61.98 58.75 1q23 s VAL 88 Cb 0.01 -1.24 0.00 0.00 0.56 0.00 0.00 36.38 35.72 1q23 s VAL 88 CO -0.03 -0.63 -0.16 -1.00 -0.31 0.00 0.00 175.10 172.97 1q23 s HIS 89 N -2.58 1.74 0.04 2.82 3.76 -0.20 -4.65 115.29 116.22 1q23 s HIS 89 Ca 0.03 -0.57 -0.31 0.00 -0.15 0.00 0.00 55.06 54.06 1q23 s HIS 89 Cb -0.02 -1.20 -0.07 0.00 1.11 0.00 0.00 32.58 32.40 1q23 s HIS 89 CO -0.02 -0.23 1.55 -1.25 -0.85 0.00 0.00 174.74 173.94 1q23 s PRO 90 N 0.26 4.23 -0.36 8.40 0.04 -1.24 -1.49 135.00 144.85 1q23 s PRO 90 Ca -0.09 2.18 -0.09 0.00 0.04 0.00 0.00 61.00 63.05 1q23 s PRO 90 Cb -0.14 -3.57 0.04 0.00 0.04 0.00 0.00 34.50 30.87 1q23 s PRO 90 CO 0.03 -0.66 0.16 0.00 0.04 0.00 0.00 177.00 176.57 1q23 s TYR 92 N 1.46 2.26 0.07 0.00 -0.85 -0.09 -1.01 117.35 119.20 1q23 s TYR 92 Ca 0.00 -0.50 -0.11 0.00 -0.52 0.00 0.00 57.07 55.94 1q23 s TYR 92 Cb -0.20 -1.21 -0.06 0.00 0.38 0.00 0.00 41.96 40.87 1q23 s TYR 92 CO 0.04 0.55 0.41 0.95 -1.52 0.00 0.00 175.55 175.99 1q23 s THR 93 N -2.68 5.06 -0.16 -3.49 -4.23 -0.93 -0.81 115.64 108.41 1q23 s THR 93 Ca 0.31 0.55 -0.00 0.00 -1.18 0.00 0.00 61.69 61.37 1q23 s THR 93 Cb 0.01 -3.66 -0.00 0.00 1.34 0.00 0.00 72.50 70.18 1q23 s THR 93 CO 0.15 0.34 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.73 1q23 s VAL 94 N -1.35 2.75 -0.01 2.29 1.01 -0.12 -4.76 120.40 120.22 1q23 s VAL 94 Ca 0.32 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 1q23 s VAL 94 Cb -0.14 -2.17 -0.06 0.00 0.00 0.00 0.00 36.38 34.01 1q23 s VAL 94 CO 0.17 0.51 0.50 0.12 0.00 0.00 0.00 175.10 176.40 1q23 s PHE 95 N 0.86 3.69 -0.46 5.22 5.36 -1.26 -1.04 117.98 130.35 1q23 s PHE 95 Ca -0.04 1.08 -0.09 0.00 -0.96 0.00 0.00 56.93 56.92 1q23 s PHE 95 Cb -0.15 -2.46 0.11 0.00 -0.34 0.00 0.00 43.02 40.18 1q23 s PHE 95 CO -0.01 0.46 0.33 -1.01 -1.46 0.00 0.00 175.22 173.54 1q23 s HIS 96 N -0.52 3.42 0.47 10.12 3.76 0.24 -4.96 115.29 127.83 1q23 s HIS 96 Ca 0.27 -1.86 0.13 0.00 -0.15 0.00 0.00 55.06 53.45 1q23 s HIS 96 Cb -0.17 -3.42 1.10 0.00 1.11 0.00 0.00 32.58 31.20 1q23 s HIS 96 CO 0.15 -0.98 2.08 0.93 -0.85 0.00 0.00 174.74 176.08 1q23 h GLU 97 N 8.43 0.12 0.03 1.40 5.08 -1.97 0.25 114.58 127.92 1q23 h GLU 97 Ca -0.21 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 57.93 1q23 h GLU 97 Cb 1.07 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1q23 h GLU 97 CO 0.84 0.13 -0.96 1.96 -1.00 0.00 0.00 179.01 179.98 1q23 h GLN 98 N 0.13 0.17 -0.01 2.33 1.08 -1.94 -3.29 115.11 113.57 1q23 h GLN 98 Ca 0.03 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 57.02 1q23 h GLN 98 Cb 0.08 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1q23 h GLN 98 CO -0.00 1.00 -0.41 0.25 -0.95 0.00 0.00 178.83 178.72 1q23 n THR 99 N -3.58 0.00 -3.25 -0.54 -2.24 -1.08 -4.99 114.28 98.60 1q23 n THR 99 Ca -0.04 -0.29 -0.23 0.00 -2.27 0.00 0.00 64.05 61.22 1q23 n THR 99 Cb 0.87 1.12 0.05 0.00 -2.10 0.00 0.00 70.33 70.27 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 -0.50 -6.08 -4.59 -0.78 1.02 0.85 -4.99 120.64 105.57 1q23 n GLU 100 Ca 0.05 0.88 -0.28 0.00 -0.02 0.00 0.00 57.16 57.79 1q23 n GLU 100 Cb 0.28 -5.82 -0.08 0.00 -0.02 0.00 0.00 31.44 25.81 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 -3.24 0.81 0.22 2.62 -4.23 -1.21 -4.97 115.64 105.64 1q23 s THR 101 Ca 0.42 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.95 1q23 s THR 101 Cb -0.19 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.29 1q23 s THR 101 CO 0.52 0.00 0.04 0.72 -0.54 0.00 0.00 174.62 175.36 1q23 s PHE 102 N -3.10 1.41 0.17 3.99 -0.12 -1.26 -0.59 117.98 118.49 1q23 s PHE 102 Ca 0.19 -1.08 0.02 0.00 -0.05 0.00 0.00 56.93 56.01 1q23 s PHE 102 Cb 0.03 -0.82 -0.05 0.00 -0.63 0.00 0.00 43.02 41.55 1q23 s PHE 102 CO 0.11 -0.24 -0.02 -1.12 -0.05 0.00 0.00 175.22 173.90 1q23 s SER 103 N -3.26 1.39 -0.23 1.98 0.01 -0.20 -4.66 113.70 108.73 1q23 s SER 103 Ca 0.31 -1.14 0.02 0.00 1.31 0.00 0.00 55.95 56.45 1q23 s SER 103 Cb 0.07 0.08 0.04 0.00 0.21 0.00 0.00 66.02 66.42 1q23 s SER 103 CO 0.09 -0.51 -0.14 -0.44 0.41 0.00 0.00 173.24 172.64 1q23 s SER 104 N -3.18 3.94 -0.10 2.44 0.01 0.39 -0.94 113.70 116.26 1q23 s SER 104 Ca 0.22 -1.11 0.03 0.00 1.31 0.00 0.00 55.95 56.40 1q23 s SER 104 Cb 0.05 -1.52 0.00 0.00 0.21 0.00 0.00 66.02 64.77 1q23 s SER 104 CO 0.03 -0.12 -0.21 -0.76 0.41 0.00 0.00 173.24 172.60 1q23 s LEU 105 N 1.18 1.97 0.09 2.44 1.43 0.01 -4.37 118.68 121.42 1q23 s LEU 105 Ca -0.04 -0.50 -0.05 0.00 -1.03 0.00 0.00 54.13 52.52 1q23 s LEU 105 Cb -0.17 -1.26 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 1q23 s LEU 105 CO -0.08 0.12 0.31 -1.66 0.23 0.00 0.00 176.35 175.27 1q23 s TRP 106 N 0.49 3.52 -0.03 0.29 1.48 -1.26 -0.91 118.94 122.52 1q23 s TRP 106 Ca -0.16 0.51 0.04 0.00 -1.06 0.00 0.00 56.10 55.43 1q23 s TRP 106 Cb -0.17 -1.96 -0.00 0.00 -1.16 0.00 0.00 33.47 30.18 1q23 s TRP 106 CO 0.06 0.52 -0.15 -1.12 -4.06 0.00 0.00 176.95 172.21 1q23 s SER 107 N -2.21 1.83 0.06 -2.66 0.01 -1.03 -5.01 113.70 104.69 1q23 s SER 107 Ca 0.36 -0.29 -0.32 0.00 1.31 0.00 0.00 55.95 57.00 1q23 s SER 107 Cb -0.13 -0.43 -0.11 0.00 0.21 0.00 0.00 66.02 65.56 1q23 s SER 107 CO 0.23 0.14 1.84 1.21 0.41 0.00 0.00 173.24 177.07 1q23 n GLU 108 N 3.08 2.57 -2.20 12.44 2.13 -1.26 -3.58 120.64 133.81 1q23 n GLU 108 Ca -0.17 0.94 -0.39 0.00 0.66 0.00 0.00 57.16 58.19 1q23 n GLU 108 Cb 0.54 -2.82 -0.02 0.00 0.27 0.00 0.00 31.44 29.41 1q23 n GLU 108 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1q23 s TYR 109 N 3.16 3.03 0.04 4.31 5.04 -1.26 -4.90 117.35 126.77 1q23 s TYR 109 Ca 0.86 1.50 0.02 0.00 -2.44 0.00 0.00 57.07 57.00 1q23 s TYR 109 Cb -0.55 -3.52 -0.02 0.00 0.35 0.00 0.00 41.96 38.21 1q23 s TYR 109 CO 0.42 -1.59 -0.06 -1.01 -1.34 0.00 0.00 175.55 171.96 1q23 s HIS 110 N -1.29 0.58 0.11 4.97 3.76 -1.26 -5.06 115.29 117.10 1q23 s HIS 110 Ca 0.54 -0.56 -0.17 0.00 -0.15 0.00 0.00 55.06 54.73 1q23 s HIS 110 Cb -0.35 -0.36 -0.04 0.00 1.11 0.00 0.00 32.58 32.95 1q23 s HIS 110 CO 0.45 -0.12 1.60 0.22 -0.85 0.00 0.00 174.74 176.03 1q23 h ASP 111 N 4.38 0.53 -3.57 1.40 3.58 -2.00 -3.43 116.42 117.31 1q23 h ASP 111 Ca -0.35 -0.25 -0.51 0.00 0.42 0.00 0.00 57.03 56.34 1q23 h ASP 111 Cb 1.20 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 42.11 1q23 h ASP 111 CO 0.43 0.64 0.45 -0.62 -2.88 0.00 0.00 179.24 177.27 1q23 s ASP 112 N -5.95 7.32 0.19 2.28 2.15 -1.26 -4.92 116.67 116.47 1q23 s ASP 112 Ca -0.13 2.04 -0.11 0.00 0.43 0.00 0.00 52.55 54.78 1q23 s ASP 112 Cb 0.09 -2.60 0.11 0.00 -0.30 0.00 0.00 42.92 40.22 1q23 s ASP 112 CO 0.76 -0.18 1.81 0.15 -0.17 0.00 0.00 175.17 177.54 1q23 h PHE 113 N 5.13 0.90 -0.24 -5.34 3.57 -1.82 -2.42 116.94 116.71 1q23 h PHE 113 Ca -0.44 -0.02 -0.16 0.00 3.53 0.00 0.00 57.97 60.88 1q23 h PHE 113 Cb 1.21 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 1q23 h PHE 113 CO 0.63 0.63 -0.49 0.00 -2.23 0.00 0.00 178.31 176.85 1q23 h ARG 114 N 0.91 0.66 -0.59 1.11 3.08 -1.91 0.14 114.38 117.77 1q23 h ARG 114 Ca 0.23 -0.39 0.06 0.00 0.07 0.00 0.00 59.98 59.96 1q23 h ARG 114 Cb 0.02 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 1q23 h ARG 114 CO -0.04 1.00 0.30 0.37 -1.07 0.00 0.00 179.97 180.53 1q23 h GLN 115 N 0.52 0.54 -0.51 0.04 -0.00 -1.93 -2.90 115.11 110.87 1q23 h GLN 115 Ca 0.02 -0.03 -0.06 0.00 -0.00 0.00 0.00 58.65 58.58 1q23 h GLN 115 Cb 1.04 -0.12 -0.02 0.00 0.00 0.00 0.00 27.48 28.38 1q23 h GLN 115 CO 0.10 0.36 0.09 0.35 0.00 0.00 0.00 178.83 179.73 1q23 h PHE 116 N 0.56 0.89 -0.23 3.99 3.57 -0.84 -2.19 116.94 122.68 1q23 h PHE 116 Ca 0.27 -0.12 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1q23 h PHE 116 Cb 0.19 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1q23 h PHE 116 CO -0.10 0.80 -0.19 1.25 -2.23 0.00 0.00 178.31 177.84 1q23 h LEU 117 N 0.72 0.41 -0.35 0.59 6.46 -0.63 -0.23 115.31 122.28 1q23 h LEU 117 Ca 0.16 -0.12 -0.14 0.00 -0.12 0.00 0.00 57.88 57.66 1q23 h LEU 117 Cb 0.39 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.20 1q23 h LEU 117 CO 0.01 0.62 -0.33 -0.74 -0.62 0.00 0.00 178.44 177.38 1q23 h HIS 118 N 0.38 1.01 -0.49 1.25 2.76 -1.23 0.36 115.15 119.18 1q23 h HIS 118 Ca 0.06 -0.30 -0.11 0.00 -2.20 0.00 0.00 60.37 57.82 1q23 h HIS 118 Cb 0.56 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.29 1q23 h HIS 118 CO 0.02 1.09 -0.15 0.82 -1.30 0.00 0.00 177.93 178.41 1q23 h ILE 119 N 0.64 1.27 0.52 6.26 5.03 -0.84 -1.83 117.51 128.56 1q23 h ILE 119 Ca 0.06 -1.29 -0.03 0.00 -0.12 0.00 0.00 64.86 63.49 1q23 h ILE 119 Cb 0.91 1.04 0.01 0.00 -3.03 0.00 0.00 36.82 35.75 1q23 h ILE 119 CO 0.08 0.45 -0.25 0.22 -0.68 0.00 0.00 178.15 177.97 1q23 h TYR 120 N 0.84 -0.65 -0.99 1.37 3.20 -0.82 -0.24 116.97 119.68 1q23 h TYR 120 Ca 0.13 -0.02 0.23 0.00 3.14 0.00 0.00 58.73 62.21 1q23 h TYR 120 Cb 0.70 0.21 -0.09 0.00 1.54 0.00 0.00 36.73 39.09 1q23 h TYR 120 CO 0.04 -0.34 0.64 0.77 -1.64 0.00 0.00 178.16 177.63 1q23 h SER 121 N -0.87 0.49 0.01 -2.11 0.02 -0.22 -0.26 113.55 110.60 1q23 h SER 121 Ca -0.07 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1q23 h SER 121 Cb 0.60 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1q23 h SER 121 CO 0.12 0.14 -0.00 1.56 -1.14 0.00 0.00 176.83 177.51 1q23 h GLN 122 N 0.46 -0.01 -0.64 3.45 4.20 -0.95 -1.82 115.11 119.79 1q23 h GLN 122 Ca 0.55 0.00 0.13 0.00 0.06 0.00 0.00 58.65 59.39 1q23 h GLN 122 Cb 1.31 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.97 1q23 h GLN 122 CO -0.27 0.51 -0.10 -0.44 -0.67 0.00 0.00 178.83 177.86 1q23 h ASP 123 N -0.54 -0.48 0.87 1.46 3.32 -0.10 -1.68 116.42 119.27 1q23 h ASP 123 Ca -0.00 0.18 -0.19 0.00 0.02 0.00 0.00 57.03 57.04 1q23 h ASP 123 Cb 0.53 0.35 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 1q23 h ASP 123 CO 0.00 -0.18 -0.90 0.58 -1.72 0.00 0.00 179.24 177.02 1q23 h VAL 124 N 0.04 1.63 -0.35 -1.35 2.07 -1.04 0.50 116.25 117.74 1q23 h VAL 124 Ca 0.32 -3.05 -0.16 0.00 0.82 0.00 0.00 66.70 64.63 1q23 h VAL 124 Cb 0.50 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.92 1q23 h VAL 124 CO -0.62 0.87 -0.40 0.00 0.02 0.00 0.00 177.57 177.44 1q23 h ALA 125 N 1.09 0.61 0.21 1.67 0.00 -1.03 0.91 119.26 122.72 1q23 h ALA 125 Ca -0.01 -0.46 -0.35 0.00 0.00 0.00 0.00 54.91 54.09 1q23 h ALA 125 Cb 1.59 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 19.28 1q23 h ALA 125 CO 0.12 0.67 -1.65 0.00 0.00 0.00 0.00 179.25 178.39 1q23 n TYR 127 N -3.63 0.06 0.33 0.00 4.01 0.15 -4.77 117.16 113.31 1q23 n TYR 127 Ca -0.22 -0.15 0.09 0.00 -0.16 0.00 0.00 57.90 57.46 1q23 n TYR 127 Cb 1.09 -0.01 0.39 0.00 -0.31 0.00 0.00 39.34 40.49 1q23 n TYR 127 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1q23 n GLY 128 N 0.16 -1.02 0.23 2.72 0.00 0.31 -2.40 105.19 105.20 1q23 n GLY 128 Ca 0.03 0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.19 1q23 n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q23 n GLU 129 N -1.93 1.81 -2.59 1.61 -0.58 -1.26 -4.90 120.64 112.80 1q23 n GLU 129 Ca 0.02 -0.52 -0.42 0.00 -0.42 0.00 0.00 57.16 55.81 1q23 n GLU 129 Cb 0.15 -1.25 -0.03 0.00 -0.57 0.00 0.00 31.44 29.74 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 -2.07 7.17 0.00 1.62 3.84 -1.01 -4.91 114.94 119.57 1q23 s ASN 130 Ca 0.11 1.67 0.17 0.00 0.21 0.00 0.00 52.86 55.01 1q23 s ASN 130 Cb 0.12 -2.56 0.61 0.00 -0.55 0.00 0.00 41.25 38.88 1q23 s ASN 130 CO 0.48 -0.49 1.45 0.18 -2.79 0.00 0.00 177.10 175.93 1q23 n LEU 131 N 5.00 1.60 -4.73 3.21 4.77 -1.26 -4.86 117.00 120.72 1q23 n LEU 131 Ca 0.10 -0.72 -0.37 0.00 -0.03 0.00 0.00 56.01 54.99 1q23 n LEU 131 Cb 0.48 -0.14 0.07 0.00 -2.33 0.00 0.00 43.42 41.50 1q23 n LEU 131 CO 0.53 0.36 0.89 0.00 -1.33 0.00 0.00 177.39 177.84 1q23 s ALA 132 N -1.72 2.33 0.07 -1.18 0.00 -1.26 -4.92 121.76 115.07 1q23 s ALA 132 Ca 0.29 1.18 -0.29 0.00 0.00 0.00 0.00 51.96 53.14 1q23 s ALA 132 Cb 0.15 -3.55 -0.17 0.00 0.00 0.00 0.00 23.12 19.55 1q23 s ALA 132 CO 0.22 -1.65 1.60 -0.92 0.00 0.00 0.00 175.76 175.01 1q23 h TYR 133 N 0.42 -0.50 -3.29 0.00 3.20 -1.90 -3.36 116.97 111.53 1q23 h TYR 133 Ca -0.50 -0.01 -0.65 0.00 3.14 0.00 0.00 58.73 60.70 1q23 h TYR 133 Cb 1.33 0.17 -0.40 0.00 1.54 0.00 0.00 36.73 39.37 1q23 h TYR 133 CO 0.42 -0.28 -0.48 -0.06 -1.64 0.00 0.00 178.16 176.12 1q23 s PHE 134 N -5.88 3.47 0.50 -3.82 0.40 -1.26 -0.46 117.98 110.94 1q23 s PHE 134 Ca -0.16 -3.14 0.28 0.00 -0.60 0.00 0.00 56.93 53.31 1q23 s PHE 134 Cb 0.04 -2.91 1.37 0.00 0.51 0.00 0.00 43.02 42.03 1q23 s PHE 134 CO 0.62 -0.68 1.88 -1.35 0.70 0.00 0.00 175.22 176.38 1q23 h PRO 135 N 6.10 0.11 -0.38 0.24 0.11 -1.76 0.33 132.00 136.74 1q23 h PRO 135 Ca 0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1q23 h PRO 135 Cb 0.84 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1q23 h PRO 135 CO 0.73 0.07 0.00 1.63 -0.21 0.00 0.00 178.00 180.22 1q23 n LYS 136 N -4.35 3.58 0.00 1.05 5.02 -1.26 -5.06 118.16 117.14 1q23 n LYS 136 Ca 0.19 -2.91 0.00 0.00 -2.02 0.00 0.00 58.31 53.57 1q23 n LYS 136 Cb 0.89 -1.95 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 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 -0.02 -0.19 3.16 0.72 0.00 0.12 -4.80 105.19 104.17 1q23 n GLY 137 Ca 0.23 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 45.06 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 1.89 0.41 1.61 -0.12 -1.26 -4.80 117.98 115.71 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 -1.27 -0.01 0.00 -0.63 0.00 0.00 43.02 41.11 1q23 s PHE 138 CO 0.00 -0.20 0.47 0.96 -0.05 0.00 0.00 175.22 176.40 1q23 s ILE 139 N 0.05 2.92 0.30 -4.49 -4.36 -1.26 -5.04 121.20 109.33 1q23 s ILE 139 Ca -0.05 -1.17 0.15 0.00 -0.26 0.00 0.00 60.65 59.32 1q23 s ILE 139 Cb -0.13 -3.03 0.10 0.00 1.25 0.00 0.00 42.46 40.66 1q23 s ILE 139 CO 0.03 -0.02 1.78 -0.33 0.24 0.00 0.00 174.94 176.65 1q23 h GLU 140 N 0.85 0.00 -2.28 0.37 5.08 -2.02 -3.36 114.58 113.22 1q23 h GLU 140 Ca -0.41 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.33 1q23 h GLU 140 Cb 1.27 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.12 1q23 h GLU 140 CO 0.51 0.40 -0.44 0.27 -1.00 0.00 0.00 179.01 178.76 1q23 n ASN 141 N -3.85 4.34 -4.58 1.42 6.94 -1.26 -5.05 115.26 113.21 1q23 n ASN 141 Ca -0.01 -3.53 -0.24 0.00 -0.02 0.00 0.00 54.58 50.77 1q23 n ASN 141 Cb 0.46 -0.70 -0.08 0.00 -2.36 0.00 0.00 39.78 37.09 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 -2.89 2.09 0.37 -3.83 1.00 -1.26 -1.04 119.30 113.74 1q23 s MET 142 Ca 0.42 -1.44 0.09 0.00 0.00 0.00 0.00 55.69 54.76 1q23 s MET 142 Cb 0.18 -2.08 -0.07 0.00 0.00 0.00 0.00 34.83 32.87 1q23 s MET 142 CO -0.05 0.38 -0.04 -0.59 0.00 0.00 0.00 175.02 174.73 1q23 s PHE 143 N -2.15 2.47 -0.02 -0.03 -0.12 -0.55 -4.75 117.98 112.83 1q23 s PHE 143 Ca 0.29 -0.54 0.02 0.00 -0.05 0.00 0.00 56.93 56.65 1q23 s PHE 143 Cb -0.07 -1.54 -0.03 0.00 -0.63 0.00 0.00 43.02 40.75 1q23 s PHE 143 CO 0.17 0.51 -0.05 -0.06 -0.05 0.00 0.00 175.22 175.75 1q23 s PHE 144 N -2.62 2.96 -0.03 3.49 0.40 -0.46 0.53 117.98 122.25 1q23 s PHE 144 Ca 0.34 0.02 -0.01 0.00 -0.60 0.00 0.00 56.93 56.68 1q23 s PHE 144 Cb 0.04 -1.65 0.03 0.00 0.51 0.00 0.00 43.02 41.94 1q23 s PHE 144 CO 0.18 0.39 0.05 0.08 0.70 0.00 0.00 175.22 176.62 1q23 s VAL 145 N -0.97 -0.04 -0.02 -0.44 1.01 -0.18 -1.55 120.40 118.21 1q23 s VAL 145 Ca 0.16 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.33 1q23 s VAL 145 Cb -0.11 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 36.17 1q23 s VAL 145 CO 0.07 0.07 -0.07 -0.55 0.00 0.00 0.00 175.10 174.61 1q23 s SER 146 N 0.86 0.96 -0.13 3.32 0.15 -0.70 -2.18 113.70 115.97 1q23 s SER 146 Ca -0.07 -0.14 -0.06 0.00 0.70 0.00 0.00 55.95 56.37 1q23 s SER 146 Cb -0.10 -0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 63.92 1q23 s SER 146 CO -0.03 0.05 0.10 0.00 1.20 0.00 0.00 173.24 174.55 1q23 s ALA 147 N 0.20 3.65 -0.47 5.45 0.00 -1.26 -0.67 121.76 128.66 1q23 s ALA 147 Ca -0.03 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.27 1q23 s ALA 147 Cb -0.07 -1.87 0.16 0.00 0.00 0.00 0.00 23.12 21.33 1q23 s ALA 147 CO 0.00 0.49 0.33 1.21 0.00 0.00 0.00 175.76 177.79 1q23 s ASN 148 N -0.62 2.89 -0.06 0.00 3.84 0.77 -4.93 114.94 116.84 1q23 s ASN 148 Ca 0.12 -2.98 0.14 0.00 0.21 0.00 0.00 52.86 50.35 1q23 s ASN 148 Cb -0.12 -0.82 0.51 0.00 -0.55 0.00 0.00 41.25 40.27 1q23 s ASN 148 CO 0.02 -0.20 1.39 -0.81 -2.79 0.00 0.00 177.10 174.71 1q23 n PRO 149 N 3.03 2.75 0.11 0.43 -0.04 -1.26 -2.30 135.00 137.72 1q23 n PRO 149 Ca 0.20 -2.01 0.05 0.00 -0.04 0.00 0.00 63.50 61.69 1q23 n PRO 149 Cb 0.40 -1.63 0.00 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 3.00 0.00 -3.33 0.54 6.55 -1.93 -3.42 115.95 117.36 1q23 h TRP 150 Ca 0.00 0.00 -0.53 0.00 0.95 0.00 0.00 58.89 59.31 1q23 h TRP 150 Cb 0.99 0.00 -0.35 0.00 -0.86 0.00 0.00 29.16 28.95 1q23 h TRP 150 CO 0.50 0.34 -0.81 0.08 -1.05 0.00 0.00 178.44 177.50 1q23 s VAL 151 N -3.07 1.16 -1.22 1.49 1.01 -1.25 -4.91 120.40 113.60 1q23 s VAL 151 Ca 0.01 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 1q23 s VAL 151 Cb 0.08 -1.09 0.18 0.00 0.00 0.00 0.00 36.38 35.55 1q23 s VAL 151 CO 0.77 0.37 1.52 -1.20 0.00 0.00 0.00 175.10 176.55 1q23 n SER 152 N 4.18 5.24 -4.79 3.32 7.64 -1.26 -0.65 113.62 127.29 1q23 n SER 152 Ca -0.20 -3.02 -0.36 0.00 1.01 0.00 0.00 58.87 56.31 1q23 n SER 152 Cb 0.51 -1.54 -0.05 0.00 -1.01 0.00 0.00 64.21 62.13 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 1.07 3.28 -0.51 1.43 -0.12 -1.26 -4.94 117.98 116.93 1q23 s PHE 153 Ca 0.41 1.65 0.24 0.00 -0.05 0.00 0.00 56.93 59.18 1q23 s PHE 153 Cb -0.00 -3.05 0.33 0.00 -0.63 0.00 0.00 43.02 39.66 1q23 s PHE 153 CO 0.00 -0.48 1.37 1.79 -0.05 0.00 0.00 175.22 177.85 1q23 h THR 154 N 2.11 0.00 -3.33 -4.49 1.35 -2.00 -3.44 112.91 103.11 1q23 h THR 154 Ca -0.48 -0.71 -0.19 0.00 -0.55 0.00 0.00 66.41 64.48 1q23 h THR 154 Cb 1.21 1.41 -0.26 0.00 -1.73 0.00 0.00 68.15 68.78 1q23 h THR 154 CO 0.62 0.00 -0.52 -0.55 -0.25 0.00 0.00 175.52 174.82 1q23 s SER 155 N -4.92 -0.17 -0.10 5.36 0.15 -1.26 -4.81 113.70 107.94 1q23 s SER 155 Ca 0.05 0.32 0.01 0.00 0.70 0.00 0.00 55.95 57.04 1q23 s SER 155 Cb 0.11 0.34 0.02 0.00 -1.71 0.00 0.00 66.02 64.77 1q23 s SER 155 CO 0.71 -0.06 -0.12 0.12 1.20 0.00 0.00 173.24 175.09 1q23 s PHE 156 N 0.06 1.70 -0.05 3.44 5.36 -1.26 -5.11 117.98 122.12 1q23 s PHE 156 Ca -0.00 -0.79 0.01 0.00 -0.96 0.00 0.00 56.93 55.18 1q23 s PHE 156 Cb -0.01 -1.29 0.02 0.00 -0.34 0.00 0.00 43.02 41.40 1q23 s PHE 156 CO 0.00 -0.45 -0.04 -0.51 -1.46 0.00 0.00 175.22 172.76 1q23 s ASP 157 N 1.16 1.19 -0.22 6.13 1.01 -1.26 -4.73 116.67 119.95 1q23 s ASP 157 Ca -0.04 -0.14 -0.08 0.00 0.71 0.00 0.00 52.55 52.99 1q23 s ASP 157 Cb -0.14 -0.50 -0.04 0.00 1.01 0.00 0.00 42.92 43.25 1q23 s ASP 157 CO -0.03 -0.07 0.09 -0.22 0.21 0.00 0.00 175.17 175.15 1q23 s LEU 158 N 1.12 3.80 -0.42 1.23 0.20 -1.26 -5.03 118.68 118.31 1q23 s LEU 158 Ca -0.08 0.01 0.01 0.00 0.69 0.00 0.00 54.13 54.75 1q23 s LEU 158 Cb -0.14 -2.00 0.11 0.00 -0.43 0.00 0.00 46.19 43.74 1q23 s LEU 158 CO -0.01 0.08 0.18 0.21 -0.29 0.00 0.00 176.35 176.52 1q23 s ASN 159 N 0.95 4.95 0.18 3.68 3.04 -1.26 -4.91 114.94 121.57 1q23 s ASN 159 Ca 0.05 -2.30 -0.29 0.00 0.04 0.00 0.00 52.86 50.36 1q23 s ASN 159 Cb -0.14 -1.73 -0.08 0.00 -1.54 0.00 0.00 41.25 37.76 1q23 s ASN 159 CO 0.03 -0.42 0.90 -0.69 -3.04 0.00 0.00 177.10 173.88 1q23 s VAL 160 N 0.73 4.27 0.21 -5.21 1.01 -1.26 -4.98 120.40 115.16 1q23 s VAL 160 Ca 0.11 1.98 -0.02 0.00 0.00 0.00 0.00 61.98 64.05 1q23 s VAL 160 Cb -0.21 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 1q23 s VAL 160 CO -0.05 0.46 1.54 0.00 0.00 0.00 0.00 175.10 177.05 1q23 h ALA 161 N 4.60 0.77 -3.32 5.51 0.00 -2.06 -3.40 119.26 121.36 1q23 h ALA 161 Ca -0.45 -0.49 -0.60 0.00 0.00 0.00 0.00 54.91 53.38 1q23 h ALA 161 Cb 1.20 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 18.50 1q23 h ALA 161 CO 0.69 0.67 -0.75 1.21 0.00 0.00 0.00 179.25 181.07 1q23 s ASN 162 N -6.89 4.09 0.00 0.00 2.47 -1.26 -4.98 114.94 108.37 1q23 s ASN 162 Ca -0.07 -1.64 0.18 0.00 0.42 0.00 0.00 52.86 51.74 1q23 s ASN 162 Cb 0.12 -1.04 0.50 0.00 -1.45 0.00 0.00 41.25 39.38 1q23 s ASN 162 CO 0.83 -0.38 1.42 1.15 -3.72 0.00 0.00 177.10 176.40 1q23 n MET 163 N 4.72 2.28 -1.67 0.43 0.00 -1.26 -4.85 117.12 116.77 1q23 n MET 163 Ca -0.02 -1.99 -0.47 0.00 0.00 0.00 0.00 57.70 55.22 1q23 n MET 163 Cb 0.43 -1.44 -0.04 0.00 0.00 0.00 0.00 33.22 32.16 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 1.12 3.14 -1.25 3.17 8.00 -1.26 -1.92 116.55 127.55 1q23 n ASP 164 Ca 0.19 1.05 -0.13 0.00 0.71 0.00 0.00 54.79 56.61 1q23 n ASP 164 Cb 0.47 -1.40 -0.06 0.00 -0.02 0.00 0.00 41.12 40.12 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 4.38 -3.96 -4.52 -2.24 3.02 -1.26 -4.87 115.26 105.82 1q23 n ASN 165 Ca 0.19 0.32 -0.43 0.00 -0.03 0.00 0.00 54.58 54.63 1q23 n ASN 165 Cb 0.28 -3.47 -0.01 0.00 -0.61 0.00 0.00 39.78 35.97 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 -2.06 3.02 -1.22 3.10 5.36 -0.81 -4.62 117.98 120.75 1q23 s PHE 166 Ca 0.00 -1.59 0.19 0.00 -0.96 0.00 0.00 56.93 54.58 1q23 s PHE 166 Cb 0.00 -4.52 -0.13 0.00 -0.34 0.00 0.00 43.02 38.03 1q23 s PHE 166 CO 0.00 -1.65 0.87 1.19 -1.46 0.00 0.00 175.22 174.17 1q23 n PHE 167 N 7.30 0.00 -2.32 10.12 3.72 -1.26 -4.40 117.46 130.61 1q23 n PHE 167 Ca 0.37 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.35 1q23 n PHE 167 Cb 0.47 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.98 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 -2.59 3.50 0.59 4.37 0.00 -1.26 -4.73 121.76 121.63 1q23 s ALA 168 Ca 0.10 0.40 -0.20 0.00 0.00 0.00 0.00 51.96 52.26 1q23 s ALA 168 Cb 0.15 -3.72 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 1q23 s ALA 168 CO 0.68 -1.52 1.34 -2.14 0.00 0.00 0.00 175.76 174.11 1q23 s PRO 169 N 3.98 2.91 -0.17 0.00 0.02 -1.26 -4.80 135.00 135.67 1q23 s PRO 169 Ca 0.60 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.81 1q23 s PRO 169 Cb -0.22 -2.10 0.04 0.00 0.02 0.00 0.00 34.50 32.24 1q23 s PRO 169 CO 0.21 -1.36 -0.09 0.08 -0.33 0.00 0.00 177.00 175.52 1q23 s VAL 170 N -1.33 1.36 0.03 3.83 1.01 -1.05 -1.36 120.40 122.89 1q23 s VAL 170 Ca 0.76 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1q23 s VAL 170 Cb -0.40 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1q23 s VAL 170 CO 0.45 0.22 0.05 -0.36 0.00 0.00 0.00 175.10 175.46 1q23 s PHE 171 N 1.54 3.16 -0.05 5.22 0.40 -0.59 -0.14 117.98 127.52 1q23 s PHE 171 Ca 0.01 0.11 -0.00 0.00 -0.60 0.00 0.00 56.93 56.45 1q23 s PHE 171 Cb -0.15 -1.67 0.03 0.00 0.51 0.00 0.00 43.02 41.74 1q23 s PHE 171 CO -0.08 0.51 -0.01 0.99 0.70 0.00 0.00 175.22 177.33 1q23 s THR 172 N -1.21 0.34 -0.15 0.64 2.01 -0.37 -1.72 115.64 115.17 1q23 s THR 172 Ca 0.23 0.07 -0.07 0.00 0.31 0.00 0.00 61.69 62.24 1q23 s THR 172 Cb -0.12 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 71.89 1q23 s THR 172 CO 0.15 0.22 0.08 -0.04 -0.69 0.00 0.00 174.62 174.35 1q23 s MET 173 N 1.52 3.68 0.13 4.92 1.00 0.15 -0.80 119.30 129.90 1q23 s MET 173 Ca -0.02 -0.27 0.02 0.00 0.00 0.00 0.00 55.69 55.41 1q23 s MET 173 Cb -0.13 -3.16 0.02 0.00 0.00 0.00 0.00 34.83 31.56 1q23 s MET 173 CO -0.03 0.50 0.17 0.41 0.00 0.00 0.00 175.02 176.07 1q23 n GLY 174 N 2.84 2.02 3.64 -0.03 0.00 -0.37 -0.16 105.19 113.13 1q23 n GLY 174 Ca -0.18 -2.16 -0.43 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 -2.57 4.08 0.67 1.61 2.20 0.17 -4.54 119.74 121.36 1q23 s LYS 175 Ca 0.13 1.20 -0.13 0.00 -0.36 0.00 0.00 55.97 56.81 1q23 s LYS 175 Cb -0.01 -3.75 -0.00 0.00 -1.51 0.00 0.00 37.83 32.56 1q23 s LYS 175 CO 0.08 -0.88 1.07 1.52 -0.36 0.00 0.00 175.35 176.78 1q23 s TYR 176 N 3.70 2.92 0.15 4.03 -0.85 -1.26 -4.28 117.35 121.75 1q23 s TYR 176 Ca 0.48 1.49 -0.18 0.00 -0.52 0.00 0.00 57.07 58.34 1q23 s TYR 176 Cb -0.14 -2.99 0.04 0.00 0.38 0.00 0.00 41.96 39.25 1q23 s TYR 176 CO 0.15 -1.34 0.46 1.52 -1.52 0.00 0.00 175.55 174.82 1q23 s TYR 177 N -2.73 -0.24 0.18 -3.49 -0.85 0.08 -4.99 117.35 105.31 1q23 s TYR 177 Ca 0.62 -0.07 -0.17 0.00 -0.52 0.00 0.00 57.07 56.93 1q23 s TYR 177 Cb -0.16 0.34 -0.07 0.00 0.38 0.00 0.00 41.96 42.45 1q23 s TYR 177 CO 0.47 -0.78 0.63 0.99 -1.52 0.00 0.00 175.55 175.34 1q23 s THR 178 N -3.81 4.72 -0.19 -3.49 2.01 -1.26 -1.27 115.64 112.35 1q23 s THR 178 Ca 0.04 1.05 -0.04 0.00 0.31 0.00 0.00 61.69 63.06 1q23 s THR 178 Cb 0.01 -3.80 0.09 0.00 0.01 0.00 0.00 72.50 68.81 1q23 s THR 178 CO -0.10 0.25 0.29 -1.58 -0.69 0.00 0.00 174.62 172.78 1q23 s GLN 179 N -1.92 0.22 7.93 4.92 0.74 -0.20 -4.94 119.66 126.42 1q23 s GLN 179 Ca 0.40 0.54 0.00 0.00 0.05 0.00 0.00 55.36 56.34 1q23 s GLN 179 Cb -0.16 -0.50 0.00 0.00 1.10 0.00 0.00 33.01 33.45 1q23 s GLN 179 CO 0.20 -0.49 0.00 0.41 -0.55 0.00 0.00 175.29 174.86 1q23 n GLY 180 N 5.35 3.74 1.15 2.59 0.00 -1.26 -1.67 105.19 115.09 1q23 n GLY 180 Ca -0.05 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 5.64 3.53 -4.80 1.61 9.92 -1.26 -4.98 116.55 126.21 1q23 n ASP 181 Ca 0.00 -1.98 -0.25 0.00 -0.53 0.00 0.00 54.79 52.03 1q23 n ASP 181 Cb 0.00 -0.32 -0.05 0.00 -0.64 0.00 0.00 41.12 40.11 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 -1.27 2.90 -0.26 -1.24 1.02 -0.67 -5.06 119.74 115.16 1q23 s LYS 182 Ca 0.40 -0.92 -0.05 0.00 0.02 0.00 0.00 55.97 55.42 1q23 s LYS 182 Cb 0.22 -2.62 -0.00 0.00 -0.52 0.00 0.00 37.83 34.91 1q23 s LYS 182 CO 0.30 0.46 0.02 0.08 -0.92 0.00 0.00 175.35 175.29 1q23 s VAL 183 N -1.85 3.68 0.09 3.17 1.01 -1.26 -1.03 120.40 124.20 1q23 s VAL 183 Ca 0.31 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.77 1q23 s VAL 183 Cb -0.09 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1q23 s VAL 183 CO 0.24 0.26 -0.06 -0.76 0.00 0.00 0.00 175.10 174.78 1q23 s LEU 184 N 1.49 3.23 -0.09 3.92 1.43 -0.40 0.36 118.68 128.62 1q23 s LEU 184 Ca 0.04 -0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1q23 s LEU 184 Cb -0.16 -1.97 0.03 0.00 0.03 0.00 0.00 46.19 44.11 1q23 s LEU 184 CO -0.00 0.19 -0.04 -0.32 0.23 0.00 0.00 176.35 176.41 1q23 s MET 185 N -2.14 1.10 0.24 1.70 1.75 0.47 -0.74 119.30 121.66 1q23 s MET 185 Ca 0.23 -0.09 -0.31 0.00 -1.25 0.00 0.00 55.69 54.26 1q23 s MET 185 Cb -0.11 -1.29 -0.12 0.00 2.84 0.00 0.00 34.83 36.15 1q23 s MET 185 CO 0.15 -0.27 1.59 -2.30 -0.65 0.00 0.00 175.02 173.54 1q23 n PRO 186 N 4.99 2.50 -3.67 4.11 -0.02 -1.26 -2.15 135.00 139.50 1q23 n PRO 186 Ca -0.11 0.90 -0.19 0.00 -2.02 0.00 0.00 63.50 62.08 1q23 n PRO 186 Cb 0.50 -2.67 -0.17 0.00 -0.02 0.00 0.00 33.50 31.14 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 0.32 0.12 0.12 2.45 2.96 0.60 -1.23 118.68 124.02 1q23 s LEU 187 Ca 0.70 0.14 0.07 0.00 -0.22 0.00 0.00 54.13 54.82 1q23 s LEU 187 Cb -0.56 -0.04 -0.04 0.00 0.50 0.00 0.00 46.19 46.05 1q23 s LEU 187 CO 0.42 -0.24 -0.05 0.00 -1.32 0.00 0.00 176.35 175.16 1q23 s ALA 188 N 2.16 3.10 -0.04 5.97 0.00 0.02 0.18 121.76 133.14 1q23 s ALA 188 Ca 0.04 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.74 1q23 s ALA 188 Cb -0.12 -0.98 0.03 0.00 0.00 0.00 0.00 23.12 22.05 1q23 s ALA 188 CO -0.04 0.61 0.02 -1.50 0.00 0.00 0.00 175.76 174.85 1q23 s ILE 189 N -1.40 0.13 -0.19 0.00 1.10 -0.00 -1.24 121.20 119.60 1q23 s ILE 189 Ca 0.24 0.20 -0.06 0.00 -0.51 0.00 0.00 60.65 60.52 1q23 s ILE 189 Cb -0.11 -0.28 -0.03 0.00 0.15 0.00 0.00 42.46 42.19 1q23 s ILE 189 CO 0.16 0.17 0.03 -1.58 -2.11 0.00 0.00 174.94 171.61 1q23 s GLN 190 N 1.54 3.78 0.17 3.50 -0.44 0.81 -1.97 119.66 127.05 1q23 s GLN 190 Ca -0.03 -0.44 0.04 0.00 -2.50 0.00 0.00 55.36 52.43 1q23 s GLN 190 Cb -0.13 -3.13 -0.05 0.00 -1.64 0.00 0.00 33.01 28.07 1q23 s GLN 190 CO -0.03 0.14 -0.08 0.14 0.50 0.00 0.00 175.29 175.97 1q23 s VAL 191 N 0.68 1.15 -0.15 1.34 -7.23 -0.58 -2.52 120.40 113.10 1q23 s VAL 191 Ca 0.01 -2.06 -0.19 0.00 -1.81 0.00 0.00 61.98 57.93 1q23 s VAL 191 Cb -0.14 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 1q23 s VAL 191 CO 0.02 -0.62 0.51 -2.28 -0.31 0.00 0.00 175.10 172.42 1q23 s HIS 192 N -3.34 3.46 0.48 2.82 2.46 -1.26 -1.85 115.29 118.06 1q23 s HIS 192 Ca 0.20 0.88 0.20 0.00 0.47 0.00 0.00 55.06 56.81 1q23 s HIS 192 Cb 0.03 -2.62 1.22 0.00 -0.13 0.00 0.00 32.58 31.08 1q23 s HIS 192 CO 0.03 0.06 1.96 1.25 -2.47 0.00 0.00 174.74 175.57 1q23 h HIS 193 N 7.01 0.24 -0.43 3.88 2.76 -1.20 0.40 115.15 127.81 1q23 h HIS 193 Ca -0.38 0.01 0.04 0.00 -2.20 0.00 0.00 60.37 57.83 1q23 h HIS 193 Cb 1.17 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 30.03 1q23 h HIS 193 CO 0.65 0.10 0.29 0.00 -1.30 0.00 0.00 177.93 177.67 1q23 h ALA 194 N 1.69 1.85 0.00 5.26 0.00 -1.78 -3.19 119.26 123.10 1q23 h ALA 194 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1q23 h ALA 194 Cb 0.89 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1q23 h ALA 194 CO -0.06 0.09 -1.01 1.33 0.00 0.00 0.00 179.25 179.60 1q23 n VAL 195 N -4.48 0.00 -3.96 0.00 0.24 0.02 -4.56 118.33 105.59 1q23 n VAL 195 Ca 0.05 -0.24 -0.09 0.00 -2.04 0.00 0.00 64.34 62.01 1q23 n VAL 195 Cb 0.17 0.67 -0.10 0.00 -1.47 0.00 0.00 33.84 33.11 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 -1.68 3.69 0.17 0.00 -0.00 -1.26 -4.08 116.67 113.51 1q23 s ASP 197 Ca -0.12 -1.23 -0.20 0.00 -0.00 0.00 0.00 52.55 51.00 1q23 s ASP 197 Cb -0.07 -0.34 0.10 0.00 -0.00 0.00 0.00 42.92 42.61 1q23 s ASP 197 CO -0.02 -0.26 1.33 0.61 -0.00 0.00 0.00 175.17 176.83 1q23 n GLY 198 N -0.81 -1.95 0.30 0.21 0.00 -1.26 -1.27 105.19 100.41 1q23 n GLY 198 Ca -0.05 0.99 -0.06 0.00 0.00 0.00 0.00 46.02 46.89 1q23 n GLY 198 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1q23 h PHE 199 N 0.00 -0.72 -0.87 1.61 3.04 -1.98 0.30 116.94 118.32 1q23 h PHE 199 Ca 0.24 0.05 0.01 0.00 3.98 0.00 0.00 57.97 62.25 1q23 h PHE 199 Cb 0.45 0.38 -0.04 0.00 2.56 0.00 0.00 35.95 39.30 1q23 h PHE 199 CO -0.80 -0.34 0.58 0.45 -2.02 0.00 0.00 178.31 176.17 1q23 h HIS 200 N -0.19 1.09 -0.31 0.41 -0.00 -1.57 0.43 115.15 115.00 1q23 h HIS 200 Ca 0.19 0.03 -0.18 0.00 -0.00 0.00 0.00 60.37 60.41 1q23 h HIS 200 Cb 0.50 -0.37 -0.00 0.00 -0.00 0.00 0.00 27.41 27.54 1q23 h HIS 200 CO -0.50 0.68 -0.51 0.28 -0.00 0.00 0.00 177.93 177.88 1q23 h VAL 201 N 1.17 1.27 -0.34 2.45 2.07 -0.17 -2.67 116.25 120.04 1q23 h VAL 201 Ca 0.32 -1.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.12 1q23 h VAL 201 Cb -0.12 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1q23 h VAL 201 CO -0.07 0.55 0.09 1.23 0.02 0.00 0.00 177.57 179.39 1q23 h GLY 202 N 0.73 0.58 0.49 2.17 0.00 0.02 -1.36 103.07 105.70 1q23 h GLY 202 Ca 0.03 -0.36 0.09 0.00 0.00 0.00 0.00 47.33 47.08 1q23 h GLY 202 CO 0.12 0.34 0.35 -0.09 0.00 0.00 0.00 176.54 177.25 1q23 h ARG 203 N 0.40 0.58 -0.90 4.80 2.43 -0.22 0.45 114.38 121.92 1q23 h ARG 203 Ca 0.11 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1q23 h ARG 203 Cb 0.29 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 1q23 h ARG 203 CO 0.00 0.38 0.59 1.98 -1.51 0.00 0.00 179.97 181.41 1q23 h MET 204 N 0.60 1.14 0.06 0.20 4.05 -1.22 -2.05 114.93 117.71 1q23 h MET 204 Ca 0.34 -0.07 -0.25 0.00 -0.28 0.00 0.00 59.70 59.45 1q23 h MET 204 Cb 0.35 -0.26 0.00 0.00 -0.80 0.00 0.00 31.60 30.90 1q23 h MET 204 CO -0.26 0.75 -1.07 -0.07 0.23 0.00 0.00 176.91 176.49 1q23 h LEU 205 N 1.17 0.49 -0.05 3.39 3.38 -0.60 -0.63 115.31 122.45 1q23 h LEU 205 Ca 0.35 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1q23 h LEU 205 Cb -0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1q23 h LEU 205 CO -0.10 1.28 0.02 0.78 0.09 0.00 0.00 178.44 180.51 1q23 h ASN 206 N 0.16 0.08 -0.71 -0.43 2.35 -0.67 -2.42 115.58 113.93 1q23 h ASN 206 Ca -0.10 -0.18 0.14 0.00 -0.55 0.00 0.00 56.30 55.61 1q23 h ASN 206 Cb 1.74 -0.02 -0.10 0.00 0.05 0.00 0.00 38.32 39.99 1q23 h ASN 206 CO 0.18 0.24 0.20 -0.33 -1.65 0.00 0.00 177.43 176.07 1q23 h GLU 207 N -0.09 0.31 -0.36 0.81 5.08 -1.34 -1.24 114.58 117.74 1q23 h GLU 207 Ca 0.02 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1q23 h GLU 207 Cb 0.19 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 1q23 h GLU 207 CO -0.00 0.21 0.02 1.25 -1.00 0.00 0.00 179.01 179.48 1q23 h LEU 208 N 0.32 -0.11 -0.08 1.33 5.85 -0.98 0.34 115.31 121.98 1q23 h LEU 208 Ca 0.39 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 59.19 1q23 h LEU 208 Cb 0.63 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 1q23 h LEU 208 CO -0.45 -0.02 0.04 -0.61 -0.34 0.00 0.00 178.44 177.05 1q23 h GLN 209 N 0.12 0.11 -0.02 1.25 5.75 -1.12 -0.54 115.11 120.67 1q23 h GLN 209 Ca 0.18 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.68 1q23 h GLN 209 Cb 0.24 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.71 1q23 h GLN 209 CO -0.28 0.21 -0.54 1.96 -2.65 0.00 0.00 178.83 177.53 1q23 h GLN 210 N -0.01 -0.64 0.00 1.69 4.20 -0.88 -2.12 115.11 117.35 1q23 h GLN 210 Ca 0.03 0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 1q23 h GLN 210 Cb 0.13 0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1q23 h GLN 210 CO -0.00 -0.43 -0.16 1.88 -0.67 0.00 0.00 178.83 179.45 1q23 h TYR 211 N -0.66 0.00 -0.35 2.96 0.99 -0.05 -0.44 116.97 119.41 1q23 h TYR 211 Ca 0.01 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.61 1q23 h TYR 211 Cb 0.72 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.44 1q23 h TYR 211 CO -0.53 0.16 -0.30 0.00 -0.00 0.00 0.00 178.16 177.50 1q23 h ASP 213 N 0.61 0.00 0.00 0.00 3.32 -0.44 -3.18 116.42 116.73 1q23 h ASP 213 Ca 0.06 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.83 1q23 h ASP 213 Cb 0.87 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.37 1q23 h ASP 213 CO 0.08 0.30 -2.27 -0.62 -1.72 0.00 0.00 179.24 175.01 1q23 n GLU 214 N -3.57 0.76 -1.49 3.56 1.02 -0.39 -4.88 120.64 115.65 1q23 n GLU 214 Ca -0.01 -0.05 -0.48 0.00 -0.02 0.00 0.00 57.16 56.60 1q23 n GLU 214 Cb 0.44 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.32 1q23 n GLU 214 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1q23 n TRP 215 N -2.62 0.37 -0.03 -0.32 -0.00 0.03 -4.90 117.44 109.98 1q23 n TRP 215 Ca -0.26 0.86 0.03 0.00 -0.00 0.00 0.00 57.50 58.13 1q23 n TRP 215 Cb 1.02 -2.10 -0.11 0.00 -0.00 0.00 0.00 31.31 30.12 1q23 n TRP 215 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 177.69 178.63 1q23 n GLN 216 N 1.09 0.88 0.00 5.87 -0.06 -1.26 -4.98 117.38 118.92 1q23 n GLN 216 Ca 0.15 -0.09 0.00 0.00 -2.00 0.00 0.00 57.00 55.06 1q23 n GLN 216 Cb 0.25 -1.34 0.00 0.00 -4.06 0.00 0.00 30.24 25.09 1q23 n GLN 216 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1q23 n GLY 217 N 1.84 1.09 0.17 1.69 0.00 -1.26 -5.09 105.19 103.64 1q23 n GLY 217 Ca -0.09 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.95 1q23 n GLY 217 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93