#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuq n SER 2 N 0.00 -1.15 -4.47 1.61 2.88 -1.26 -4.70 113.62 106.53 2yuq n SER 2 Ca 0.00 -1.17 -0.54 0.00 -1.33 0.00 0.00 58.87 55.83 2yuq n SER 2 Cb 0.00 -1.49 -0.06 0.00 -0.75 0.00 0.00 64.21 61.92 2yuq n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2yuq n SER 3 N -2.32 -0.30 -2.98 -3.46 3.41 -1.26 -4.91 113.62 101.80 2yuq n SER 3 Ca 0.02 1.15 -0.14 0.00 -0.26 0.00 0.00 58.87 59.64 2yuq n SER 3 Cb 0.47 -0.96 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2yuq n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yuq n GLY 4 N 1.74 2.66 3.12 5.00 0.00 -1.26 -5.11 105.19 111.34 2yuq n GLY 4 Ca 0.19 -1.35 -0.08 0.00 0.00 0.00 0.00 46.02 44.78 2yuq n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuq s SER 5 N -2.45 0.40 -0.29 1.61 0.01 -1.26 -5.16 113.70 106.55 2yuq s SER 5 Ca 0.34 -0.92 -0.14 0.00 1.31 0.00 0.00 55.95 56.53 2yuq s SER 5 Cb 0.38 0.24 0.10 0.00 0.21 0.00 0.00 66.02 66.95 2yuq s SER 5 CO -0.05 -0.64 0.71 -0.44 0.41 0.00 0.00 173.24 173.24 2yuq s SER 6 N -2.91 -0.96 -0.11 2.44 0.01 -1.26 -5.16 113.70 105.75 2yuq s SER 6 Ca 0.07 1.45 0.01 0.00 1.31 0.00 0.00 55.95 58.79 2yuq s SER 6 Cb 0.07 1.65 -0.01 0.00 0.21 0.00 0.00 66.02 67.93 2yuq s SER 6 CO -0.10 -0.22 -0.15 -0.83 0.41 0.00 0.00 173.24 172.36 2yuq s GLY 7 N 2.00 1.51 -0.24 3.44 0.00 -1.26 -5.00 107.32 107.77 2yuq s GLY 7 Ca -0.09 -0.91 -0.03 0.00 0.00 0.00 0.00 44.72 43.69 2yuq s GLY 7 CO -0.19 -0.29 -0.24 1.18 0.00 0.00 0.00 173.10 173.55 2yuq n GLU 8 N 3.35 0.57 -1.58 2.90 4.71 -1.26 -4.56 120.64 124.77 2yuq n GLU 8 Ca -0.18 0.17 -0.30 0.00 -0.01 0.00 0.00 57.16 56.84 2yuq n GLU 8 Cb 0.53 -1.44 0.06 0.00 -1.01 0.00 0.00 31.44 29.58 2yuq n GLU 8 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2yuq n ASP 9 N -3.49 6.44 -0.04 1.62 2.03 -1.26 -4.60 116.55 117.25 2yuq n ASP 9 Ca -0.44 -3.77 -0.08 0.00 0.52 0.00 0.00 54.79 51.02 2yuq n ASP 9 Cb 0.91 -0.72 -0.03 0.00 -0.72 0.00 0.00 41.12 40.56 2yuq n ASP 9 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2yuq n ASN 10 N -0.85 1.44 -4.75 1.67 4.13 -1.26 -5.06 115.26 110.58 2yuq n ASN 10 Ca 0.55 0.23 -0.23 0.00 1.68 0.00 0.00 54.58 56.81 2yuq n ASN 10 Cb 0.81 -0.53 -0.06 0.00 -1.54 0.00 0.00 39.78 38.46 2yuq n ASN 10 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2yuq s ARG 11 N -2.44 2.68 -0.01 3.52 0.52 -1.26 -5.14 118.95 116.82 2yuq s ARG 11 Ca -0.17 -1.15 0.01 0.00 -0.52 0.00 0.00 55.73 53.90 2yuq s ARG 11 Cb 0.04 -2.43 -0.00 0.00 0.52 0.00 0.00 34.95 33.08 2yuq s ARG 11 CO 0.24 0.40 -0.04 0.50 0.02 0.00 0.00 175.30 176.42 2yuq s ARG 12 N -3.63 0.38 1.13 3.54 3.52 -1.26 -4.98 118.95 117.66 2yuq s ARG 12 Ca 0.32 -0.15 -0.17 0.00 -0.13 0.00 0.00 55.73 55.60 2yuq s ARG 12 Cb -0.08 -0.38 0.25 0.00 -1.56 0.00 0.00 34.95 33.19 2yuq s ARG 12 CO 0.23 0.08 1.10 -1.25 -0.81 0.00 0.00 175.30 174.65 2yuq s PRO 13 N -0.03 -0.68 -0.16 5.12 0.04 -1.26 -5.03 135.00 133.00 2yuq s PRO 13 Ca 0.01 0.13 -0.02 0.00 0.04 0.00 0.00 61.00 61.16 2yuq s PRO 13 Cb -0.03 -1.64 -0.09 0.00 0.04 0.00 0.00 34.50 32.78 2yuq s PRO 13 CO -0.00 -3.39 -0.17 1.28 0.04 0.00 0.00 177.00 174.76 2yuq n LEU 14 N -4.57 2.29 0.00 -3.56 7.99 -1.26 -5.06 117.00 112.83 2yuq n LEU 14 Ca 0.10 0.03 -0.19 0.00 -0.01 0.00 0.00 56.01 55.94 2yuq n LEU 14 Cb 0.59 -0.52 -0.00 0.00 -0.11 0.00 0.00 43.42 43.37 2yuq n LEU 14 CO 0.50 0.60 0.03 0.79 -1.51 0.00 0.00 177.39 177.80 2yuq n TRP 15 N -3.26 -0.75 -3.42 -1.77 7.02 -1.26 -5.13 117.44 108.87 2yuq n TRP 15 Ca -0.30 -1.63 -0.32 0.00 -1.02 0.00 0.00 57.50 54.23 2yuq n TRP 15 Cb 0.77 -0.31 -0.05 0.00 -2.42 0.00 0.00 31.31 29.30 2yuq n TRP 15 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2yuq s GLU 16 N -3.55 3.81 -0.01 -0.99 2.02 -1.26 -5.02 118.70 113.69 2yuq s GLU 16 Ca 0.20 0.28 -0.25 0.00 0.02 0.00 0.00 54.97 55.22 2yuq s GLU 16 Cb -0.02 -2.68 -0.19 0.00 0.10 0.00 0.00 34.13 31.34 2yuq s GLU 16 CO 0.13 0.34 1.28 -1.00 0.02 0.00 0.00 175.26 176.03 2yuq h PRO 17 N 2.66 0.09 -0.71 0.39 0.13 -2.01 -3.25 132.00 129.29 2yuq h PRO 17 Ca -0.47 -0.05 0.06 0.00 -0.87 0.00 0.00 66.00 64.67 2yuq h PRO 17 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 2yuq h PRO 17 CO 0.69 0.55 0.41 1.49 -0.23 0.00 0.00 178.00 180.91 2yuq h GLU 18 N -0.37 0.73 -7.00 0.86 4.22 -2.06 -3.42 114.58 107.53 2yuq h GLU 18 Ca 0.01 -0.04 -0.52 0.00 0.08 0.00 0.00 59.36 58.88 2yuq h GLU 18 Cb 0.54 -0.17 0.08 0.00 0.50 0.00 0.00 28.75 29.70 2yuq h GLU 18 CO 0.01 0.49 0.53 -1.21 -2.18 0.00 0.00 179.01 176.65 2yuq s GLU 19 N -6.09 3.65 -0.10 1.92 0.41 -1.23 -4.97 118.70 112.30 2yuq s GLU 19 Ca -0.13 1.94 -0.30 0.00 -0.41 0.00 0.00 54.97 56.08 2yuq s GLU 19 Cb 0.17 -2.44 -0.02 0.00 -1.78 0.00 0.00 34.13 30.06 2yuq s GLU 19 CO 0.77 -0.69 1.08 0.99 -0.49 0.00 0.00 175.26 176.92 2yuq s THR 20 N -1.44 4.60 -0.11 3.63 2.01 -1.26 -4.82 115.64 118.24 2yuq s THR 20 Ca 0.64 1.89 0.02 0.00 0.31 0.00 0.00 61.69 64.55 2yuq s THR 20 Cb -0.33 -4.21 0.01 0.00 0.01 0.00 0.00 72.50 67.98 2yuq s THR 20 CO 0.40 -0.02 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.45 2yuq s VAL 21 N 2.21 1.66 0.19 3.82 1.01 -1.26 -2.97 120.40 125.06 2yuq s VAL 21 Ca 0.51 -0.75 0.10 0.00 0.00 0.00 0.00 61.98 61.84 2yuq s VAL 21 Cb -0.20 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2yuq s VAL 21 CO 0.18 0.47 -0.16 0.68 0.00 0.00 0.00 175.10 176.28 2yuq s VAL 22 N 0.88 2.83 0.09 2.92 -7.23 0.02 -2.21 120.40 117.71 2yuq s VAL 22 Ca -0.08 -1.85 0.09 0.00 -1.81 0.00 0.00 61.98 58.34 2yuq s VAL 22 Cb -0.15 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2yuq s VAL 22 CO -0.01 -0.13 -0.23 -0.63 -0.31 0.00 0.00 175.10 173.79 2yuq s ILE 23 N -1.74 2.48 -0.31 -0.62 1.09 0.94 0.35 121.20 123.39 2yuq s ILE 23 Ca 0.24 -1.51 -0.17 0.00 -1.10 0.00 0.00 60.65 58.11 2yuq s ILE 23 Cb -0.08 -2.07 -0.02 0.00 -1.06 0.00 0.00 42.46 39.23 2yuq s ILE 23 CO 0.13 0.20 0.46 0.00 -0.10 0.00 0.00 174.94 175.63 2yuq s ALA 24 N -1.00 3.53 0.48 9.38 0.00 -1.15 0.68 121.76 133.68 2yuq s ALA 24 Ca 0.15 -0.89 0.15 0.00 0.00 0.00 0.00 51.96 51.37 2yuq s ALA 24 Cb -0.10 -2.88 1.14 0.00 0.00 0.00 0.00 23.12 21.27 2yuq s ALA 24 CO 0.06 -0.95 2.07 -0.07 0.00 0.00 0.00 175.76 176.87 2yuq h LEU 25 N 8.85 0.00 -8.66 0.00 3.38 -1.13 -2.89 115.31 114.86 2yuq h LEU 25 Ca -0.29 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.41 2yuq h LEU 25 Cb 1.14 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.74 2yuq h LEU 25 CO 0.72 0.10 -0.61 -0.31 0.09 0.00 0.00 178.44 178.42 2yuq s TYR 26 N -4.83 1.25 -0.85 1.13 1.51 -1.26 -4.70 117.35 109.61 2yuq s TYR 26 Ca -0.04 -1.37 -0.18 0.00 -1.01 0.00 0.00 57.07 54.47 2yuq s TYR 26 Cb 0.16 -0.62 0.14 0.00 -0.11 0.00 0.00 41.96 41.53 2yuq s TYR 26 CO 0.68 -0.61 0.99 0.16 -1.11 0.00 0.00 175.55 175.66 2yuq s ASP 27 N -3.20 6.56 0.77 2.29 -4.77 -1.26 -3.66 116.67 113.41 2yuq s ASP 27 Ca 0.39 -2.02 -0.11 0.00 -3.30 0.00 0.00 52.55 47.51 2yuq s ASP 27 Cb 0.07 -2.35 0.06 0.00 -1.09 0.00 0.00 42.92 39.61 2yuq s ASP 27 CO 0.13 -1.00 1.10 -0.47 0.70 0.00 0.00 175.17 175.63 2yuq s TYR 28 N 2.28 2.50 0.01 2.11 5.04 -0.44 -4.86 117.35 123.98 2yuq s TYR 28 Ca 0.26 1.58 -0.06 0.00 -2.44 0.00 0.00 57.07 56.41 2yuq s TYR 28 Cb -0.09 -3.09 -0.00 0.00 0.35 0.00 0.00 41.96 39.13 2yuq s TYR 28 CO -0.06 -1.88 0.11 1.14 -1.34 0.00 0.00 175.55 173.52 2yuq s GLN 29 N -4.80 0.47 -0.09 4.97 -2.07 -1.26 -2.94 119.66 113.94 2yuq s GLN 29 Ca 0.62 -0.46 -0.14 0.00 -1.82 0.00 0.00 55.36 53.57 2yuq s GLN 29 Cb -0.18 0.19 0.03 0.00 -1.09 0.00 0.00 33.01 31.97 2yuq s GLN 29 CO 0.55 -0.11 0.36 -0.08 -1.32 0.00 0.00 175.29 174.69 2yuq s THR 30 N -1.49 0.02 -0.37 3.63 -1.32 -1.26 -4.90 115.64 109.95 2yuq s THR 30 Ca -0.14 -0.16 0.23 0.00 -1.21 0.00 0.00 61.69 60.40 2yuq s THR 30 Cb -0.07 -0.57 -0.04 0.00 -1.51 0.00 0.00 72.50 70.31 2yuq s THR 30 CO 0.01 -0.09 1.05 -3.20 -2.21 0.00 0.00 174.62 170.18 2yuq n ASN 31 N 2.26 0.71 -4.84 8.08 5.15 -1.26 -4.87 115.26 120.49 2yuq n ASN 31 Ca -0.16 0.17 -0.35 0.00 -0.60 0.00 0.00 54.58 53.63 2yuq n ASN 31 Cb 0.57 0.57 -0.06 0.00 -0.53 0.00 0.00 39.78 40.33 2yuq n ASN 31 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2yuq s ASP 32 N -4.82 6.85 0.08 1.20 1.11 -1.26 -5.01 116.67 114.82 2yuq s ASP 32 Ca 0.01 1.14 -0.16 0.00 0.18 0.00 0.00 52.55 53.71 2yuq s ASP 32 Cb 0.11 -2.31 -0.10 0.00 1.07 0.00 0.00 42.92 41.69 2yuq s ASP 32 CO 0.79 0.06 1.40 1.55 1.18 0.00 0.00 175.17 180.15 2yuq h PRO 33 N 3.37 0.61 -0.81 8.23 0.13 -2.02 -3.20 132.00 138.31 2yuq h PRO 33 Ca -0.48 -0.32 0.17 0.00 -0.87 0.00 0.00 66.00 64.50 2yuq h PRO 33 Cb 1.19 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.22 2yuq h PRO 33 CO 0.66 0.92 0.32 1.96 -0.23 0.00 0.00 178.00 181.63 2yuq h GLN 34 N 0.32 0.40 -7.11 0.86 7.50 -1.94 -3.41 115.11 111.73 2yuq h GLN 34 Ca 0.04 -0.02 -0.49 0.00 0.50 0.00 0.00 58.65 58.67 2yuq h GLN 34 Cb 0.81 -0.09 0.03 0.00 0.05 0.00 0.00 27.48 28.27 2yuq h GLN 34 CO 0.06 0.26 0.28 -1.21 -1.50 0.00 0.00 178.83 176.72 2yuq s GLU 35 N -5.98 3.74 -0.00 1.46 2.02 -1.21 -3.07 118.70 115.66 2yuq s GLU 35 Ca -0.12 0.65 0.07 0.00 0.02 0.00 0.00 54.97 55.58 2yuq s GLU 35 Cb 0.22 -2.23 -0.03 0.00 0.10 0.00 0.00 34.13 32.20 2yuq s GLU 35 CO 0.77 -0.28 -0.21 -1.17 0.02 0.00 0.00 175.26 174.39 2yuq s LEU 36 N -4.43 2.38 -0.49 1.80 2.96 -1.03 -4.70 118.68 115.17 2yuq s LEU 36 Ca 0.54 -0.41 -0.19 0.00 -0.22 0.00 0.00 54.13 53.85 2yuq s LEU 36 Cb -0.10 -1.43 0.05 0.00 0.50 0.00 0.00 46.19 45.21 2yuq s LEU 36 CO 0.40 0.30 0.60 0.00 -1.32 0.00 0.00 176.35 176.33 2yuq s ALA 37 N -0.75 3.40 0.92 5.97 0.00 -1.26 -4.66 121.76 125.38 2yuq s ALA 37 Ca 0.12 -1.70 -0.11 0.00 0.00 0.00 0.00 51.96 50.27 2yuq s ALA 37 Cb -0.10 -3.31 0.15 0.00 0.00 0.00 0.00 23.12 19.86 2yuq s ALA 37 CO 0.01 -1.94 1.10 -0.51 0.00 0.00 0.00 175.76 174.42 2yuq s LEU 38 N 2.55 2.31 0.03 0.00 1.43 -1.15 -4.80 118.68 119.05 2yuq s LEU 38 Ca 0.15 1.73 0.07 0.00 -1.03 0.00 0.00 54.13 55.05 2yuq s LEU 38 Cb -0.19 -4.10 -0.02 0.00 0.03 0.00 0.00 46.19 41.90 2yuq s LEU 38 CO 0.12 -2.91 -0.22 -0.60 0.23 0.00 0.00 176.35 172.98 2yuq s ARG 39 N -4.78 1.54 0.29 1.70 3.52 -1.26 -1.33 118.95 118.62 2yuq s ARG 39 Ca 0.65 -0.92 -0.30 0.00 -0.13 0.00 0.00 55.73 55.03 2yuq s ARG 39 Cb -0.20 -1.62 -0.11 0.00 -1.56 0.00 0.00 34.95 31.46 2yuq s ARG 39 CO 0.58 0.42 1.47 0.50 -0.81 0.00 0.00 175.30 177.47 2yuq s ARG 40 N -1.02 4.22 -1.25 5.12 3.52 -1.24 -2.93 118.95 125.38 2yuq s ARG 40 Ca 0.08 2.40 -0.01 0.00 -0.13 0.00 0.00 55.73 58.08 2yuq s ARG 40 Cb -0.09 -3.06 -0.00 0.00 -1.56 0.00 0.00 34.95 30.23 2yuq s ARG 40 CO 0.01 -0.46 0.84 0.09 -0.81 0.00 0.00 175.30 174.97 2yuq n ASN 41 N 1.88 -1.80 -3.75 -2.12 3.02 -1.09 -4.94 115.26 106.45 2yuq n ASN 41 Ca 0.06 -0.73 -0.18 0.00 -0.03 0.00 0.00 54.58 53.70 2yuq n ASN 41 Cb 0.40 -4.56 -0.17 0.00 -0.61 0.00 0.00 39.78 34.84 2yuq n ASN 41 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2yuq s GLU 42 N -5.65 0.10 0.52 3.52 0.41 -1.15 -5.01 118.70 111.44 2yuq s GLU 42 Ca 0.02 0.21 -0.19 0.00 -0.41 0.00 0.00 54.97 54.61 2yuq s GLU 42 Cb -0.01 -0.45 -0.07 0.00 -1.78 0.00 0.00 34.13 31.83 2yuq s GLU 42 CO 0.77 -0.22 1.04 -1.21 -0.49 0.00 0.00 175.26 175.15 2yuq s GLU 43 N 1.45 3.68 -0.11 1.61 2.02 -1.26 -2.92 118.70 123.17 2yuq s GLU 43 Ca -0.04 1.27 -0.09 0.00 0.02 0.00 0.00 54.97 56.12 2yuq s GLU 43 Cb -0.13 -2.08 0.03 0.00 0.10 0.00 0.00 34.13 32.05 2yuq s GLU 43 CO -0.03 -0.52 0.29 0.71 0.02 0.00 0.00 175.26 175.73 2yuq s TYR 44 N -2.19 -0.34 0.11 1.61 1.51 0.15 -4.68 117.35 113.53 2yuq s TYR 44 Ca 0.65 0.81 -0.25 0.00 -1.01 0.00 0.00 57.07 57.27 2yuq s TYR 44 Cb -0.15 0.11 -0.07 0.00 -0.11 0.00 0.00 41.96 41.74 2yuq s TYR 44 CO 0.26 -0.17 0.78 0.00 -1.11 0.00 0.00 175.55 175.30 2yuq s LEU 46 N -0.66 4.33 -0.00 0.00 2.96 -1.16 -1.44 118.68 122.72 2yuq s LEU 46 Ca 0.37 -0.86 -0.07 0.00 -0.22 0.00 0.00 54.13 53.36 2yuq s LEU 46 Cb -0.22 -2.50 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 2yuq s LEU 46 CO 0.25 -1.39 0.67 -0.07 -1.32 0.00 0.00 176.35 174.49 2yuq h LEU 47 N 11.24 -0.20 -7.75 -0.68 3.38 -0.64 -3.46 115.31 117.19 2yuq h LEU 47 Ca -0.28 0.01 -0.37 0.00 0.09 0.00 0.00 57.88 57.32 2yuq h LEU 47 Cb 1.07 0.05 -0.33 0.00 0.09 0.00 0.00 40.66 41.55 2yuq h LEU 47 CO 1.16 -0.08 -0.76 -0.62 0.09 0.00 0.00 178.44 178.23 2yuq s ASP 48 N -3.11 0.72 -0.36 -0.43 2.15 -0.91 -5.03 116.67 109.70 2yuq s ASP 48 Ca -0.03 -0.09 0.07 0.00 0.43 0.00 0.00 52.55 52.92 2yuq s ASP 48 Cb 0.00 -0.30 0.59 0.00 -0.30 0.00 0.00 42.92 42.91 2yuq s ASP 48 CO 0.10 -0.04 1.68 -1.54 -0.17 0.00 0.00 175.17 175.21 2yuq n SER 49 N 3.79 3.10 -0.34 -0.34 3.41 -1.26 -1.33 113.62 120.65 2yuq n SER 49 Ca -0.23 -3.69 -0.10 0.00 -0.26 0.00 0.00 58.87 54.59 2yuq n SER 49 Cb 0.52 -0.73 -0.08 0.00 -0.26 0.00 0.00 64.21 63.66 2yuq n SER 49 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2yuq h SER 50 N 1.05 -1.97 -3.72 4.04 0.87 -1.96 -3.41 113.55 108.45 2yuq h SER 50 Ca 0.41 0.30 -0.40 0.00 -1.23 0.00 0.00 61.79 60.87 2yuq h SER 50 Cb 2.22 0.87 0.16 0.00 -0.44 0.00 0.00 62.40 65.22 2yuq h SER 50 CO 0.72 -0.28 0.39 -0.62 -0.53 0.00 0.00 176.83 176.50 2yuq n GLU 51 N -5.31 -1.19 -0.05 2.24 4.71 -1.25 -5.06 120.64 114.72 2yuq n GLU 51 Ca 0.02 -1.91 -0.11 0.00 -0.01 0.00 0.00 57.16 55.15 2yuq n GLU 51 Cb 0.30 -1.26 -0.04 0.00 -1.01 0.00 0.00 31.44 29.44 2yuq n GLU 51 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2yuq n ILE 52 N -3.69 1.01 0.07 -3.67 5.41 -1.26 -4.71 119.36 112.53 2yuq n ILE 52 Ca 0.15 -0.02 -0.08 0.00 1.00 0.00 0.00 62.75 63.81 2yuq n ILE 52 Cb 0.53 -1.80 0.04 0.00 -0.71 0.00 0.00 39.64 37.70 2yuq n ILE 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 2yuq h HIS 53 N -0.51 0.39 -3.33 1.39 3.86 -1.97 -3.43 115.15 111.55 2yuq h HIS 53 Ca -0.22 -0.18 -0.66 0.00 -1.16 0.00 0.00 60.37 58.15 2yuq h HIS 53 Cb 1.00 -0.06 -0.28 0.00 1.06 0.00 0.00 27.41 29.14 2yuq h HIS 53 CO -0.11 0.94 -0.75 -1.58 0.86 0.00 0.00 177.93 177.29 2yuq s TRP 54 N -3.48 2.91 0.02 2.45 0.52 -1.26 -1.93 118.94 118.16 2yuq s TRP 54 Ca -0.04 -0.94 0.08 0.00 0.02 0.00 0.00 56.10 55.22 2yuq s TRP 54 Cb 0.11 -2.02 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 2yuq s TRP 54 CO 0.82 -0.49 -0.22 -1.58 0.02 0.00 0.00 176.95 175.51 2yuq s TRP 55 N 1.16 2.44 -0.37 -1.98 0.52 -0.82 -3.94 118.94 115.96 2yuq s TRP 55 Ca 0.02 -0.34 -0.20 0.00 0.02 0.00 0.00 56.10 55.60 2yuq s TRP 55 Cb -0.14 -1.46 0.00 0.00 -1.15 0.00 0.00 33.47 30.72 2yuq s TRP 55 CO -0.02 0.14 0.61 0.50 0.02 0.00 0.00 176.95 178.20 2yuq s ARG 56 N -1.13 3.59 0.43 4.98 3.52 -0.44 -2.40 118.95 127.50 2yuq s ARG 56 Ca 0.12 -0.08 0.05 0.00 -0.13 0.00 0.00 55.73 55.70 2yuq s ARG 56 Cb -0.10 -3.83 -0.06 0.00 -1.56 0.00 0.00 34.95 29.40 2yuq s ARG 56 CO 0.02 -0.76 0.02 0.14 -0.81 0.00 0.00 175.30 173.91 2yuq s VAL 57 N 2.64 1.64 -0.07 7.11 -7.23 -1.19 0.11 120.40 123.42 2yuq s VAL 57 Ca 0.23 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.38 2yuq s VAL 57 Cb -0.15 -2.71 0.03 0.00 0.56 0.00 0.00 36.38 34.11 2yuq s VAL 57 CO 0.15 0.00 -0.01 -1.58 -0.31 0.00 0.00 175.10 173.35 2yuq s GLN 58 N -3.77 0.72 1.15 4.82 0.74 -0.52 -3.19 119.66 119.60 2yuq s GLN 58 Ca 0.26 0.06 -0.13 0.00 0.05 0.00 0.00 55.36 55.60 2yuq s GLN 58 Cb 0.07 -1.03 0.27 0.00 1.10 0.00 0.00 33.01 33.42 2yuq s GLN 58 CO 0.13 -0.29 1.04 0.34 -0.55 0.00 0.00 175.29 175.96 2yuq s ASP 59 N 1.89 1.20 0.18 6.67 2.15 0.47 -3.19 116.67 126.04 2yuq s ASP 59 Ca 0.04 1.38 -0.10 0.00 0.43 0.00 0.00 52.55 54.29 2yuq s ASP 59 Cb -0.12 -2.14 0.10 0.00 -0.30 0.00 0.00 42.92 40.45 2yuq s ASP 59 CO -0.05 -4.04 1.72 -0.09 -0.17 0.00 0.00 175.17 172.54 2yuq h ARG 60 N -2.52 1.00 -0.02 4.34 9.65 -1.89 -3.13 114.38 121.82 2yuq h ARG 60 Ca -0.61 -0.21 -0.01 0.00 -1.10 0.00 0.00 59.98 58.06 2yuq h ARG 60 Cb 1.34 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2yuq h ARG 60 CO 0.52 0.87 -0.01 -0.91 2.80 0.00 0.00 179.97 183.24 2yuq h ASN 61 N 0.94 0.04 0.00 -3.80 4.21 -2.00 -3.47 115.58 111.50 2yuq h ASN 61 Ca 0.21 -0.42 0.00 0.00 1.21 0.00 0.00 56.30 57.31 2yuq h ASN 61 Cb 0.27 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 2yuq h ASN 61 CO -0.01 0.45 0.00 0.61 -1.29 0.00 0.00 177.43 177.19 2yuq n GLY 62 N 0.03 0.00 3.39 2.83 0.00 -1.18 -5.14 105.19 105.12 2yuq n GLY 62 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 2yuq n GLY 62 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yuq s HIS 63 N 0.00 3.12 0.50 1.61 3.76 -1.26 -4.85 115.29 118.17 2yuq s HIS 63 Ca 0.00 -0.74 0.06 0.00 -0.15 0.00 0.00 55.06 54.24 2yuq s HIS 63 Cb 0.00 -2.26 0.02 0.00 1.11 0.00 0.00 32.58 31.45 2yuq s HIS 63 CO 0.00 -0.49 0.38 -1.21 -0.85 0.00 0.00 174.74 172.57 2yuq s GLU 64 N 1.55 2.31 0.00 1.40 8.01 -1.26 -0.40 118.70 130.32 2yuq s GLU 64 Ca 0.04 -1.88 0.00 0.00 0.01 0.00 0.00 54.97 53.14 2yuq s GLU 64 Cb -0.16 -2.16 0.00 0.00 -4.31 0.00 0.00 34.13 27.50 2yuq s GLU 64 CO 0.03 -0.47 0.00 0.41 0.01 0.00 0.00 175.26 175.24 2yuq n GLY 65 N -1.66 -1.15 3.74 -1.39 0.00 -1.19 -4.53 105.19 99.01 2yuq n GLY 65 Ca 0.00 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 2yuq n GLY 65 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yuq s TYR 66 N -2.16 3.51 0.05 1.61 2.02 -1.17 -3.14 117.35 118.07 2yuq s TYR 66 Ca 0.00 0.74 0.02 0.00 -0.37 0.00 0.00 57.07 57.46 2yuq s TYR 66 Cb 0.00 -2.40 -0.03 0.00 -0.40 0.00 0.00 41.96 39.13 2yuq s TYR 66 CO 0.00 0.27 -0.07 0.14 -1.57 0.00 0.00 175.55 174.32 2yuq s VAL 67 N 0.31 0.48 -0.48 0.71 -7.23 -1.01 -2.45 120.40 110.74 2yuq s VAL 67 Ca 0.21 -1.17 -0.27 0.00 -1.81 0.00 0.00 61.98 58.93 2yuq s VAL 67 Cb -0.14 -0.71 -0.02 0.00 0.56 0.00 0.00 36.38 36.08 2yuq s VAL 67 CO 0.07 -0.47 1.78 -2.16 -0.31 0.00 0.00 175.10 174.01 2yuq s PRO 68 N -1.89 3.02 0.56 4.82 0.04 -1.26 -1.94 135.00 138.34 2yuq s PRO 68 Ca -0.08 0.96 0.49 0.00 0.04 0.00 0.00 61.00 62.42 2yuq s PRO 68 Cb -0.08 -4.27 1.72 0.00 0.04 0.00 0.00 34.50 31.92 2yuq s PRO 68 CO -0.01 -2.25 1.59 0.66 0.04 0.00 0.00 177.00 177.04 2yuq h SER 69 N 13.62 0.01 -0.69 6.66 4.64 -1.65 0.40 113.55 136.53 2yuq h SER 69 Ca -0.29 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.18 2yuq h SER 69 Cb 1.16 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.14 2yuq h SER 69 CO 1.13 -0.01 0.10 -1.28 -0.87 0.00 0.00 176.83 175.90 2yuq h SER 70 N 0.00 -0.13 -0.41 4.97 0.87 -1.88 -0.44 113.55 116.53 2yuq h SER 70 Ca 0.91 0.15 -0.12 0.00 -1.23 0.00 0.00 61.79 61.51 2yuq h SER 70 Cb 3.65 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 65.83 2yuq h SER 70 CO -0.02 -0.08 -0.20 1.88 -0.53 0.00 0.00 176.83 177.88 2yuq h TYR 71 N 0.20 1.00 -3.94 2.24 -1.99 -0.56 -3.44 116.97 110.48 2yuq h TYR 71 Ca 0.38 -0.25 -0.52 0.00 2.00 0.00 0.00 58.73 60.35 2yuq h TYR 71 Cb 0.64 -0.23 0.06 0.00 2.00 0.00 0.00 36.73 39.20 2yuq h TYR 71 CO -0.31 1.02 0.55 -0.51 -0.00 0.00 0.00 178.16 178.91 2yuq s LEU 72 N -9.11 4.22 -0.05 3.88 1.43 -0.17 -0.53 118.68 118.35 2yuq s LEU 72 Ca -0.12 2.48 -0.03 0.00 -1.03 0.00 0.00 54.13 55.43 2yuq s LEU 72 Cb 0.11 -3.94 0.03 0.00 0.03 0.00 0.00 46.19 42.41 2yuq s LEU 72 CO 0.85 -0.72 0.12 0.68 0.23 0.00 0.00 176.35 177.50 2yuq s VAL 73 N -1.33 -0.03 -0.04 -1.59 -7.23 0.21 -4.84 120.40 105.55 2yuq s VAL 73 Ca 0.56 0.11 -0.30 0.00 -1.81 0.00 0.00 61.98 60.55 2yuq s VAL 73 Cb -0.34 -0.19 -0.06 0.00 0.56 0.00 0.00 36.38 36.34 2yuq s VAL 73 CO 0.43 0.05 1.78 -0.70 -0.31 0.00 0.00 175.10 176.35 2yuq s GLU 74 N 0.70 4.11 -0.06 4.82 2.12 -1.26 -0.04 118.70 129.09 2yuq s GLU 74 Ca -0.05 2.29 -0.29 0.00 0.36 0.00 0.00 54.97 57.28 2yuq s GLU 74 Cb -0.07 -4.06 -0.07 0.00 0.26 0.00 0.00 34.13 30.19 2yuq s GLU 74 CO -0.03 -0.95 1.92 0.21 -0.54 0.00 0.00 175.26 175.86 2yuq s LYS 75 N 4.30 3.90 0.42 4.30 2.20 -0.94 -4.93 119.74 128.99 2yuq s LYS 75 Ca 0.79 2.30 -0.25 0.00 -0.36 0.00 0.00 55.97 58.45 2yuq s LYS 75 Cb -0.36 -4.16 -0.08 0.00 -1.51 0.00 0.00 37.83 31.72 2yuq s LYS 75 CO 0.34 -1.21 1.25 0.45 -0.36 0.00 0.00 175.35 175.81 2yuq s SER 76 N 4.98 6.30 0.25 1.43 0.15 -1.26 -4.94 113.70 120.61 2yuq s SER 76 Ca 0.86 2.52 0.02 0.00 0.70 0.00 0.00 55.95 60.04 2yuq s SER 76 Cb -0.37 -2.63 0.29 0.00 -1.71 0.00 0.00 66.02 61.61 2yuq s SER 76 CO 0.37 -0.84 1.62 1.55 1.20 0.00 0.00 173.24 177.13 2yuq h PRO 77 N 2.53 0.42 -6.27 5.44 0.13 -2.03 -3.43 132.00 128.79 2yuq h PRO 77 Ca -0.49 -0.22 -0.57 0.00 -0.87 0.00 0.00 66.00 63.84 2yuq h PRO 77 Cb 1.25 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.29 2yuq h PRO 77 CO 0.62 0.78 -0.62 0.54 -0.23 0.00 0.00 178.00 179.09 2yuq s ASN 78 N -6.87 4.96 -0.91 1.44 4.22 -1.26 -4.65 114.94 111.86 2yuq s ASN 78 Ca -0.06 -0.38 -0.03 0.00 -2.14 0.00 0.00 52.86 50.25 2yuq s ASN 78 Cb 0.13 -1.11 0.00 0.00 1.28 0.00 0.00 41.25 41.55 2yuq s ASN 78 CO 0.80 0.05 0.78 -3.20 -2.04 0.00 0.00 177.10 173.49 2yuq n ASN 79 N -0.49 -3.29 -4.64 3.54 5.15 -1.26 -4.89 115.26 109.38 2yuq n ASN 79 Ca -0.08 -0.42 -0.46 0.00 -0.60 0.00 0.00 54.58 53.01 2yuq n ASN 79 Cb 0.56 -3.82 -0.04 0.00 -0.53 0.00 0.00 39.78 35.95 2yuq n ASN 79 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2yuq n LEU 80 N -3.46 3.53 -3.76 1.20 4.32 -1.26 -4.88 117.00 112.69 2yuq n LEU 80 Ca -0.12 0.78 -0.42 0.00 -0.02 0.00 0.00 56.01 56.23 2yuq n LEU 80 Cb 0.59 -1.44 0.02 0.00 -1.62 0.00 0.00 43.42 40.97 2yuq n LEU 80 CO 0.45 -0.13 1.41 -1.84 -1.22 0.00 0.00 177.39 176.06 2yuq n GLU 81 N 7.39 5.05 -0.46 3.23 0.00 -1.26 -4.68 120.64 129.91 2yuq n GLU 81 Ca 0.25 -4.54 0.07 0.00 0.00 0.00 0.00 57.16 52.94 2yuq n GLU 81 Cb 0.35 -2.50 0.28 0.00 0.00 0.00 0.00 31.44 29.56 2yuq n GLU 81 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 2yuq n THR 82 N 0.57 1.35 -1.67 3.84 -1.04 -1.26 -4.96 114.28 111.10 2yuq n THR 82 Ca 0.41 -0.89 -0.46 0.00 -2.04 0.00 0.00 64.05 61.07 2yuq n THR 82 Cb 0.29 0.06 -0.04 0.00 -1.82 0.00 0.00 70.33 68.82 2yuq n THR 82 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2yuq n TYR 83 N 0.86 2.32 -3.91 -1.42 4.02 -1.26 -4.97 117.16 112.79 2yuq n TYR 83 Ca 0.20 0.24 -0.30 0.00 -0.01 0.00 0.00 57.90 58.03 2yuq n TYR 83 Cb 0.70 -2.56 -0.16 0.00 -0.02 0.00 0.00 39.34 37.30 2yuq n TYR 83 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 2yuq s GLU 84 N 1.02 1.47 0.00 -0.72 -1.05 -1.26 -5.24 118.70 112.93 2yuq s GLU 84 Ca 0.79 -0.91 0.31 0.00 -0.15 0.00 0.00 54.97 55.00 2yuq s GLU 84 Cb -0.66 -2.52 1.70 0.00 -0.44 0.00 0.00 34.13 32.20 2yuq s GLU 84 CO 0.38 -0.61 2.11 -2.67 0.95 0.00 0.00 175.26 175.42