#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuq s SER 2 N 0.00 5.52 -1.09 1.61 0.15 -1.26 -5.02 113.70 113.61 2yuq s SER 2 Ca 0.00 -2.49 -0.16 0.00 0.70 0.00 0.00 55.95 54.00 2yuq s SER 2 Cb 0.00 -1.93 0.16 0.00 -1.71 0.00 0.00 66.02 62.54 2yuq s SER 2 CO 0.00 -0.49 1.30 -0.44 1.20 0.00 0.00 173.24 174.81 2yuq s SER 3 N 1.48 6.90 0.00 5.45 0.01 -1.26 -4.22 113.70 122.07 2yuq s SER 3 Ca 0.13 -2.63 0.00 0.00 1.31 0.00 0.00 55.95 54.76 2yuq s SER 3 Cb -0.21 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2yuq s SER 3 CO -0.04 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.36 2yuq n GLY 4 N 4.63 0.15 0.17 3.44 0.00 -1.26 -5.06 105.19 107.25 2yuq n GLY 4 Ca 0.31 -0.19 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 2yuq n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2yuq h SER 5 N 0.00 -0.37 -3.79 1.61 0.02 -2.03 -3.37 113.55 105.61 2yuq h SER 5 Ca 0.00 0.09 -0.67 0.00 -0.84 0.00 0.00 61.79 60.37 2yuq h SER 5 Cb 0.00 0.21 -0.36 0.00 0.14 0.00 0.00 62.40 62.39 2yuq h SER 5 CO 0.00 -0.14 -0.78 -0.44 -1.14 0.00 0.00 176.83 174.33 2yuq s SER 6 N -5.14 4.49 0.63 3.07 0.01 -1.26 -5.11 113.70 110.39 2yuq s SER 6 Ca -0.14 -1.31 -0.12 0.00 1.31 0.00 0.00 55.95 55.69 2yuq s SER 6 Cb 0.11 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.72 2yuq s SER 6 CO 0.69 -0.20 1.04 -0.83 0.41 0.00 0.00 173.24 174.35 2yuq s GLY 7 N 1.16 1.76 -0.17 3.44 0.00 -1.26 -5.02 107.32 107.23 2yuq s GLY 7 Ca -0.07 0.05 -0.21 0.00 0.00 0.00 0.00 44.72 44.48 2yuq s GLY 7 CO -0.04 0.33 0.38 -2.09 0.00 0.00 0.00 173.10 171.68 2yuq h GLU 8 N -0.23 0.00 -5.10 2.90 4.81 -1.99 -3.45 114.58 111.52 2yuq h GLU 8 Ca -0.45 0.00 -0.65 0.00 -0.13 0.00 0.00 59.36 58.13 2yuq h GLU 8 Cb 1.20 0.00 -0.26 0.00 0.63 0.00 0.00 28.75 30.32 2yuq h GLU 8 CO 0.60 0.81 -0.71 0.34 -0.73 0.00 0.00 179.01 179.32 2yuq s ASP 9 N -6.38 4.39 -0.10 1.04 2.15 -1.26 -4.97 116.67 111.53 2yuq s ASP 9 Ca -0.21 -0.32 -0.05 0.00 0.43 0.00 0.00 52.55 52.40 2yuq s ASP 9 Cb 0.01 -1.74 -0.04 0.00 -0.30 0.00 0.00 42.92 40.85 2yuq s ASP 9 CO 0.54 0.04 -0.13 -0.46 -0.17 0.00 0.00 175.17 174.99 2yuq n ASN 10 N 4.37 0.86 -3.61 -0.34 6.94 -1.26 -5.10 115.26 117.12 2yuq n ASN 10 Ca -0.18 0.12 -0.23 0.00 -0.02 0.00 0.00 54.58 54.27 2yuq n ASN 10 Cb 0.51 -0.29 -0.07 0.00 -2.36 0.00 0.00 39.78 37.57 2yuq n ASN 10 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2yuq n ARG 11 N -3.42 0.51 -2.79 -3.83 1.74 -1.26 -5.15 116.66 102.46 2yuq n ARG 11 Ca -0.20 -3.36 -0.35 0.00 -0.77 0.00 0.00 57.85 53.16 2yuq n ARG 11 Cb 0.65 2.16 -0.07 0.00 -1.02 0.00 0.00 32.46 34.18 2yuq n ARG 11 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2yuq s ARG 12 N -3.46 4.44 0.36 5.56 0.52 -1.26 -5.03 118.95 120.08 2yuq s ARG 12 Ca 0.27 1.25 -0.27 0.00 -0.52 0.00 0.00 55.73 56.46 2yuq s ARG 12 Cb 0.01 -2.55 -0.09 0.00 0.52 0.00 0.00 34.95 32.84 2yuq s ARG 12 CO 0.19 0.15 1.21 -1.25 0.02 0.00 0.00 175.30 175.62 2yuq s PRO 13 N -2.50 4.23 0.04 3.54 0.04 -1.26 -4.98 135.00 134.11 2yuq s PRO 13 Ca 0.55 1.96 -0.15 0.00 0.04 0.00 0.00 61.00 63.41 2yuq s PRO 13 Cb -0.15 -2.88 -0.06 0.00 0.04 0.00 0.00 34.50 31.45 2yuq s PRO 13 CO 0.20 -0.21 1.23 -0.07 0.04 0.00 0.00 177.00 178.19 2yuq h LEU 14 N 3.04 -0.65 -9.91 -3.56 3.38 -2.04 -3.43 115.31 102.14 2yuq h LEU 14 Ca -0.48 0.07 -0.37 0.00 0.09 0.00 0.00 57.88 57.18 2yuq h LEU 14 Cb 1.23 0.24 0.21 0.00 0.09 0.00 0.00 40.66 42.43 2yuq h LEU 14 CO 0.64 -0.24 -0.17 0.79 0.09 0.00 0.00 178.44 179.55 2yuq n TRP 15 N -3.69 -3.47 -4.33 1.13 7.02 -1.26 -5.06 117.44 107.77 2yuq n TRP 15 Ca -0.04 -0.71 -0.20 0.00 -1.02 0.00 0.00 57.50 55.53 2yuq n TRP 15 Cb 0.18 -1.38 -0.11 0.00 -2.42 0.00 0.00 31.31 27.58 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 -4.93 1.29 0.12 -0.99 0.41 -1.26 -5.06 118.70 108.28 2yuq s GLU 16 Ca 0.66 -1.48 -0.13 0.00 -0.41 0.00 0.00 54.97 53.61 2yuq s GLU 16 Cb -0.13 -1.22 -0.07 0.00 -1.78 0.00 0.00 34.13 30.93 2yuq s GLU 16 CO 0.57 0.23 1.45 -1.00 -0.49 0.00 0.00 175.26 176.01 2yuq h PRO 17 N 2.94 0.81 0.00 0.39 0.13 -1.97 -2.89 132.00 131.42 2yuq h PRO 17 Ca -0.40 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.30 2yuq h PRO 17 Cb 1.21 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2yuq h PRO 17 CO 0.56 1.06 0.00 -0.85 -0.23 0.00 0.00 178.00 178.54 2yuq n GLU 18 N -4.17 0.11 -3.51 0.86 0.00 -1.26 -4.79 120.64 107.88 2yuq n GLU 18 Ca -0.03 0.08 -0.30 0.00 0.00 0.00 0.00 57.16 56.90 2yuq n GLU 18 Cb 0.50 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 30.40 2yuq n GLU 18 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2yuq s GLU 19 N -2.87 3.66 -0.40 3.44 2.02 -1.09 -5.06 118.70 118.40 2yuq s GLU 19 Ca 0.15 0.01 -0.20 0.00 0.02 0.00 0.00 54.97 54.94 2yuq s GLU 19 Cb 0.16 -2.73 0.01 0.00 0.10 0.00 0.00 34.13 31.67 2yuq s GLU 19 CO 0.42 0.35 0.63 0.99 0.02 0.00 0.00 175.26 177.66 2yuq s THR 20 N -1.85 4.87 -0.15 3.63 2.01 -1.26 -4.79 115.64 118.10 2yuq s THR 20 Ca 0.43 0.32 -0.04 0.00 0.31 0.00 0.00 61.69 62.71 2yuq s THR 20 Cb -0.11 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 2yuq s THR 20 CO 0.26 -0.45 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.04 2yuq s VAL 21 N 2.74 4.17 0.43 3.82 1.01 -1.26 -2.61 120.40 128.70 2yuq s VAL 21 Ca 0.23 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.01 2yuq s VAL 21 Cb -0.14 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2yuq s VAL 21 CO 0.17 0.51 0.18 0.68 0.00 0.00 0.00 175.10 176.63 2yuq s VAL 22 N 0.11 2.13 0.04 2.92 -7.23 0.58 -3.00 120.40 115.94 2yuq s VAL 22 Ca 0.01 -1.72 0.03 0.00 -1.81 0.00 0.00 61.98 58.49 2yuq s VAL 22 Cb -0.13 -2.85 -0.02 0.00 0.56 0.00 0.00 36.38 33.93 2yuq s VAL 22 CO 0.02 0.00 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.09 2yuq s ILE 23 N -2.65 0.66 0.05 -0.62 1.01 -0.55 0.49 121.20 119.60 2yuq s ILE 23 Ca 0.37 -0.94 -0.18 0.00 0.00 0.00 0.00 60.65 59.90 2yuq s ILE 23 Cb 0.04 -0.67 -0.06 0.00 0.01 0.00 0.00 42.46 41.77 2yuq s ILE 23 CO 0.21 -0.22 0.52 0.00 0.00 0.00 0.00 174.94 175.45 2yuq s ALA 24 N -1.07 3.62 -0.06 9.38 0.00 -1.02 0.26 121.76 132.88 2yuq s ALA 24 Ca -0.05 -0.04 0.11 0.00 0.00 0.00 0.00 51.96 51.98 2yuq s ALA 24 Cb -0.08 -2.56 -0.23 0.00 0.00 0.00 0.00 23.12 20.24 2yuq s ALA 24 CO 0.01 0.42 0.61 1.28 0.00 0.00 0.00 175.76 178.08 2yuq n LEU 25 N 1.75 1.02 -4.15 0.00 4.77 -0.34 -2.83 117.00 117.22 2yuq n LEU 25 Ca -0.11 0.38 -0.16 0.00 -0.03 0.00 0.00 56.01 56.09 2yuq n LEU 25 Cb 0.51 0.06 -0.11 0.00 -2.33 0.00 0.00 43.42 41.54 2yuq n LEU 25 CO 0.40 0.44 -0.43 -0.31 -1.33 0.00 0.00 177.39 176.16 2yuq s TYR 26 N -2.59 1.03 -0.86 -1.77 1.51 -1.26 -4.76 117.35 108.65 2yuq s TYR 26 Ca -0.07 -0.53 -0.25 0.00 -1.01 0.00 0.00 57.07 55.21 2yuq s TYR 26 Cb 0.08 -0.58 -0.00 0.00 -0.11 0.00 0.00 41.96 41.35 2yuq s TYR 26 CO 0.82 0.00 1.68 0.16 -1.11 0.00 0.00 175.55 177.11 2yuq s ASP 27 N -1.93 5.72 0.58 2.29 -4.77 -1.26 -4.23 116.67 113.06 2yuq s ASP 27 Ca -0.02 -0.68 -0.15 0.00 -3.30 0.00 0.00 52.55 48.41 2yuq s ASP 27 Cb -0.08 -2.56 -0.05 0.00 -1.09 0.00 0.00 42.92 39.15 2yuq s ASP 27 CO 0.01 -2.18 1.02 -0.47 0.70 0.00 0.00 175.17 174.26 2yuq s TYR 28 N 7.73 3.30 -0.02 2.11 5.04 -1.19 -4.94 117.35 129.39 2yuq s TYR 28 Ca 0.57 1.45 -0.13 0.00 -2.44 0.00 0.00 57.07 56.52 2yuq s TYR 28 Cb -0.06 -2.85 0.02 0.00 0.35 0.00 0.00 41.96 39.41 2yuq s TYR 28 CO 0.03 -0.74 0.27 1.14 -1.34 0.00 0.00 175.55 174.91 2yuq s GLN 29 N -4.37 0.60 -0.30 4.97 -2.07 -1.26 -3.09 119.66 114.14 2yuq s GLN 29 Ca 0.60 -0.19 -0.15 0.00 -1.82 0.00 0.00 55.36 53.80 2yuq s GLN 29 Cb -0.12 0.27 0.17 0.00 -1.09 0.00 0.00 33.01 32.23 2yuq s GLN 29 CO 0.39 -0.16 1.04 -0.08 -1.32 0.00 0.00 175.29 175.16 2yuq s THR 30 N -1.22 -0.42 -0.15 3.63 -1.32 -1.26 -4.94 115.64 109.96 2yuq s THR 30 Ca -0.13 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.33 2yuq s THR 30 Cb -0.05 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.91 2yuq s THR 30 CO 0.03 0.00 2.62 0.59 -2.21 0.00 0.00 174.62 175.66 2yuq n ASN 31 N 4.96 5.76 -4.20 8.08 3.02 -1.26 -4.62 115.26 127.00 2yuq n ASN 31 Ca -0.08 -2.71 -0.24 0.00 -0.03 0.00 0.00 54.58 51.52 2yuq n ASN 31 Cb 0.53 -1.22 -0.14 0.00 -0.61 0.00 0.00 39.78 38.34 2yuq n ASN 31 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2yuq s ASP 32 N 1.32 2.13 0.11 6.41 1.11 -1.26 -5.05 116.67 121.43 2yuq s ASP 32 Ca 0.37 -0.45 -0.14 0.00 0.18 0.00 0.00 52.55 52.51 2yuq s ASP 32 Cb 0.21 -0.18 -0.08 0.00 1.07 0.00 0.00 42.92 43.94 2yuq s ASP 32 CO -0.04 0.14 1.43 1.55 1.18 0.00 0.00 175.17 179.43 2yuq h PRO 33 N 5.12 0.74 0.00 8.23 0.13 -1.98 -3.02 132.00 141.23 2yuq h PRO 33 Ca -0.40 -0.39 -0.02 0.00 -0.87 0.00 0.00 66.00 64.32 2yuq h PRO 33 Cb 1.16 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2yuq h PRO 33 CO 0.45 1.01 -0.12 -0.56 -0.23 0.00 0.00 178.00 178.55 2yuq h GLN 34 N 0.50 0.00 -6.26 0.86 3.07 -1.97 -3.44 115.11 107.88 2yuq h GLN 34 Ca 0.05 0.00 -0.47 0.00 0.09 0.00 0.00 58.65 58.32 2yuq h GLN 34 Cb 0.87 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.41 2yuq h GLN 34 CO 0.07 0.12 -0.33 -1.21 0.09 0.00 0.00 178.83 177.57 2yuq s GLU 35 N -4.30 2.60 0.07 0.06 2.02 -1.14 -1.67 118.70 116.33 2yuq s GLU 35 Ca -0.03 -1.47 0.04 0.00 0.02 0.00 0.00 54.97 53.52 2yuq s GLU 35 Cb 0.14 -2.48 -0.03 0.00 0.10 0.00 0.00 34.13 31.85 2yuq s GLU 35 CO 0.60 -0.25 -0.11 -1.17 0.02 0.00 0.00 175.26 174.34 2yuq s LEU 36 N -4.22 2.31 -0.51 1.80 2.96 -1.26 -4.62 118.68 115.15 2yuq s LEU 36 Ca 0.50 -0.66 -0.17 0.00 -0.22 0.00 0.00 54.13 53.58 2yuq s LEU 36 Cb -0.05 -0.35 0.08 0.00 0.50 0.00 0.00 46.19 46.37 2yuq s LEU 36 CO 0.29 -0.17 0.54 0.00 -1.32 0.00 0.00 176.35 175.69 2yuq s ALA 37 N -1.69 3.48 0.99 5.97 0.00 -1.26 -4.62 121.76 124.64 2yuq s ALA 37 Ca -0.02 -2.04 -0.12 0.00 0.00 0.00 0.00 51.96 49.78 2yuq s ALA 37 Cb -0.08 -3.26 0.18 0.00 0.00 0.00 0.00 23.12 19.96 2yuq s ALA 37 CO 0.01 -1.96 1.10 -0.51 0.00 0.00 0.00 175.76 174.40 2yuq s LEU 38 N 2.16 1.64 -0.02 0.00 1.43 -1.18 -4.91 118.68 117.79 2yuq s LEU 38 Ca 0.09 1.18 0.02 0.00 -1.03 0.00 0.00 54.13 54.39 2yuq s LEU 38 Cb -0.23 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.62 2yuq s LEU 38 CO 0.08 -3.09 -0.08 -0.60 0.23 0.00 0.00 176.35 172.90 2yuq s ARG 39 N -4.99 0.81 0.56 1.70 6.06 -1.26 -3.16 118.95 118.67 2yuq s ARG 39 Ca 0.65 -0.26 -0.21 0.00 -2.50 0.00 0.00 55.73 53.42 2yuq s ARG 39 Cb -0.18 -0.77 -0.04 0.00 0.06 0.00 0.00 34.95 34.01 2yuq s ARG 39 CO 0.57 0.10 1.29 0.50 -2.50 0.00 0.00 175.30 175.26 2yuq s ARG 40 N 0.18 3.10 -1.38 5.12 3.52 -1.26 -3.11 118.95 125.12 2yuq s ARG 40 Ca -0.02 2.07 -0.05 0.00 -0.13 0.00 0.00 55.73 57.60 2yuq s ARG 40 Cb -0.08 -2.15 0.00 0.00 -1.56 0.00 0.00 34.95 31.16 2yuq s ARG 40 CO 0.00 -1.17 0.41 0.27 -0.81 0.00 0.00 175.30 174.00 2yuq n ASN 41 N -1.19 -0.94 -3.86 -2.12 0.23 -1.13 -4.96 115.26 101.28 2yuq n ASN 41 Ca 0.11 -1.07 -0.12 0.00 -0.53 0.00 0.00 54.58 52.97 2yuq n ASN 41 Cb 0.47 -2.76 -0.12 0.00 -2.08 0.00 0.00 39.78 35.28 2yuq n ASN 41 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2yuq s GLU 42 N -6.68 0.19 0.53 -3.83 0.41 -1.18 -5.01 118.70 103.13 2yuq s GLU 42 Ca 0.09 -0.05 -0.09 0.00 -0.41 0.00 0.00 54.97 54.51 2yuq s GLU 42 Cb -0.04 0.08 -0.04 0.00 -1.78 0.00 0.00 34.13 32.35 2yuq s GLU 42 CO 0.91 -0.03 0.89 -1.21 -0.49 0.00 0.00 175.26 175.33 2yuq s GLU 43 N -0.37 3.62 -0.21 1.61 2.02 -1.26 -2.43 118.70 121.68 2yuq s GLU 43 Ca -0.04 0.50 -0.14 0.00 0.02 0.00 0.00 54.97 55.31 2yuq s GLU 43 Cb -0.03 -2.25 0.06 0.00 0.10 0.00 0.00 34.13 32.02 2yuq s GLU 43 CO 0.00 -0.33 0.53 0.71 0.02 0.00 0.00 175.26 176.19 2yuq s TYR 44 N -2.85 -0.75 -0.02 1.61 1.51 0.18 -4.76 117.35 112.27 2yuq s TYR 44 Ca 0.52 1.59 -0.28 0.00 -1.01 0.00 0.00 57.07 57.89 2yuq s TYR 44 Cb -0.11 0.37 -0.03 0.00 -0.11 0.00 0.00 41.96 42.08 2yuq s TYR 44 CO 0.46 -0.39 0.91 0.00 -1.11 0.00 0.00 175.55 175.42 2yuq s LEU 46 N 1.01 3.97 -0.10 0.00 2.96 -1.07 -0.43 118.68 125.02 2yuq s LEU 46 Ca 0.48 0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 55.17 2yuq s LEU 46 Cb -0.20 -3.37 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 2yuq s LEU 46 CO 0.25 -0.84 0.11 -0.07 -1.32 0.00 0.00 176.35 174.47 2yuq h LEU 47 N 10.02 -0.03 -7.15 -0.68 3.38 -0.57 -3.47 115.31 116.82 2yuq h LEU 47 Ca -0.22 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 2yuq h LEU 47 Cb 1.07 0.01 -0.19 0.00 0.09 0.00 0.00 40.66 41.63 2yuq h LEU 47 CO 0.99 0.51 0.06 -1.81 0.09 0.00 0.00 178.44 178.28 2yuq s ASP 48 N -5.57 -0.53 -0.62 -0.43 1.01 -0.72 -5.04 116.67 104.78 2yuq s ASP 48 Ca -0.02 0.56 0.01 0.00 0.71 0.00 0.00 52.55 53.81 2yuq s ASP 48 Cb -0.00 0.50 0.41 0.00 1.01 0.00 0.00 42.92 44.84 2yuq s ASP 48 CO 0.08 -0.55 1.70 -1.54 0.21 0.00 0.00 175.17 175.06 2yuq n SER 49 N 1.06 6.55 -0.26 0.27 3.41 -1.26 -0.85 113.62 122.54 2yuq n SER 49 Ca -0.20 -3.79 0.26 0.00 -0.26 0.00 0.00 58.87 54.89 2yuq n SER 49 Cb 0.57 -0.79 0.47 0.00 -0.26 0.00 0.00 64.21 64.20 2yuq n SER 49 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2yuq n SER 50 N -0.67 0.27 -4.45 4.04 2.88 -1.26 -4.45 113.62 109.98 2yuq n SER 50 Ca 0.52 1.31 -0.31 0.00 -1.33 0.00 0.00 58.87 59.07 2yuq n SER 50 Cb 0.57 -0.64 -0.07 0.00 -0.75 0.00 0.00 64.21 63.32 2yuq n SER 50 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2yuq n GLU 51 N -4.78 0.71 -0.09 -1.46 -0.58 -1.23 -5.10 120.64 108.11 2yuq n GLU 51 Ca 0.30 -3.66 -0.11 0.00 -0.42 0.00 0.00 57.16 53.28 2yuq n GLU 51 Cb 1.04 1.27 -0.04 0.00 -0.57 0.00 0.00 31.44 33.14 2yuq n GLU 51 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2yuq n ILE 52 N -1.17 1.47 -0.12 -3.67 5.41 -1.26 -4.55 119.36 115.46 2yuq n ILE 52 Ca -0.17 0.11 -0.11 0.00 1.00 0.00 0.00 62.75 63.58 2yuq n ILE 52 Cb 0.64 -2.28 -0.02 0.00 -0.71 0.00 0.00 39.64 37.26 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 -1.00 0.74 -3.57 1.39 3.86 -1.97 -3.42 115.15 111.19 2yuq h HIS 53 Ca -0.12 -0.15 -0.62 0.00 -1.16 0.00 0.00 60.37 58.33 2yuq h HIS 53 Cb 0.86 -0.18 -0.14 0.00 1.06 0.00 0.00 27.41 29.01 2yuq h HIS 53 CO -0.21 0.81 -0.42 -1.58 0.86 0.00 0.00 177.93 177.38 2yuq s TRP 54 N -4.84 3.33 -0.04 2.45 0.52 -1.26 -0.31 118.94 118.78 2yuq s TRP 54 Ca -0.13 0.33 0.06 0.00 0.02 0.00 0.00 56.10 56.38 2yuq s TRP 54 Cb 0.09 -2.35 -0.02 0.00 -1.15 0.00 0.00 33.47 30.05 2yuq s TRP 54 CO 0.79 0.03 -0.21 -1.58 0.02 0.00 0.00 176.95 176.01 2yuq s TRP 55 N 1.17 2.51 -0.45 -1.98 0.52 0.59 -3.51 118.94 117.79 2yuq s TRP 55 Ca 0.11 -0.38 -0.21 0.00 0.02 0.00 0.00 56.10 55.64 2yuq s TRP 55 Cb -0.14 -1.58 0.03 0.00 -1.15 0.00 0.00 33.47 30.63 2yuq s TRP 55 CO 0.06 0.02 0.66 0.50 0.02 0.00 0.00 176.95 178.20 2yuq s ARG 56 N -0.55 3.26 0.43 4.98 3.52 -0.03 -1.95 118.95 128.61 2yuq s ARG 56 Ca 0.08 -0.42 0.06 0.00 -0.13 0.00 0.00 55.73 55.32 2yuq s ARG 56 Cb -0.11 -3.97 -0.07 0.00 -1.56 0.00 0.00 34.95 29.24 2yuq s ARG 56 CO 0.01 -1.06 0.01 0.14 -0.81 0.00 0.00 175.30 173.59 2yuq s VAL 57 N 2.86 1.87 -0.12 7.11 -7.23 -1.22 0.18 120.40 123.85 2yuq s VAL 57 Ca 0.22 -1.99 -0.01 0.00 -1.81 0.00 0.00 61.98 58.40 2yuq s VAL 57 Cb -0.15 -2.86 0.03 0.00 0.56 0.00 0.00 36.38 33.96 2yuq s VAL 57 CO 0.18 0.00 -0.06 -1.58 -0.31 0.00 0.00 175.10 173.33 2yuq s GLN 58 N -3.74 1.39 1.21 4.82 0.74 0.43 -3.19 119.66 121.31 2yuq s GLN 58 Ca 0.31 -0.25 -0.16 0.00 0.05 0.00 0.00 55.36 55.31 2yuq s GLN 58 Cb 0.08 -1.57 0.29 0.00 1.10 0.00 0.00 33.01 32.91 2yuq s GLN 58 CO 0.16 -0.30 1.02 0.16 -0.55 0.00 0.00 175.29 175.78 2yuq s ASP 59 N 1.73 0.71 0.49 6.67 -4.77 -0.01 -3.07 116.67 118.43 2yuq s ASP 59 Ca 0.04 1.16 0.27 0.00 -3.30 0.00 0.00 52.55 50.72 2yuq s ASP 59 Cb -0.13 -1.77 1.23 0.00 -1.09 0.00 0.00 42.92 41.16 2yuq s ASP 59 CO -0.08 -4.31 1.96 0.08 0.70 0.00 0.00 175.17 173.52 2yuq h ARG 60 N -2.70 0.00 -0.09 2.11 0.11 -1.89 -2.75 114.38 109.18 2yuq h ARG 60 Ca -0.55 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.34 2yuq h ARG 60 Cb 1.33 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.41 2yuq h ARG 60 CO 0.45 0.16 -0.77 -0.91 0.10 0.00 0.00 179.97 179.01 2yuq h ASN 61 N 0.00 0.59 0.00 0.08 4.21 -2.01 -3.47 115.58 114.98 2yuq h ASN 61 Ca -0.00 -0.40 0.00 0.00 1.21 0.00 0.00 56.30 57.11 2yuq h ASN 61 Cb 0.53 -0.18 0.00 0.00 -1.12 0.00 0.00 38.32 37.55 2yuq h ASN 61 CO 0.02 1.16 0.00 0.61 -1.29 0.00 0.00 177.43 177.93 2yuq n GLY 62 N 0.63 0.96 3.88 2.83 0.00 -1.04 -5.14 105.19 107.32 2yuq n GLY 62 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.93 1.19 0.25 1.61 3.76 -1.26 -4.76 115.29 115.15 2yuq s HIS 63 Ca 0.00 0.27 -0.13 0.00 -0.15 0.00 0.00 55.06 55.05 2yuq s HIS 63 Cb 0.00 -4.11 0.05 0.00 1.11 0.00 0.00 32.58 29.63 2yuq s HIS 63 CO 0.00 -2.99 0.67 -0.85 -0.85 0.00 0.00 174.74 170.72 2yuq n GLU 64 N -4.00 0.74 0.00 1.40 -0.00 -1.26 -0.83 120.64 116.70 2yuq n GLU 64 Ca 0.16 -1.51 0.00 0.00 -0.00 0.00 0.00 57.16 55.81 2yuq n GLU 64 Cb 0.59 1.93 0.00 0.00 -0.00 0.00 0.00 31.44 33.96 2yuq n GLU 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2yuq n GLY 65 N -0.46 1.51 3.54 -1.84 0.00 -1.19 -4.37 105.19 102.38 2yuq n GLY 65 Ca -0.05 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.49 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 -2.00 2.83 0.21 1.61 2.02 -0.67 -3.43 117.35 117.91 2yuq s TYR 66 Ca 0.00 0.18 0.10 0.00 -0.37 0.00 0.00 57.07 56.98 2yuq s TYR 66 Cb 0.00 -4.07 -0.04 0.00 -0.40 0.00 0.00 41.96 37.45 2yuq s TYR 66 CO 0.00 -1.27 -0.10 0.14 -1.57 0.00 0.00 175.55 172.75 2yuq s VAL 67 N 3.95 3.08 -0.37 0.71 -7.23 -0.82 -4.29 120.40 115.42 2yuq s VAL 67 Ca 0.34 -1.82 -0.28 0.00 -1.81 0.00 0.00 61.98 58.41 2yuq s VAL 67 Cb -0.11 -2.56 -0.01 0.00 0.56 0.00 0.00 36.38 34.26 2yuq s VAL 67 CO 0.23 -0.19 1.71 -2.16 -0.31 0.00 0.00 175.10 174.38 2yuq s PRO 68 N -3.04 3.33 0.60 4.82 0.04 -1.26 -0.30 135.00 139.20 2yuq s PRO 68 Ca 0.26 1.24 0.28 0.00 0.04 0.00 0.00 61.00 62.81 2yuq s PRO 68 Cb -0.08 -4.17 1.06 0.00 0.04 0.00 0.00 34.50 31.35 2yuq s PRO 68 CO 0.15 -1.87 1.44 0.66 0.04 0.00 0.00 177.00 177.42 2yuq h SER 69 N 12.53 0.00 -0.75 6.66 4.64 -0.91 0.44 113.55 136.18 2yuq h SER 69 Ca -0.32 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.11 2yuq h SER 69 Cb 1.15 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.17 2yuq h SER 69 CO 1.06 0.00 0.38 0.28 -0.87 0.00 0.00 176.83 177.68 2yuq h SER 70 N 0.00 0.49 -0.22 4.97 0.02 -1.88 -2.17 113.55 114.76 2yuq h SER 70 Ca 0.44 0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 61.39 2yuq h SER 70 Cb 2.57 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 65.09 2yuq h SER 70 CO -0.00 0.27 -0.11 1.88 -1.14 0.00 0.00 176.83 177.73 2yuq h TYR 71 N 0.62 0.53 -3.75 3.45 -1.99 -0.46 -3.44 116.97 111.93 2yuq h TYR 71 Ca 0.37 -0.13 -0.51 0.00 2.00 0.00 0.00 58.73 60.46 2yuq h TYR 71 Cb 0.41 -0.12 0.03 0.00 2.00 0.00 0.00 36.73 39.05 2yuq h TYR 71 CO -0.10 0.74 0.52 -0.51 -0.00 0.00 0.00 178.16 178.81 2yuq s LEU 72 N -9.23 4.51 -0.03 3.88 1.43 -0.82 -1.19 118.68 117.22 2yuq s LEU 72 Ca -0.14 2.34 0.01 0.00 -1.03 0.00 0.00 54.13 55.32 2yuq s LEU 72 Cb 0.07 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.68 2yuq s LEU 72 CO 0.76 -0.27 -0.05 0.68 0.23 0.00 0.00 176.35 177.71 2yuq s VAL 73 N -0.90 0.51 -0.32 -1.59 -7.23 0.14 -4.86 120.40 106.15 2yuq s VAL 73 Ca 0.47 -0.14 -0.27 0.00 -1.81 0.00 0.00 61.98 60.22 2yuq s VAL 73 Cb -0.34 -0.52 -0.05 0.00 0.56 0.00 0.00 36.38 36.04 2yuq s VAL 73 CO 0.42 0.20 2.22 -0.70 -0.31 0.00 0.00 175.10 176.94 2yuq s GLU 74 N 0.69 2.85 -0.50 4.82 2.12 -1.26 -1.48 118.70 125.93 2yuq s GLU 74 Ca -0.09 1.76 -0.36 0.00 0.36 0.00 0.00 54.97 56.64 2yuq s GLU 74 Cb -0.12 -4.42 -0.15 0.00 0.26 0.00 0.00 34.13 29.71 2yuq s GLU 74 CO 0.00 -2.43 2.27 1.17 -0.54 0.00 0.00 175.26 175.73 2yuq n LYS 75 N 8.82 0.62 0.34 4.30 4.81 -1.16 -4.84 118.16 131.05 2yuq n LYS 75 Ca 0.31 0.14 -0.14 0.00 -0.87 0.00 0.00 58.31 57.75 2yuq n LYS 75 Cb 0.48 -2.14 -0.07 0.00 0.02 0.00 0.00 35.03 33.33 2yuq n LYS 75 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 2yuq h SER 76 N 12.01 -0.77 -2.89 3.14 0.02 -1.92 -3.43 113.55 119.71 2yuq h SER 76 Ca -0.19 0.03 -0.54 0.00 -0.84 0.00 0.00 61.79 60.25 2yuq h SER 76 Cb 1.34 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.09 2yuq h SER 76 CO 1.11 -0.40 0.84 -2.16 -1.14 0.00 0.00 176.83 175.08 2yuq s PRO 77 N -4.52 4.28 -0.03 3.45 0.04 -1.26 -5.02 135.00 131.93 2yuq s PRO 77 Ca -0.13 2.02 0.02 0.00 0.04 0.00 0.00 61.00 62.95 2yuq s PRO 77 Cb 0.01 -3.54 0.01 0.00 0.04 0.00 0.00 34.50 31.03 2yuq s PRO 77 CO 0.40 -0.58 -0.07 1.21 0.04 0.00 0.00 177.00 178.00 2yuq s ASN 78 N 1.86 1.04 -0.40 6.66 2.47 -1.26 -5.08 114.94 120.23 2yuq s ASN 78 Ca 0.65 -0.16 -0.38 0.00 0.42 0.00 0.00 52.86 53.39 2yuq s ASN 78 Cb -0.33 -0.39 -0.14 0.00 -1.45 0.00 0.00 41.25 38.94 2yuq s ASN 78 CO 0.28 0.01 2.15 -3.20 -3.72 0.00 0.00 177.10 172.62 2yuq n ASN 79 N 3.64 1.67 -4.56 -4.21 2.85 -1.26 -4.82 115.26 108.58 2yuq n ASN 79 Ca -0.21 0.53 -0.37 0.00 -0.11 0.00 0.00 54.58 54.42 2yuq n ASN 79 Cb 0.53 -1.13 -0.04 0.00 1.24 0.00 0.00 39.78 40.38 2yuq n ASN 79 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2yuq s LEU 80 N 6.69 3.31 -0.42 1.20 1.43 -1.26 -4.91 118.68 124.73 2yuq s LEU 80 Ca 1.13 -0.79 0.02 0.00 -1.03 0.00 0.00 54.13 53.45 2yuq s LEU 80 Cb -1.09 -2.56 0.12 0.00 0.03 0.00 0.00 46.19 42.70 2yuq s LEU 80 CO 0.56 -2.03 0.19 -0.70 0.23 0.00 0.00 176.35 174.60 2yuq s GLU 81 N 5.96 1.34 0.85 1.70 2.56 -1.26 -5.12 118.70 124.74 2yuq s GLU 81 Ca 0.53 -1.94 -0.11 0.00 0.00 0.00 0.00 54.97 53.45 2yuq s GLU 81 Cb -0.05 -2.58 0.10 0.00 2.00 0.00 0.00 34.13 33.60 2yuq s GLU 81 CO 0.02 -1.09 1.09 -0.08 -0.56 0.00 0.00 175.26 174.64 2yuq s THR 82 N 0.53 2.92 0.23 -1.70 -1.32 -1.26 -5.07 115.64 109.97 2yuq s THR 82 Ca 0.15 0.30 0.00 0.00 -1.21 0.00 0.00 61.69 60.94 2yuq s THR 82 Cb -0.23 -2.76 -0.04 0.00 -1.51 0.00 0.00 72.50 67.95 2yuq s THR 82 CO -0.05 -0.39 0.13 -0.31 -2.21 0.00 0.00 174.62 171.78 2yuq s TYR 83 N -2.91 1.35 -0.30 9.09 1.51 -1.26 -5.16 117.35 119.67 2yuq s TYR 83 Ca 0.63 -1.32 -0.09 0.00 -1.01 0.00 0.00 57.07 55.27 2yuq s TYR 83 Cb -0.18 -0.71 0.15 0.00 -0.11 0.00 0.00 41.96 41.12 2yuq s TYR 83 CO 0.57 -0.54 0.70 -2.00 -1.11 0.00 0.00 175.55 173.17 2yuq s GLU 84 N -4.06 0.52 0.00 -0.62 2.56 -1.26 -5.36 118.70 110.48 2yuq s GLU 84 Ca 0.38 1.22 0.00 0.00 0.00 0.00 0.00 54.97 56.58 2yuq s GLU 84 Cb 0.07 0.73 0.00 0.00 2.00 0.00 0.00 34.13 36.92 2yuq s GLU 84 CO 0.14 -0.28 0.10 1.87 -0.56 0.00 0.00 175.26 176.53