#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyr s VAL 5 N 0.00 5.03 0.18 0.44 1.01 -1.26 -5.08 120.40 120.72 2dyr s VAL 5 Ca 0.00 -0.38 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 2dyr s VAL 5 Cb 0.00 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 32.19 2dyr s VAL 5 CO 0.00 -0.53 0.58 -0.69 0.00 0.00 0.00 175.10 174.46 2dyr s VAL 6 N 2.26 4.84 0.17 2.92 1.01 -1.26 -5.10 120.40 125.24 2dyr s VAL 6 Ca 0.13 0.79 0.10 0.00 0.00 0.00 0.00 61.98 63.00 2dyr s VAL 6 Cb -0.18 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 2dyr s VAL 6 CO 0.13 0.14 -0.18 -0.54 0.00 0.00 0.00 175.10 174.66 2dyr s LYS 7 N -2.22 1.77 0.16 2.72 1.02 -1.26 -5.07 119.74 116.85 2dyr s LYS 7 Ca 0.41 -1.34 -0.24 0.00 0.02 0.00 0.00 55.97 54.83 2dyr s LYS 7 Cb -0.14 -2.02 0.04 0.00 -0.52 0.00 0.00 37.83 35.18 2dyr s LYS 7 CO 0.20 0.43 1.61 0.77 -0.92 0.00 0.00 175.35 177.44 2dyr h SER 8 N 3.26 -1.01 0.00 2.83 0.02 -2.05 -2.53 113.55 114.07 2dyr h SER 8 Ca -0.48 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2dyr h SER 8 Cb 1.19 0.46 0.00 0.00 0.14 0.00 0.00 62.40 64.20 2dyr h SER 8 CO 0.49 -0.32 0.00 -1.84 -1.14 0.00 0.00 176.83 174.02 2dyr n GLU 9 N -5.41 0.60 -0.52 3.45 0.00 -1.26 -2.94 120.64 114.57 2dyr n GLU 9 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 57.16 57.26 2dyr n GLU 9 Cb 0.33 -1.09 0.33 0.00 0.00 0.00 0.00 31.44 31.01 2dyr n GLU 9 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2dyr n ASP 10 N -0.30 4.42 0.32 -1.84 9.92 -0.95 -4.50 116.55 123.61 2dyr n ASP 10 Ca 0.00 -2.32 0.21 0.00 -0.53 0.00 0.00 54.79 52.15 2dyr n ASP 10 Cb 0.04 -0.53 1.07 0.00 -0.64 0.00 0.00 41.12 41.06 2dyr n ASP 10 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 2dyr h TYR 11 N 3.95 0.00 -0.00 1.24 -0.00 -1.74 -2.03 116.97 118.38 2dyr h TYR 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2dyr h TYR 11 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.01 2dyr h TYR 11 CO 0.65 0.00 -0.34 0.00 -0.00 0.00 0.00 178.16 178.47 2dyr n ALA 12 N -2.09 3.22 -2.88 0.10 0.00 -1.26 -4.92 120.51 112.67 2dyr n ALA 12 Ca -0.02 -0.34 -0.31 0.00 0.00 0.00 0.00 53.44 52.77 2dyr n ALA 12 Cb 0.14 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.37 2dyr n ALA 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2dyr s LEU 13 N -2.77 4.21 0.32 0.00 1.43 -0.77 -5.06 118.68 116.04 2dyr s LEU 13 Ca 0.18 0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 53.18 2dyr s LEU 13 Cb 0.18 -2.83 -0.12 0.00 0.03 0.00 0.00 46.19 43.45 2dyr s LEU 13 CO 0.60 0.17 1.36 -2.65 0.23 0.00 0.00 176.35 176.06 2dyr n PRO 14 N 0.31 2.21 -4.57 1.29 -0.02 -1.26 -4.99 135.00 127.97 2dyr n PRO 14 Ca -0.06 0.78 -0.26 0.00 -2.02 0.00 0.00 63.50 61.94 2dyr n PRO 14 Cb 0.51 -2.40 -0.10 0.00 -0.02 0.00 0.00 33.50 31.48 2dyr n PRO 14 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2dyr s SER 15 N -0.11 3.33 0.02 2.55 1.04 -1.26 -4.86 113.70 114.41 2dyr s SER 15 Ca 0.58 -1.41 -0.12 0.00 0.48 0.00 0.00 55.95 55.49 2dyr s SER 15 Cb -0.57 -0.19 -0.06 0.00 0.10 0.00 0.00 66.02 65.31 2dyr s SER 15 CO 0.59 -0.55 0.38 -0.47 0.98 0.00 0.00 173.24 174.16 2dyr s TYR 16 N -2.95 3.65 -0.05 5.02 5.04 -1.26 -4.09 117.35 122.71 2dyr s TYR 16 Ca 0.33 0.86 -0.06 0.00 -2.44 0.00 0.00 57.07 55.76 2dyr s TYR 16 Cb 0.09 -2.20 0.01 0.00 0.35 0.00 0.00 41.96 40.21 2dyr s TYR 16 CO 0.16 0.60 0.16 0.14 -1.34 0.00 0.00 175.55 175.26 2dyr s VAL 17 N -1.22 0.01 -0.49 3.14 -7.23 -1.26 -5.07 120.40 108.28 2dyr s VAL 17 Ca 0.27 -0.05 -0.11 0.00 -1.81 0.00 0.00 61.98 60.28 2dyr s VAL 17 Cb -0.15 -0.24 0.12 0.00 0.56 0.00 0.00 36.38 36.67 2dyr s VAL 17 CO 0.15 -0.03 0.39 -1.81 -0.31 0.00 0.00 175.10 173.49 2dyr s ASP 18 N -0.02 5.86 -0.01 4.85 -0.00 -1.26 -4.61 116.67 121.47 2dyr s ASP 18 Ca -0.01 -1.86 0.00 0.00 -0.00 0.00 0.00 52.55 50.69 2dyr s ASP 18 Cb -0.02 -2.07 0.01 0.00 -0.00 0.00 0.00 42.92 40.84 2dyr s ASP 18 CO 0.00 -0.74 0.00 -0.60 -0.00 0.00 0.00 175.17 173.83 2dyr s ARG 19 N 1.44 0.06 0.27 8.23 3.52 -1.26 -5.05 118.95 126.15 2dyr s ARG 19 Ca 0.05 0.03 -0.02 0.00 -0.13 0.00 0.00 55.73 55.66 2dyr s ARG 19 Cb -0.27 -0.13 0.43 0.00 -1.56 0.00 0.00 34.95 33.41 2dyr s ARG 19 CO 0.01 -0.04 1.88 0.00 -0.81 0.00 0.00 175.30 176.34 2dyr h ARG 20 N 6.47 1.13 -0.33 5.12 3.08 -1.98 -2.46 114.38 125.41 2dyr h ARG 20 Ca -0.31 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2dyr h ARG 20 Cb 1.18 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.98 2dyr h ARG 20 CO 0.50 0.75 0.00 -0.40 -1.07 0.00 0.00 179.97 179.75 2dyr n ASP 21 N -4.51 2.18 -3.12 7.04 5.75 -1.26 -4.21 116.55 118.42 2dyr n ASP 21 Ca 0.16 -1.89 -0.18 0.00 -0.01 0.00 0.00 54.79 52.87 2dyr n ASP 21 Cb 0.20 -0.22 -0.03 0.00 -1.03 0.00 0.00 41.12 40.05 2dyr n ASP 21 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2dyr n TYR 22 N 0.67 -0.46 -0.18 2.11 9.36 -0.93 -5.00 117.16 122.72 2dyr n TYR 22 Ca 0.16 -3.47 0.16 0.00 3.32 0.00 0.00 57.90 58.06 2dyr n TYR 22 Cb 0.38 -0.10 0.50 0.00 -0.63 0.00 0.00 39.34 39.49 2dyr n TYR 22 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 2dyr h PRO 23 N 3.35 0.41 -3.61 2.98 0.13 -1.71 -3.36 132.00 130.19 2dyr h PRO 23 Ca 0.06 -0.02 -0.69 0.00 -0.87 0.00 0.00 66.00 64.47 2dyr h PRO 23 Cb 0.96 -0.09 -0.36 0.00 0.13 0.00 0.00 31.00 31.64 2dyr h PRO 23 CO 0.44 0.27 -0.40 -0.51 -0.23 0.00 0.00 178.00 177.58 2dyr s LEU 24 N -9.38 5.15 0.99 1.56 1.43 -1.26 -4.95 118.68 112.21 2dyr s LEU 24 Ca -0.08 -2.84 -0.12 0.00 -1.03 0.00 0.00 54.13 50.05 2dyr s LEU 24 Cb 0.21 -1.83 0.13 0.00 0.03 0.00 0.00 46.19 44.73 2dyr s LEU 24 CO 0.77 -0.36 0.75 -2.65 0.23 0.00 0.00 176.35 175.09 2dyr n PRO 25 N 3.49 -0.85 0.21 1.29 -0.02 -1.26 -4.93 135.00 132.92 2dyr n PRO 25 Ca 0.07 -0.20 0.05 0.00 -2.02 0.00 0.00 63.50 61.40 2dyr n PRO 25 Cb 0.37 -2.10 0.44 0.00 -0.02 0.00 0.00 33.50 32.20 2dyr n PRO 25 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2dyr h ASP 26 N -1.94 0.00 -3.97 2.55 3.32 -1.94 -3.45 116.42 111.00 2dyr h ASP 26 Ca -0.47 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.25 2dyr h ASP 26 Cb 1.29 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.70 2dyr h ASP 26 CO 0.40 0.30 -0.71 0.68 -1.72 0.00 0.00 179.24 178.19 2dyr s VAL 27 N -4.23 1.14 0.46 -1.35 -7.23 -1.26 -4.98 120.40 102.95 2dyr s VAL 27 Ca -0.03 -2.06 -0.19 0.00 -1.81 0.00 0.00 61.98 57.89 2dyr s VAL 27 Cb 0.14 -1.92 -0.10 0.00 0.56 0.00 0.00 36.38 35.07 2dyr s VAL 27 CO 0.69 -0.69 0.97 0.00 -0.31 0.00 0.00 175.10 175.76 2dyr s ALA 28 N -3.35 3.04 0.19 1.32 0.00 -1.26 -4.75 121.76 116.94 2dyr s ALA 28 Ca 0.18 0.34 -0.12 0.00 0.00 0.00 0.00 51.96 52.36 2dyr s ALA 28 Cb 0.03 -3.15 0.19 0.00 0.00 0.00 0.00 23.12 20.19 2dyr s ALA 28 CO 0.02 -0.03 1.75 1.25 0.00 0.00 0.00 175.76 178.75 2dyr h HIS 29 N 1.54 0.34 -3.15 0.00 2.76 -0.74 -3.40 115.15 112.50 2dyr h HIS 29 Ca -0.48 0.03 -0.67 0.00 -2.20 0.00 0.00 60.37 57.05 2dyr h HIS 29 Cb 1.18 -0.08 -0.33 0.00 1.55 0.00 0.00 27.41 29.73 2dyr h HIS 29 CO 0.62 0.11 -0.83 0.08 -1.30 0.00 0.00 177.93 176.62 2dyr s VAL 30 N -6.12 2.37 -0.18 5.26 1.01 0.12 -2.03 120.40 120.83 2dyr s VAL 30 Ca -0.13 -0.85 0.15 0.00 0.00 0.00 0.00 61.98 61.15 2dyr s VAL 30 Cb 0.15 -2.03 -0.24 0.00 0.00 0.00 0.00 36.38 34.26 2dyr s VAL 30 CO 0.73 0.50 0.13 2.29 0.00 0.00 0.00 175.10 178.75 2dyr n LYS 31 N 4.66 0.68 -3.33 2.72 2.85 -1.26 -4.83 118.16 119.64 2dyr n LYS 31 Ca -0.20 0.06 -0.39 0.00 -1.05 0.00 0.00 58.31 56.74 2dyr n LYS 31 Cb 0.50 -1.57 -0.07 0.00 -0.65 0.00 0.00 35.03 33.24 2dyr n LYS 31 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2dyr s ASN 32 N -5.75 6.49 -0.03 -5.58 0.02 -1.26 -5.06 114.94 103.77 2dyr s ASN 32 Ca -0.13 0.58 0.04 0.00 -1.02 0.00 0.00 52.86 52.34 2dyr s ASN 32 Cb 0.07 -2.26 -0.03 0.00 0.02 0.00 0.00 41.25 39.05 2dyr s ASN 32 CO 0.80 -0.11 -0.15 -0.76 0.02 0.00 0.00 177.10 176.90 2dyr s LEU 33 N 1.41 2.71 1.09 0.60 1.43 -1.26 -5.10 118.68 119.56 2dyr s LEU 33 Ca 0.21 -0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 52.89 2dyr s LEU 33 Cb -0.15 -1.56 0.25 0.00 0.03 0.00 0.00 46.19 44.76 2dyr s LEU 33 CO 0.09 0.32 1.19 -0.94 0.23 0.00 0.00 176.35 177.24 2dyr s SER 34 N -0.92 1.90 0.14 2.29 1.04 -1.26 -4.69 113.70 112.20 2dyr s SER 34 Ca 0.12 0.51 -0.18 0.00 0.48 0.00 0.00 55.95 56.88 2dyr s SER 34 Cb -0.11 -0.70 -0.02 0.00 0.10 0.00 0.00 66.02 65.30 2dyr s SER 34 CO 0.02 -3.51 1.77 0.00 0.98 0.00 0.00 173.24 172.50 2dyr h ALA 35 N -2.17 0.33 -0.55 5.32 0.00 -2.00 -0.09 119.26 120.11 2dyr h ALA 35 Ca -0.45 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 2dyr h ALA 35 Cb 1.27 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2dyr h ALA 35 CO 0.37 -0.25 0.18 0.66 0.00 0.00 0.00 179.25 180.21 2dyr h SER 36 N 0.29 0.79 -0.51 0.00 4.64 -1.99 -2.25 113.55 114.53 2dyr h SER 36 Ca 0.11 -0.20 -0.08 0.00 -0.47 0.00 0.00 61.79 61.15 2dyr h SER 36 Cb 0.03 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.89 2dyr h SER 36 CO -0.07 0.78 -0.01 1.56 -0.87 0.00 0.00 176.83 178.22 2dyr h GLN 37 N 0.76 0.90 -0.17 4.77 4.20 -1.83 -0.95 115.11 122.79 2dyr h GLN 37 Ca 0.18 -0.29 -0.07 0.00 0.06 0.00 0.00 58.65 58.52 2dyr h GLN 37 Cb 0.27 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2dyr h GLN 37 CO -0.01 0.93 -0.22 0.87 -0.67 0.00 0.00 178.83 179.74 2dyr h LYS 38 N 0.77 0.30 -0.63 1.46 1.57 -0.95 -1.45 116.57 117.64 2dyr h LYS 38 Ca 0.14 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2dyr h LYS 38 Cb 0.53 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 2dyr h LYS 38 CO 0.03 0.51 0.09 0.00 -0.57 0.00 0.00 179.45 179.51 2dyr h ALA 39 N 1.50 0.97 -0.54 3.86 0.00 -1.05 -2.20 119.26 121.79 2dyr h ALA 39 Ca 0.05 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 2dyr h ALA 39 Cb 0.55 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2dyr h ALA 39 CO 0.04 0.65 0.04 1.25 0.00 0.00 0.00 179.25 181.22 2dyr h LEU 40 N 0.97 0.91 -1.93 0.00 5.85 -0.58 -0.25 115.31 120.27 2dyr h LEU 40 Ca 0.19 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 2dyr h LEU 40 Cb 0.44 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 2dyr h LEU 40 CO 0.01 0.97 -0.12 0.11 -0.34 0.00 0.00 178.44 179.08 2dyr h LYS 41 N 0.81 0.00 0.07 1.25 1.79 -0.92 0.73 116.57 120.32 2dyr h LYS 41 Ca 0.16 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.36 2dyr h LYS 41 Cb 0.48 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 31.15 2dyr h LYS 41 CO 0.02 0.12 -1.10 0.93 -1.08 0.00 0.00 179.45 178.33 2dyr h GLU 42 N 0.00 0.62 -0.36 3.15 4.39 -0.81 -3.12 114.58 118.45 2dyr h GLU 42 Ca -0.00 -0.76 -0.03 0.00 0.34 0.00 0.00 59.36 58.91 2dyr h GLU 42 Cb 0.29 0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 29.17 2dyr h GLU 42 CO 0.02 1.34 0.10 -0.22 -1.16 0.00 0.00 179.01 179.08 2dyr h LYS 43 N 0.24 0.52 0.00 2.33 3.64 -0.18 -1.60 116.57 121.52 2dyr h LYS 43 Ca -0.16 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2dyr h LYS 43 Cb 1.78 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.51 2dyr h LYS 43 CO 0.21 0.47 0.00 1.49 -2.27 0.00 0.00 179.45 179.35 2dyr h GLU 44 N 0.51 0.00 0.00 1.90 4.81 -0.82 -1.22 114.58 119.76 2dyr h GLU 44 Ca 0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2dyr h GLU 44 Cb 0.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2dyr h GLU 44 CO -0.01 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.90 2dyr n LYS 45 N -2.81 0.19 -2.32 1.92 5.02 -0.60 -4.80 118.16 114.76 2dyr n LYS 45 Ca -0.02 0.19 -0.19 0.00 -2.02 0.00 0.00 58.31 56.28 2dyr n LYS 45 Cb 0.09 -1.74 0.09 0.00 -0.02 0.00 0.00 35.03 33.46 2dyr n LYS 45 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dyr n ALA 46 N -1.71 0.32 -1.69 7.82 0.00 -0.46 -5.02 120.51 119.76 2dyr n ALA 46 Ca 0.05 -1.66 -0.44 0.00 0.00 0.00 0.00 53.44 51.40 2dyr n ALA 46 Cb 0.38 0.31 -0.02 0.00 0.00 0.00 0.00 19.45 20.12 2dyr n ALA 46 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dyr n SER 47 N -2.83 3.06 0.25 0.00 2.88 -1.26 -4.87 113.62 110.84 2dyr n SER 47 Ca 0.14 1.15 0.16 0.00 -1.33 0.00 0.00 58.87 58.99 2dyr n SER 47 Cb 0.50 -1.48 0.65 0.00 -0.75 0.00 0.00 64.21 63.13 2dyr n SER 47 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 2dyr h TRP 48 N 4.15 0.00 0.00 0.66 6.55 -1.91 -2.79 115.95 122.62 2dyr h TRP 48 Ca -0.46 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.33 2dyr h TRP 48 Cb 1.26 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.55 2dyr h TRP 48 CO 0.56 0.00 -0.26 0.77 -1.05 0.00 0.00 178.44 178.46 2dyr h SER 49 N 0.00 0.00 0.57 -3.49 0.02 -2.00 -2.23 113.55 106.41 2dyr h SER 49 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dyr h SER 49 Cb 0.47 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.01 2dyr h SER 49 CO 0.00 0.26 -0.00 -1.20 -1.14 0.00 0.00 176.83 174.74 2dyr n SER 50 N -3.89 0.01 -4.75 3.07 7.64 -1.05 -4.80 113.62 109.85 2dyr n SER 50 Ca -0.02 -0.15 -0.40 0.00 1.01 0.00 0.00 58.87 59.31 2dyr n SER 50 Cb 0.34 -0.28 -0.05 0.00 -1.01 0.00 0.00 64.21 63.21 2dyr n SER 50 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dyr s LEU 51 N -2.57 4.48 0.60 -3.43 2.96 -0.84 -5.07 118.68 114.81 2dyr s LEU 51 Ca 0.29 1.54 -0.08 0.00 -0.22 0.00 0.00 54.13 55.66 2dyr s LEU 51 Cb 0.20 -3.30 -0.01 0.00 0.50 0.00 0.00 46.19 43.58 2dyr s LEU 51 CO 0.46 0.03 0.95 -0.94 -1.32 0.00 0.00 176.35 175.53 2dyr s SER 52 N -0.22 5.86 0.18 3.68 1.04 -1.26 -4.87 113.70 118.11 2dyr s SER 52 Ca 0.40 1.02 -0.13 0.00 0.48 0.00 0.00 55.95 57.71 2dyr s SER 52 Cb -0.21 -2.05 0.16 0.00 0.10 0.00 0.00 66.02 64.01 2dyr s SER 52 CO 0.25 -0.97 1.74 0.40 0.98 0.00 0.00 173.24 175.64 2dyr h ILE 53 N -0.22 0.81 0.00 -1.02 1.08 -1.98 0.77 117.51 116.96 2dyr h ILE 53 Ca -0.45 -0.11 -0.04 0.00 -0.39 0.00 0.00 64.86 63.87 2dyr h ILE 53 Cb 1.23 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.45 2dyr h ILE 53 CO 0.62 0.06 -0.18 0.44 -0.69 0.00 0.00 178.15 178.39 2dyr h ASP 54 N 0.31 0.00 0.00 1.72 3.45 -1.99 -0.29 116.42 119.62 2dyr h ASP 54 Ca 0.23 0.00 -0.21 0.00 0.43 0.00 0.00 57.03 57.48 2dyr h ASP 54 Cb 0.25 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.03 2dyr h ASP 54 CO -0.25 0.18 -0.78 -0.33 -1.57 0.00 0.00 179.24 176.49 2dyr h GLU 55 N 0.00 0.65 -0.51 3.56 5.08 -1.61 -1.70 114.58 120.06 2dyr h GLU 55 Ca -0.00 -0.55 -0.08 0.00 -1.00 0.00 0.00 59.36 57.73 2dyr h GLU 55 Cb 0.33 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2dyr h GLU 55 CO 0.02 1.16 -0.01 0.87 -1.00 0.00 0.00 179.01 180.06 2dyr h LYS 56 N 0.44 0.91 -0.04 2.33 1.57 0.17 -1.09 116.57 120.86 2dyr h LYS 56 Ca -0.05 -0.29 -0.12 0.00 -1.87 0.00 0.00 60.65 58.31 2dyr h LYS 56 Cb 1.39 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 2dyr h LYS 56 CO 0.15 0.94 -0.54 0.28 -0.57 0.00 0.00 179.45 179.71 2dyr h VAL 57 N 0.77 1.38 -0.39 0.50 2.07 -1.07 -1.53 116.25 117.98 2dyr h VAL 57 Ca 0.14 -1.84 -0.12 0.00 0.82 0.00 0.00 66.70 65.70 2dyr h VAL 57 Cb 0.54 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 2dyr h VAL 57 CO 0.03 0.53 -0.23 -0.08 0.02 0.00 0.00 177.57 177.84 2dyr h GLU 58 N 0.08 0.79 -0.52 1.57 4.81 -1.02 -0.25 114.58 120.05 2dyr h GLU 58 Ca -0.00 -0.33 -0.03 0.00 -0.13 0.00 0.00 59.36 58.87 2dyr h GLU 58 Cb 0.98 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 2dyr h GLU 58 CO 0.08 0.95 0.19 -0.07 -0.73 0.00 0.00 179.01 179.42 2dyr h LEU 59 N 0.69 0.73 -0.20 1.64 3.38 -0.89 -2.19 115.31 118.47 2dyr h LEU 59 Ca 0.09 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2dyr h LEU 59 Cb 0.75 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2dyr h LEU 59 CO 0.06 0.72 0.07 0.22 0.09 0.00 0.00 178.44 179.60 2dyr h TYR 60 N 0.70 0.31 0.00 1.13 3.20 -0.99 -2.80 116.97 118.52 2dyr h TYR 60 Ca 0.17 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2dyr h TYR 60 Cb 0.23 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.41 2dyr h TYR 60 CO 0.01 0.38 0.00 0.54 -1.64 0.00 0.00 178.16 177.45 2dyr n ARG 61 N -4.81 0.10 0.11 1.82 5.12 -0.13 -0.29 116.66 118.58 2dyr n ARG 61 Ca -0.04 0.34 -0.24 0.00 -1.93 0.00 0.00 57.85 55.99 2dyr n ARG 61 Cb 0.14 -1.69 -0.15 0.00 -1.16 0.00 0.00 32.46 29.59 2dyr n ARG 61 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2dyr h LEU 62 N 0.00 0.73 0.00 0.55 3.38 -1.15 -3.38 115.31 115.45 2dyr h LEU 62 Ca 0.00 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.02 2dyr h LEU 62 Cb 0.30 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2dyr h LEU 62 CO 0.00 1.65 -0.10 0.50 0.09 0.00 0.00 178.44 180.58 2dyr h LYS 63 N 0.01 0.06 -6.66 1.13 1.63 -1.13 0.41 116.57 112.03 2dyr h LYS 63 Ca -0.25 -0.07 -0.67 0.00 -0.85 0.00 0.00 60.65 58.82 2dyr h LYS 63 Cb 2.03 0.02 -0.18 0.00 -0.60 0.00 0.00 32.23 33.51 2dyr h LYS 63 CO 0.23 0.86 -0.79 -0.06 -3.45 0.00 0.00 179.45 176.25 2dyr s PHE 64 N -2.98 2.54 -0.03 1.91 0.40 0.60 -0.70 117.98 119.72 2dyr s PHE 64 Ca -0.17 -0.26 -0.00 0.00 -0.60 0.00 0.00 56.93 55.90 2dyr s PHE 64 Cb -0.01 -1.32 -0.00 0.00 0.51 0.00 0.00 43.02 42.20 2dyr s PHE 64 CO 0.71 0.42 0.01 -0.22 0.70 0.00 0.00 175.22 176.84 2dyr h LYS 65 N 3.54 -0.00 -6.53 0.44 3.64 -1.85 -3.38 116.57 112.42 2dyr h LYS 65 Ca -0.49 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 58.22 2dyr h LYS 65 Cb 1.18 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.82 2dyr h LYS 65 CO 0.48 -0.00 -0.75 -1.21 -2.27 0.00 0.00 179.45 175.69 2dyr s GLU 66 N -1.20 2.15 0.84 1.90 2.02 -1.26 -4.98 118.70 118.17 2dyr s GLU 66 Ca -0.00 -0.98 -0.12 0.00 0.02 0.00 0.00 54.97 53.89 2dyr s GLU 66 Cb 0.00 -2.30 0.12 0.00 0.10 0.00 0.00 34.13 32.05 2dyr s GLU 66 CO 0.00 0.53 1.20 -1.54 0.02 0.00 0.00 175.26 175.46 2dyr s SER 67 N -1.92 4.10 0.15 -0.19 1.04 -1.26 -4.79 113.70 110.83 2dyr s SER 67 Ca 0.19 0.53 -0.16 0.00 0.48 0.00 0.00 55.95 56.99 2dyr s SER 67 Cb -0.11 -0.90 0.03 0.00 0.10 0.00 0.00 66.02 65.14 2dyr s SER 67 CO 0.11 -2.13 1.80 -0.26 0.98 0.00 0.00 173.24 173.74 2dyr h PHE 68 N -1.16 0.46 -0.79 5.02 -1.00 -2.00 -0.51 116.94 116.95 2dyr h PHE 68 Ca -0.45 0.01 0.03 0.00 2.81 0.00 0.00 57.97 60.37 2dyr h PHE 68 Cb 1.30 -0.15 -0.05 0.00 3.61 0.00 0.00 35.95 40.66 2dyr h PHE 68 CO -0.17 0.27 0.51 0.00 -1.61 0.00 0.00 178.31 177.32 2dyr h ALA 69 N 1.17 1.03 -0.30 2.45 0.00 -1.96 -0.42 119.26 121.23 2dyr h ALA 69 Ca 0.15 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2dyr h ALA 69 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2dyr h ALA 69 CO -0.06 0.33 -0.15 0.93 0.00 0.00 0.00 179.25 180.31 2dyr h GLU 70 N 1.00 0.63 0.00 0.00 5.08 -1.83 -2.85 114.58 116.61 2dyr h GLU 70 Ca 0.31 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 2dyr h GLU 70 Cb -0.01 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2dyr h GLU 70 CO -0.10 0.86 -0.39 0.00 -1.00 0.00 0.00 179.01 178.38 2dyr h MET 71 N 0.39 0.00 -0.22 2.33 -0.00 -0.87 -2.99 114.93 113.57 2dyr h MET 71 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.77 2dyr h MET 71 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.27 2dyr h MET 71 CO 0.04 0.39 0.00 0.09 -0.00 0.00 0.00 176.91 177.43 2dyr n ASN 72 N -4.03 1.88 -4.76 -0.10 3.02 -0.19 -4.97 115.26 106.11 2dyr n ASN 72 Ca -0.02 -1.78 -0.38 0.00 -0.03 0.00 0.00 54.58 52.38 2dyr n ASN 72 Cb 0.42 -0.14 0.01 0.00 -0.61 0.00 0.00 39.78 39.47 2dyr n ASN 72 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dyr s ARG 73 N -1.72 3.49 0.59 3.52 1.70 -1.08 -5.03 118.95 120.41 2dyr s ARG 73 Ca 0.32 1.98 -0.04 0.00 -0.47 0.00 0.00 55.73 57.52 2dyr s ARG 73 Cb 0.17 -2.34 0.02 0.00 -0.57 0.00 0.00 34.95 32.23 2dyr s ARG 73 CO 0.25 -0.84 0.87 -1.54 -1.08 0.00 0.00 175.30 172.96 2dyr s SER 74 N -1.17 5.41 0.37 -2.89 1.04 -1.26 -5.11 113.70 110.08 2dyr s SER 74 Ca 0.67 0.47 0.04 0.00 0.48 0.00 0.00 55.95 57.61 2dyr s SER 74 Cb -0.34 -1.41 -0.03 0.00 0.10 0.00 0.00 66.02 64.34 2dyr s SER 74 CO 0.41 -1.13 0.16 0.42 0.98 0.00 0.00 173.24 174.07 2dyr s THR 75 N -2.94 0.45 -1.09 2.02 -4.23 -1.26 -5.04 115.64 103.55 2dyr s THR 75 Ca 0.55 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.23 2dyr s THR 75 Cb -0.10 -2.43 0.72 0.00 1.34 0.00 0.00 72.50 72.03 2dyr s THR 75 CO 0.43 0.00 1.63 0.59 -0.54 0.00 0.00 174.62 176.72 2dyr n ASN 76 N -1.23 4.78 -0.18 3.99 3.02 -1.26 -4.53 115.26 119.85 2dyr n ASN 76 Ca -0.02 -2.47 0.08 0.00 -0.03 0.00 0.00 54.58 52.14 2dyr n ASN 76 Cb 0.65 -0.59 0.38 0.00 -0.61 0.00 0.00 39.78 39.61 2dyr n ASN 76 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2dyr h GLU 77 N 4.04 0.67 -0.13 3.52 4.81 -2.01 -1.99 114.58 123.50 2dyr h GLU 77 Ca 0.00 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.23 2dyr h GLU 77 Cb 1.48 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2dyr h GLU 77 CO 0.25 0.45 0.10 0.11 -0.73 0.00 0.00 179.01 179.19 2dyr h TRP 78 N 0.69 0.00 -0.25 0.92 5.08 -2.00 -0.60 115.95 119.79 2dyr h TRP 78 Ca 0.33 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.25 2dyr h TRP 78 Cb 0.39 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.54 2dyr h TRP 78 CO -0.00 0.00 -0.06 0.87 -1.28 0.00 0.00 178.44 177.97 2dyr h LYS 79 N 0.00 0.49 -0.32 0.12 1.57 -1.72 -0.91 116.57 115.81 2dyr h LYS 79 Ca 0.06 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2dyr h LYS 79 Cb 0.27 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2dyr h LYS 79 CO -0.00 0.71 0.05 1.15 -0.57 0.00 0.00 179.45 180.79 2dyr h THR 80 N 0.24 1.24 0.42 -0.16 2.02 -1.30 -0.25 112.91 115.11 2dyr h THR 80 Ca 0.06 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 2dyr h THR 80 Cb 0.53 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2dyr h THR 80 CO 0.02 0.27 -0.20 0.58 0.37 0.00 0.00 175.52 176.57 2dyr h VAL 81 N 0.36 0.59 -0.64 3.16 2.07 -1.10 0.01 116.25 120.70 2dyr h VAL 81 Ca 0.10 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 2dyr h VAL 81 Cb 0.35 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 2dyr h VAL 81 CO 0.01 0.03 0.27 0.58 0.02 0.00 0.00 177.57 178.48 2dyr h VAL 82 N -0.65 1.23 -0.53 2.57 2.07 -1.21 -0.45 116.25 119.28 2dyr h VAL 82 Ca -0.06 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.70 2dyr h VAL 82 Cb 0.48 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2dyr h VAL 82 CO 0.09 0.28 0.08 1.23 0.02 0.00 0.00 177.57 179.28 2dyr h GLY 83 N 0.89 0.95 1.26 2.17 0.00 -0.99 -1.67 103.07 105.68 2dyr h GLY 83 Ca 0.21 -0.64 -0.14 0.00 0.00 0.00 0.00 47.33 46.77 2dyr h GLY 83 CO -0.02 0.59 -0.35 0.00 0.00 0.00 0.00 176.54 176.76 2dyr h ALA 84 N 0.98 0.71 -0.32 3.60 0.00 -0.83 -1.47 119.26 121.93 2dyr h ALA 84 Ca 0.16 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.66 2dyr h ALA 84 Cb 0.41 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2dyr h ALA 84 CO 0.01 0.66 0.17 0.00 0.00 0.00 0.00 179.25 180.09 2dyr h ALA 85 N 0.92 0.39 -0.32 0.00 0.00 -0.95 -1.21 119.26 118.10 2dyr h ALA 85 Ca 0.07 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2dyr h ALA 85 Cb 0.90 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2dyr h ALA 85 CO 0.08 -0.21 0.01 0.52 0.00 0.00 0.00 179.25 179.65 2dyr h MET 86 N 0.34 0.48 -0.55 0.00 2.07 -1.13 -0.99 114.93 115.15 2dyr h MET 86 Ca 0.13 -0.09 -0.06 0.00 -2.07 0.00 0.00 59.70 57.61 2dyr h MET 86 Cb 0.04 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 29.67 2dyr h MET 86 CO -0.09 0.50 0.11 0.35 1.07 0.00 0.00 176.91 178.86 2dyr h PHE 87 N 0.46 0.96 -0.10 -0.22 3.57 -0.42 -0.32 116.94 120.88 2dyr h PHE 87 Ca 0.10 -0.12 -0.14 0.00 3.53 0.00 0.00 57.97 61.34 2dyr h PHE 87 Cb 0.29 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 2dyr h PHE 87 CO 0.01 0.84 -0.55 0.74 -2.23 0.00 0.00 178.31 177.12 2dyr h PHE 88 N 0.80 0.36 -0.08 0.41 -1.00 -0.67 0.11 116.94 116.88 2dyr h PHE 88 Ca 0.17 -0.13 -0.12 0.00 2.81 0.00 0.00 57.97 60.70 2dyr h PHE 88 Cb 0.38 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.86 2dyr h PHE 88 CO 0.03 0.77 -0.51 0.82 -1.61 0.00 0.00 178.31 177.81 2dyr h ILE 89 N 0.23 1.35 -0.35 -0.55 2.04 -1.09 -1.29 117.51 117.86 2dyr h ILE 89 Ca 0.00 -1.77 -0.12 0.00 1.00 0.00 0.00 64.86 63.98 2dyr h ILE 89 Cb 1.03 1.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 2dyr h ILE 89 CO 0.09 0.52 -0.24 1.23 0.00 0.00 0.00 178.15 179.75 2dyr h GLY 90 N 1.39 0.84 1.51 5.37 0.00 -0.55 -2.59 103.07 109.04 2dyr h GLY 90 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 47.33 46.53 2dyr h GLY 90 CO 0.08 0.73 0.32 -2.75 0.00 0.00 0.00 176.54 174.92 2dyr h PHE 91 N 0.56 0.63 -1.00 5.60 3.57 -0.43 -1.96 116.94 123.91 2dyr h PHE 91 Ca 0.07 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.60 2dyr h PHE 91 Cb 0.80 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 39.28 2dyr h PHE 91 CO 0.06 0.41 0.66 1.15 -2.23 0.00 0.00 178.31 178.36 2dyr h THR 92 N 0.68 1.23 0.00 4.41 2.02 -0.85 -0.80 112.91 119.60 2dyr h THR 92 Ca 0.18 -0.46 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 2dyr h THR 92 Cb -0.06 -0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 66.14 2dyr h THR 92 CO -0.04 0.24 -0.01 0.00 0.37 0.00 0.00 175.52 176.08 2dyr h ALA 93 N 1.39 1.87 -0.47 6.16 0.00 -1.18 -0.04 119.26 126.99 2dyr h ALA 93 Ca 0.37 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 2dyr h ALA 93 Cb -0.11 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2dyr h ALA 93 CO -0.09 0.01 -0.17 -0.07 0.00 0.00 0.00 179.25 178.93 2dyr h LEU 94 N 0.00 0.91 -0.78 0.00 3.38 -1.08 -0.68 115.31 117.06 2dyr h LEU 94 Ca -0.00 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.57 2dyr h LEU 94 Cb 0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 2dyr h LEU 94 CO 0.00 1.07 0.05 -0.07 0.09 0.00 0.00 178.44 179.58 2dyr h LEU 95 N 0.80 0.93 -0.70 1.67 3.38 -0.88 -1.05 115.31 119.46 2dyr h LEU 95 Ca 0.12 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 2dyr h LEU 95 Cb 0.71 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2dyr h LEU 95 CO 0.05 0.97 -0.19 -0.07 0.09 0.00 0.00 178.44 179.29 2dyr h LEU 96 N 0.90 0.80 -0.32 1.67 3.38 -1.11 -0.86 115.31 119.77 2dyr h LEU 96 Ca 0.17 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2dyr h LEU 96 Cb 0.46 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2dyr h LEU 96 CO 0.02 0.98 0.09 0.40 0.09 0.00 0.00 178.44 180.02 2dyr h ILE 97 N 0.70 1.21 -0.87 1.22 2.04 -0.80 -1.23 117.51 119.78 2dyr h ILE 97 Ca 0.10 -0.70 0.02 0.00 1.00 0.00 0.00 64.86 65.28 2dyr h ILE 97 Cb 0.70 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 2dyr h ILE 97 CO 0.05 0.24 0.57 -0.25 0.00 0.00 0.00 178.15 178.76 2dyr h TRP 98 N 0.37 1.07 -0.09 1.37 7.01 -0.97 -1.70 115.95 123.01 2dyr h TRP 98 Ca 0.10 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 2dyr h TRP 98 Cb 0.27 -0.36 -0.00 0.00 -2.10 0.00 0.00 29.16 26.97 2dyr h TRP 98 CO 0.01 0.65 0.02 1.49 -2.79 0.00 0.00 178.44 177.82 2dyr h GLU 99 N 1.13 0.15 -0.67 2.65 4.81 -0.85 0.15 114.58 121.96 2dyr h GLU 99 Ca 0.33 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.54 2dyr h GLU 99 Cb -0.07 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 2dyr h GLU 99 CO -0.09 0.35 0.44 -0.22 -0.73 0.00 0.00 179.01 178.76 2dyr h LYS 100 N -0.07 0.82 0.00 1.92 1.63 -0.94 0.19 116.57 120.12 2dyr h LYS 100 Ca 0.03 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 2dyr h LYS 100 Cb 0.27 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 2dyr h LYS 100 CO 0.00 0.55 -0.07 1.25 -3.45 0.00 0.00 179.45 177.73 2dyr h HIS 101 N 0.85 0.07 0.00 1.91 2.76 -1.11 -3.34 115.15 116.28 2dyr h HIS 101 Ca 0.26 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 2dyr h HIS 101 Cb -0.01 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 28.94 2dyr h HIS 101 CO -0.00 0.84 -1.67 0.66 -1.30 0.00 0.00 177.93 176.46 2dyr n TYR 102 N -4.65 0.03 -0.09 5.26 4.01 0.02 -4.76 117.16 116.98 2dyr n TYR 102 Ca -0.10 0.01 -0.17 0.00 -0.16 0.00 0.00 57.90 57.48 2dyr n TYR 102 Cb 0.42 -0.38 -0.06 0.00 -0.31 0.00 0.00 39.34 39.02 2dyr n TYR 102 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2dyr n VAL 103 N -2.06 1.20 -2.41 -0.72 0.31 0.61 -5.00 118.33 110.27 2dyr n VAL 103 Ca -0.02 -0.14 -0.41 0.00 -0.01 0.00 0.00 64.34 63.76 2dyr n VAL 103 Cb 0.50 -1.88 -0.04 0.00 -0.91 0.00 0.00 33.84 31.52 2dyr n VAL 103 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2dyr s TYR 104 N -2.45 3.47 0.00 3.52 4.12 -0.85 -5.04 117.35 120.12 2dyr s TYR 104 Ca -0.26 1.50 0.00 0.00 0.02 0.00 0.00 57.07 58.32 2dyr s TYR 104 Cb 0.09 -3.39 0.00 0.00 -1.52 0.00 0.00 41.96 37.14 2dyr s TYR 104 CO 0.34 -1.01 0.00 0.41 0.02 0.00 0.00 175.55 175.31 2dyr n GLY 105 N 1.99 1.14 3.78 0.71 0.00 -1.26 -4.77 105.19 106.77 2dyr n GLY 105 Ca 0.03 -2.01 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 2dyr n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dyr s PRO 106 N -2.19 3.25 0.68 1.61 0.04 -1.26 -5.03 135.00 132.10 2dyr s PRO 106 Ca 0.00 1.42 -0.09 0.00 0.04 0.00 0.00 61.00 62.37 2dyr s PRO 106 Cb 0.00 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.56 2dyr s PRO 106 CO 0.00 -0.90 1.03 0.96 0.04 0.00 0.00 177.00 178.13 2dyr s ILE 107 N -2.12 3.15 0.61 0.56 -4.36 -1.26 -5.02 121.20 112.76 2dyr s ILE 107 Ca 0.68 0.14 -0.18 0.00 -0.26 0.00 0.00 60.65 61.03 2dyr s ILE 107 Cb -0.20 -3.33 -0.06 0.00 1.25 0.00 0.00 42.46 40.12 2dyr s ILE 107 CO 0.32 -0.39 0.79 -2.65 0.24 0.00 0.00 174.94 173.25 2dyr n PRO 108 N -2.90 0.69 0.18 0.37 -0.02 -1.26 -4.87 135.00 127.19 2dyr n PRO 108 Ca 0.06 0.27 0.13 0.00 -2.02 0.00 0.00 63.50 61.95 2dyr n PRO 108 Cb 0.58 -2.00 0.65 0.00 -0.02 0.00 0.00 33.50 32.72 2dyr n PRO 108 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 2dyr h HIS 109 N 0.27 0.00 0.00 6.00 2.07 -2.01 -2.69 115.15 118.79 2dyr h HIS 109 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2dyr h HIS 109 Cb 1.37 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.35 2dyr h HIS 109 CO 0.35 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.46 2dyr n THR 110 N -2.41 0.90 1.06 6.12 -2.24 -1.26 -2.00 114.28 114.44 2dyr n THR 110 Ca -0.00 0.22 0.12 0.00 -2.27 0.00 0.00 64.05 62.12 2dyr n THR 110 Cb 0.11 -1.03 0.13 0.00 -2.10 0.00 0.00 70.33 67.44 2dyr n THR 110 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2dyr n PHE 111 N -1.37 0.00 -1.80 4.78 3.01 -1.02 -4.23 117.46 116.84 2dyr n PHE 111 Ca 0.04 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.12 2dyr n PHE 111 Cb 0.11 -0.10 0.04 0.00 -0.01 0.00 0.00 39.48 39.52 2dyr n PHE 111 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2dyr s GLU 112 N -2.76 3.19 0.24 -1.08 2.02 -0.85 -4.76 118.70 114.70 2dyr s GLU 112 Ca 0.15 2.22 -0.06 0.00 0.02 0.00 0.00 54.97 57.31 2dyr s GLU 112 Cb 0.18 -2.28 0.42 0.00 0.10 0.00 0.00 34.13 32.54 2dyr s GLU 112 CO 0.67 -1.14 1.71 1.49 0.02 0.00 0.00 175.26 178.01 2dyr h GLU 113 N 1.53 0.35 -0.02 1.61 4.81 -1.92 -0.69 114.58 120.24 2dyr h GLU 113 Ca -0.51 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.70 2dyr h GLU 113 Cb 1.30 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 2dyr h GLU 113 CO 0.58 0.23 0.01 1.49 -0.73 0.00 0.00 179.01 180.58 2dyr h GLU 114 N 0.36 0.04 -0.45 1.92 4.81 -1.96 -1.62 114.58 117.67 2dyr h GLU 114 Ca 0.39 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.67 2dyr h GLU 114 Cb 0.61 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.93 2dyr h GLU 114 CO -0.43 0.22 0.15 2.35 -0.73 0.00 0.00 179.01 180.57 2dyr h TRP 115 N -0.15 0.26 -0.92 0.92 2.91 -1.77 -1.39 115.95 115.81 2dyr h TRP 115 Ca 0.01 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.05 2dyr h TRP 115 Cb 0.19 -0.05 -0.05 0.00 -0.51 0.00 0.00 29.16 28.75 2dyr h TRP 115 CO -0.01 0.09 0.58 0.28 -1.03 0.00 0.00 178.44 178.35 2dyr h VAL 116 N 0.32 1.25 -0.64 2.65 2.07 -1.03 0.21 116.25 121.07 2dyr h VAL 116 Ca 0.21 -0.49 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 2dyr h VAL 116 Cb 0.22 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 2dyr h VAL 116 CO -0.22 0.25 0.22 0.00 0.02 0.00 0.00 177.57 177.83 2dyr h ALA 117 N 1.38 0.83 0.03 1.67 0.00 -0.33 0.93 119.26 123.78 2dyr h ALA 117 Ca 0.33 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2dyr h ALA 117 Cb -0.10 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2dyr h ALA 117 CO -0.07 0.48 -0.01 0.87 0.00 0.00 0.00 179.25 180.52 2dyr h LYS 118 N 0.91 -0.04 -0.91 0.00 1.57 -0.74 -2.37 116.57 114.99 2dyr h LYS 118 Ca 0.21 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 59.11 2dyr h LYS 118 Cb 0.26 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.50 2dyr h LYS 118 CO -0.01 0.43 0.53 0.37 -0.57 0.00 0.00 179.45 180.21 2dyr h GLN 119 N -0.52 0.80 -0.46 3.15 4.15 -0.52 0.52 115.11 122.23 2dyr h GLN 119 Ca -0.00 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 2dyr h GLN 119 Cb 0.49 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.98 2dyr h GLN 119 CO 0.01 0.53 0.17 1.15 -1.93 0.00 0.00 178.83 178.76 2dyr h THR 120 N 0.83 1.21 -0.24 2.39 2.02 -0.79 0.07 112.91 118.40 2dyr h THR 120 Ca 0.46 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 2dyr h THR 120 Cb 0.51 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 2dyr h THR 120 CO -0.29 0.25 0.12 0.50 0.37 0.00 0.00 175.52 176.47 2dyr h LYS 121 N 0.60 0.34 -0.95 6.66 3.64 -0.64 -1.83 116.57 124.40 2dyr h LYS 121 Ca 0.15 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 2dyr h LYS 121 Cb 0.22 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.92 2dyr h LYS 121 CO -0.01 0.35 0.61 -0.09 -2.27 0.00 0.00 179.45 178.04 2dyr h ARG 122 N 0.26 1.10 -0.46 1.90 2.43 -0.72 0.26 114.38 119.15 2dyr h ARG 122 Ca 0.08 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 2dyr h ARG 122 Cb 0.12 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 2dyr h ARG 122 CO -0.01 0.73 0.03 0.52 -1.51 0.00 0.00 179.97 179.73 2dyr h MET 123 N 1.13 0.74 -0.07 0.20 2.86 -0.78 -0.26 114.93 118.75 2dyr h MET 123 Ca 0.40 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.72 2dyr h MET 123 Cb 0.10 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2dyr h MET 123 CO -0.15 0.73 -0.60 -0.07 1.06 0.00 0.00 176.91 177.88 2dyr h LEU 124 N 0.70 0.26 -0.51 1.22 3.38 -0.35 -0.46 115.31 119.54 2dyr h LEU 124 Ca 0.14 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2dyr h LEU 124 Cb 0.38 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2dyr h LEU 124 CO 0.01 0.80 -0.43 0.44 0.09 0.00 0.00 178.44 179.34 2dyr h ASP 125 N 0.17 0.78 -0.21 -0.43 3.45 0.22 -2.45 116.42 117.96 2dyr h ASP 125 Ca -0.01 -0.37 0.00 0.00 0.43 0.00 0.00 57.03 57.09 2dyr h ASP 125 Cb 1.09 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 39.64 2dyr h ASP 125 CO 0.09 1.11 0.00 1.15 -1.57 0.00 0.00 179.24 180.02 2dyr n MET 126 N -4.02 1.69 -3.69 3.56 0.00 -0.18 -4.95 117.12 109.53 2dyr n MET 126 Ca -0.02 -1.06 -0.22 0.00 0.00 0.00 0.00 57.70 56.40 2dyr n MET 126 Cb 0.55 -1.34 0.03 0.00 0.00 0.00 0.00 33.22 32.46 2dyr n MET 126 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2dyr n LYS 127 N 0.30 -4.30 -1.72 3.17 5.02 -0.74 -4.92 118.16 114.97 2dyr n LYS 127 Ca 0.14 0.61 -0.42 0.00 -2.02 0.00 0.00 58.31 56.62 2dyr n LYS 127 Cb 0.30 -5.07 -0.03 0.00 -0.02 0.00 0.00 35.03 30.20 2dyr n LYS 127 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2dyr s VAL 128 N -3.65 2.33 -1.03 -0.18 1.01 -0.26 -3.26 120.40 115.36 2dyr s VAL 128 Ca 0.07 0.03 -0.17 0.00 0.00 0.00 0.00 61.98 61.92 2dyr s VAL 128 Cb -0.02 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.35 2dyr s VAL 128 CO 0.82 0.00 0.71 0.00 0.00 0.00 0.00 175.10 176.63 2dyr n ALA 129 N 5.03 -2.63 0.26 5.51 0.00 -1.26 -1.24 120.51 126.18 2dyr n ALA 129 Ca 0.17 -0.30 0.15 0.00 0.00 0.00 0.00 53.44 53.46 2dyr n ALA 129 Cb 0.37 -2.62 0.45 0.00 0.00 0.00 0.00 19.45 17.66 2dyr n ALA 129 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2dyr h PRO 130 N -1.39 0.00 0.23 0.00 0.13 -1.90 -1.18 132.00 127.89 2dyr h PRO 130 Ca -0.59 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.19 2dyr h PRO 130 Cb 1.34 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.50 2dyr h PRO 130 CO 0.44 0.00 -1.59 0.82 -0.23 0.00 0.00 178.00 177.44 2dyr h ILE 131 N 0.00 1.15 0.00 -3.56 5.03 -1.91 -3.29 117.51 114.93 2dyr h ILE 131 Ca 0.00 -2.64 0.00 0.00 -0.12 0.00 0.00 64.86 62.10 2dyr h ILE 131 Cb 0.72 2.94 0.00 0.00 -3.03 0.00 0.00 36.82 37.45 2dyr h ILE 131 CO 0.00 0.83 0.00 0.00 -0.68 0.00 0.00 178.15 178.30 2dyr n GLN 132 N -3.67 0.00 -0.08 2.37 6.02 -1.25 -4.85 117.38 115.93 2dyr n GLN 132 Ca -0.20 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.70 2dyr n GLN 132 Cb 1.10 -0.19 -0.02 0.00 1.02 0.00 0.00 30.24 32.15 2dyr n GLN 132 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2dyr h GLY 133 N 0.00 0.39 0.00 1.08 0.00 -1.89 -3.43 103.07 99.22 2dyr h GLY 133 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.17 2dyr h GLY 133 CO 0.00 0.15 0.00 0.33 0.00 0.00 0.00 176.54 177.02 2dyr n PHE 134 N -4.87 -0.67 0.27 5.60 7.35 -0.48 -4.88 117.46 119.78 2dyr n PHE 134 Ca -0.02 0.12 0.13 0.00 -0.76 0.00 0.00 57.45 56.92 2dyr n PHE 134 Cb 0.04 0.53 0.79 0.00 0.35 0.00 0.00 39.48 41.19 2dyr n PHE 134 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 2dyr h SER 135 N 0.00 0.00 0.50 -2.13 0.02 -0.78 0.04 113.55 111.20 2dyr h SER 135 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dyr h SER 135 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2dyr h SER 135 CO 0.00 0.07 0.00 0.00 -1.14 0.00 0.00 176.83 175.76 2dyr h ALA 136 N 1.93 1.00 -0.20 3.77 0.00 -1.60 -1.88 119.26 122.28 2dyr h ALA 136 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dyr h ALA 136 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2dyr h ALA 136 CO 0.01 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.89 2dyr n LYS 137 N -3.00 1.90 -4.79 0.00 5.02 -0.00 -4.85 118.16 112.44 2dyr n LYS 137 Ca -0.01 -1.34 -0.33 0.00 -2.02 0.00 0.00 58.31 54.61 2dyr n LYS 137 Cb 0.18 -1.42 -0.13 0.00 -0.02 0.00 0.00 35.03 33.64 2dyr n LYS 137 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 2dyr s TRP 138 N -1.75 2.79 -0.53 2.13 -0.11 -0.71 -1.24 118.94 119.51 2dyr s TRP 138 Ca 0.34 -0.34 -0.21 0.00 1.22 0.00 0.00 56.10 57.11 2dyr s TRP 138 Cb 0.19 -1.74 0.05 0.00 -1.50 0.00 0.00 33.47 30.47 2dyr s TRP 138 CO 0.28 0.03 0.76 0.34 -4.62 0.00 0.00 176.95 173.74 2dyr s ASP 139 N -0.26 6.27 0.49 5.86 -1.08 0.10 -4.76 116.67 123.29 2dyr s ASP 139 Ca 0.02 -0.71 0.31 0.00 -0.52 0.00 0.00 52.55 51.65 2dyr s ASP 139 Cb -0.13 -2.35 1.20 0.00 -1.46 0.00 0.00 42.92 40.18 2dyr s ASP 139 CO 0.03 -1.04 1.90 1.88 0.52 0.00 0.00 175.17 178.46 2dyr h TYR 140 N 9.13 0.00 0.00 -5.34 0.05 -1.92 -0.30 116.97 118.60 2dyr h TYR 140 Ca -0.27 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.49 2dyr h TYR 140 Cb 1.09 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.82 2dyr h TYR 140 CO 0.82 0.00 -0.19 -0.44 -1.05 0.00 0.00 178.16 177.30 2dyr h ASP 141 N 0.00 0.00 0.28 3.88 3.45 -1.94 -3.34 116.42 118.75 2dyr h ASP 141 Ca 0.00 -0.38 0.00 0.00 0.43 0.00 0.00 57.03 57.08 2dyr h ASP 141 Cb 0.54 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.31 2dyr h ASP 141 CO 0.00 0.79 0.00 0.29 -1.57 0.00 0.00 179.24 178.75 2dyr n LYS 142 N -4.67 0.71 -3.68 3.56 5.02 -1.24 -4.94 118.16 112.92 2dyr n LYS 142 Ca -0.07 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.00 2dyr n LYS 142 Cb 0.26 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.80 2dyr n LYS 142 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2dyr n ASN 143 N -1.14 -1.66 -3.74 4.39 2.85 -0.15 -4.99 115.26 110.81 2dyr n ASN 143 Ca 0.19 -0.83 -0.07 0.00 -0.11 0.00 0.00 54.58 53.76 2dyr n ASN 143 Cb 0.17 -4.04 -0.01 0.00 1.24 0.00 0.00 39.78 37.14 2dyr n ASN 143 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 2dyr s GLU 144 N -5.92 1.78 0.19 1.20 -1.05 -1.04 -5.00 118.70 108.87 2dyr s GLU 144 Ca 0.06 -1.01 -0.30 0.00 -0.15 0.00 0.00 54.97 53.56 2dyr s GLU 144 Cb -0.02 0.59 -0.09 0.00 -0.44 0.00 0.00 34.13 34.18 2dyr s GLU 144 CO 0.81 -0.82 1.39 -1.58 0.95 0.00 0.00 175.26 176.01 2dyr s TRP 145 N -3.66 3.16 0.20 4.83 0.52 -1.26 0.02 118.94 122.76 2dyr s TRP 145 Ca 0.12 1.05 -0.32 0.00 0.02 0.00 0.00 56.10 56.96 2dyr s TRP 145 Cb -0.05 -3.72 -0.13 0.00 -1.15 0.00 0.00 33.47 28.42 2dyr s TRP 145 CO 0.07 -2.37 1.61 1.63 0.02 0.00 0.00 176.95 177.91 2dyr n LYS 146 N 2.94 2.41 0.00 4.98 5.02 -0.38 -4.74 118.16 128.40 2dyr n LYS 146 Ca 0.08 0.87 0.11 0.00 -2.02 0.00 0.00 58.31 57.35 2dyr n LYS 146 Cb 0.41 -2.65 0.66 0.00 -0.02 0.00 0.00 35.03 33.43 2dyr n LYS 146 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51