#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dai s SER 2 N 0.00 -0.42 -0.30 1.61 0.15 -1.26 -5.15 113.70 108.33 2dai s SER 2 Ca 0.00 0.12 -0.17 0.00 0.70 0.00 0.00 55.95 56.60 2dai s SER 2 Cb 0.00 0.41 0.17 0.00 -1.71 0.00 0.00 66.02 64.89 2dai s SER 2 CO 0.00 -0.62 1.21 -0.55 1.20 0.00 0.00 173.24 174.48 2dai s SER 3 N -2.18 -0.11 0.00 5.45 0.15 -1.26 -5.11 113.70 110.64 2dai s SER 3 Ca 0.02 0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2dai s SER 3 Cb -0.01 1.09 0.00 0.00 -1.71 0.00 0.00 66.02 65.39 2dai s SER 3 CO -0.06 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 174.97 2dai n GLY 4 N 5.42 -1.08 1.50 9.45 0.00 -1.26 -5.17 105.19 114.06 2dai n GLY 4 Ca -0.06 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2dai n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dai n SER 5 N -0.59 -8.10 -3.65 1.61 7.64 -1.26 -5.09 113.62 104.18 2dai n SER 5 Ca 0.00 1.14 -0.02 0.00 1.01 0.00 0.00 58.87 61.00 2dai n SER 5 Cb 0.00 -4.25 -0.06 0.00 -1.01 0.00 0.00 64.21 58.89 2dai n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dai s SER 6 N -2.80 -0.04 0.34 6.43 0.15 -1.26 -5.19 113.70 111.34 2dai s SER 6 Ca 0.00 0.06 -0.06 0.00 0.70 0.00 0.00 55.95 56.65 2dai s SER 6 Cb 0.00 0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.38 2dai s SER 6 CO 0.00 -0.02 0.54 -0.83 1.20 0.00 0.00 173.24 174.13 2dai s GLY 7 N -0.41 1.14 0.00 9.45 0.00 -1.26 -5.16 107.32 111.08 2dai s GLY 7 Ca 0.08 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.52 2dai s GLY 7 CO -0.13 -0.81 0.00 1.22 0.00 0.00 0.00 173.10 173.38 2dai n ASP 8 N -1.29 0.00 -3.15 1.64 8.00 -1.26 -5.14 116.55 115.35 2dai n ASP 8 Ca -0.01 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.54 2dai n ASP 8 Cb 0.61 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.71 2dai n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dai s ALA 9 N 0.00 -3.65 -0.04 2.24 0.00 -1.26 -5.15 121.76 113.90 2dai s ALA 9 Ca 0.00 1.35 -0.02 0.00 0.00 0.00 0.00 51.96 53.29 2dai s ALA 9 Cb 0.00 -2.70 0.03 0.00 0.00 0.00 0.00 23.12 20.45 2dai s ALA 9 CO 0.00 -1.89 0.07 0.08 0.00 0.00 0.00 175.76 174.01 2dai s VAL 10 N 2.94 -0.11 0.46 0.00 1.01 -1.26 -5.09 120.40 118.36 2dai s VAL 10 Ca 0.18 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.51 2dai s VAL 10 Cb -0.05 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2dai s VAL 10 CO -0.20 0.14 0.00 -0.62 0.00 0.00 0.00 175.10 174.42 2dai n GLU 11 N 4.91 -3.33 -3.65 2.72 1.02 -1.26 -5.07 120.64 115.99 2dai n GLU 11 Ca -0.12 2.57 -0.02 0.00 -0.02 0.00 0.00 57.16 59.57 2dai n GLU 11 Cb 0.50 -3.17 -0.07 0.00 -0.02 0.00 0.00 31.44 28.69 2dai n GLU 11 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2dai s LEU 12 N -4.66 -0.22 0.45 -4.62 2.96 -1.26 -5.17 118.68 106.16 2dai s LEU 12 Ca 0.00 0.38 -0.04 0.00 -0.22 0.00 0.00 54.13 54.25 2dai s LEU 12 Cb 0.00 1.36 -0.04 0.00 0.50 0.00 0.00 46.19 48.01 2dai s LEU 12 CO 0.00 -0.06 0.74 0.12 -1.32 0.00 0.00 176.35 175.83 2dai s PHE 13 N 0.73 3.55 -0.33 5.38 2.19 -1.26 -5.08 117.98 123.17 2dai s PHE 13 Ca -0.03 0.72 0.01 0.00 0.33 0.00 0.00 56.93 57.96 2dai s PHE 13 Cb -0.04 -2.22 0.14 0.00 -1.31 0.00 0.00 43.02 39.60 2dai s PHE 13 CO -0.12 -0.19 0.31 0.21 1.83 0.00 0.00 175.22 177.25 2dai s LYS 14 N -4.65 0.47 0.52 10.12 2.20 -1.26 -5.14 119.74 122.01 2dai s LYS 14 Ca 0.46 -0.62 0.07 0.00 -0.36 0.00 0.00 55.97 55.51 2dai s LYS 14 Cb -0.10 -0.80 0.03 0.00 -1.51 0.00 0.00 37.83 35.45 2dai s LYS 14 CO 0.43 -1.12 0.47 0.15 -0.36 0.00 0.00 175.35 174.92 2dai s LYS 15 N 1.79 2.32 0.54 4.03 1.02 -1.26 -5.08 119.74 123.10 2dai s LYS 15 Ca 0.14 -1.85 -0.22 0.00 0.02 0.00 0.00 55.97 54.06 2dai s LYS 15 Cb -0.16 -2.26 -0.05 0.00 -0.52 0.00 0.00 37.83 34.84 2dai s LYS 15 CO -0.17 -0.57 1.33 0.00 -0.92 0.00 0.00 175.35 175.02 2dai n ALA 16 N -1.81 1.47 -0.08 5.17 0.00 -1.26 -4.96 120.51 119.05 2dai n ALA 16 Ca 0.03 0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.47 2dai n ALA 16 Cb 0.63 -2.33 -0.04 0.00 0.00 0.00 0.00 19.45 17.71 2dai n ALA 16 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2dai n ASN 17 N -0.85 1.69 -2.98 0.00 2.85 -1.26 -5.08 115.26 109.64 2dai n ASN 17 Ca 0.10 0.28 -0.10 0.00 -0.11 0.00 0.00 54.58 54.75 2dai n ASN 17 Cb 0.44 -0.65 0.01 0.00 1.24 0.00 0.00 39.78 40.82 2dai n ASN 17 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2dai n ALA 18 N -4.16 -2.89 -2.01 5.20 0.00 -1.26 -4.97 120.51 110.41 2dai n ALA 18 Ca -0.23 0.68 -0.04 0.00 0.00 0.00 0.00 53.44 53.86 2dai n ALA 18 Cb 0.55 -2.27 -0.04 0.00 0.00 0.00 0.00 19.45 17.69 2dai n ALA 18 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2dai n MET 19 N 0.23 0.00 -3.21 0.00 0.00 -1.26 -5.08 117.12 107.80 2dai n MET 19 Ca 0.03 -0.61 0.03 0.00 0.00 0.00 0.00 57.70 57.15 2dai n MET 19 Cb 0.37 0.26 -0.02 0.00 0.00 0.00 0.00 33.22 33.83 2dai n MET 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2dai s LEU 20 N 0.00 -1.34 -0.23 -0.89 1.02 -1.26 -5.09 118.68 110.88 2dai s LEU 20 Ca 0.01 0.94 0.01 0.00 0.02 0.00 0.00 54.13 55.11 2dai s LEU 20 Cb 0.01 2.16 0.06 0.00 0.02 0.00 0.00 46.19 48.44 2dai s LEU 20 CO -0.00 -0.26 -0.05 -1.81 0.02 0.00 0.00 176.35 174.25 2dai s ASP 21 N 2.86 3.85 0.48 2.29 1.11 -1.26 -5.06 116.67 120.94 2dai s ASP 21 Ca 0.18 -1.17 0.00 0.00 0.18 0.00 0.00 52.55 51.74 2dai s ASP 21 Cb -0.15 -1.18 0.00 0.00 1.07 0.00 0.00 42.92 42.66 2dai s ASP 21 CO -0.21 -0.23 0.00 1.21 1.18 0.00 0.00 175.17 177.12 2dai n GLU 22 N 4.67 -2.89 -1.46 8.23 2.13 -1.26 -4.75 120.64 125.32 2dai n GLU 22 Ca -0.12 2.24 -0.39 0.00 0.66 0.00 0.00 57.16 59.55 2dai n GLU 22 Cb 0.44 -3.48 0.03 0.00 0.27 0.00 0.00 31.44 28.70 2dai n GLU 22 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2dai n ASP 23 N -4.29 -1.06 -4.25 4.31 2.03 -1.26 -4.89 116.55 107.14 2dai n ASP 23 Ca -0.05 0.77 -0.32 0.00 0.52 0.00 0.00 54.79 55.71 2dai n ASP 23 Cb 0.65 -1.15 0.17 0.00 -0.72 0.00 0.00 41.12 40.07 2dai n ASP 23 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2dai n GLU 24 N 0.14 -1.65 -4.83 -0.67 0.28 -1.26 -5.01 120.64 107.63 2dai n GLU 24 Ca 0.11 -0.47 -0.26 0.00 -0.16 0.00 0.00 57.16 56.39 2dai n GLU 24 Cb 0.46 -1.68 -0.16 0.00 1.43 0.00 0.00 31.44 31.49 2dai n GLU 24 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2dai s ASP 25 N -1.83 2.12 0.49 -1.84 1.01 -1.26 -5.11 116.67 110.25 2dai s ASP 25 Ca 0.55 -0.34 -0.20 0.00 0.71 0.00 0.00 52.55 53.27 2dai s ASP 25 Cb -0.11 -0.52 -0.11 0.00 1.01 0.00 0.00 42.92 43.20 2dai s ASP 25 CO 0.65 0.16 0.53 -0.62 0.21 0.00 0.00 175.17 176.11 2dai n GLU 26 N 3.04 0.57 -1.41 8.23 -0.58 -1.26 -4.63 120.64 124.60 2dai n GLU 26 Ca -0.17 0.21 0.18 0.00 -0.42 0.00 0.00 57.16 56.96 2dai n GLU 26 Cb 0.53 -1.61 -0.08 0.00 -0.57 0.00 0.00 31.44 29.71 2dai n GLU 26 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2dai n ARG 27 N 0.31 -3.17 -0.92 3.49 0.63 -1.26 -4.81 116.66 110.93 2dai n ARG 27 Ca 0.11 2.50 -0.34 0.00 -0.92 0.00 0.00 57.85 59.20 2dai n ARG 27 Cb 0.44 -3.74 0.09 0.00 0.45 0.00 0.00 32.46 29.69 2dai n ARG 27 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2dai n VAL 28 N -4.28 0.22 -3.07 5.15 0.31 -1.26 -4.92 118.33 110.48 2dai n VAL 28 Ca -0.07 -0.31 -0.39 0.00 -0.01 0.00 0.00 64.34 63.56 2dai n VAL 28 Cb 0.67 -0.45 -0.06 0.00 -0.91 0.00 0.00 33.84 33.09 2dai n VAL 28 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2dai s ASP 29 N -1.64 7.27 -0.14 4.52 -1.08 -1.26 -4.98 116.67 119.36 2dai s ASP 29 Ca 0.53 1.51 -0.18 0.00 -0.52 0.00 0.00 52.55 53.89 2dai s ASP 29 Cb -0.23 -2.45 -0.24 0.00 -1.46 0.00 0.00 42.92 38.54 2dai s ASP 29 CO 0.71 0.21 0.46 1.05 0.52 0.00 0.00 175.17 178.11 2dai h GLU 30 N 4.51 0.14 -0.61 4.34 4.11 -1.96 -3.01 114.58 122.10 2dai h GLU 30 Ca -0.48 -0.24 0.12 0.00 0.07 0.00 0.00 59.36 58.83 2dai h GLU 30 Cb 1.21 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 30.43 2dai h GLU 30 CO 0.66 1.12 -0.25 0.00 0.07 0.00 0.00 179.01 180.60 2dai h ALA 31 N -0.17 0.19 0.60 1.06 0.00 -2.00 0.39 119.26 119.33 2dai h ALA 31 Ca -0.29 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2dai h ALA 31 Cb 1.55 0.64 0.01 0.00 0.00 0.00 0.00 17.79 19.99 2dai h ALA 31 CO -0.03 -0.55 -0.29 0.00 0.00 0.00 0.00 179.25 178.38 2dai h ALA 32 N 1.32 -0.80 -0.98 0.00 0.00 -1.94 -2.75 119.26 114.11 2dai h ALA 32 Ca 0.27 -0.20 0.25 0.00 0.00 0.00 0.00 54.91 55.24 2dai h ALA 32 Cb 0.52 0.31 -0.18 0.00 0.00 0.00 0.00 17.79 18.44 2dai h ALA 32 CO -0.67 -0.89 -0.02 1.25 0.00 0.00 0.00 179.25 178.92 2dai h LEU 33 N -0.93 -0.55 -0.61 0.00 5.85 -1.08 1.45 115.31 119.44 2dai h LEU 33 Ca -0.08 0.28 0.09 0.00 0.84 0.00 0.00 57.88 59.01 2dai h LEU 33 Cb 0.66 0.50 -0.07 0.00 0.37 0.00 0.00 40.66 42.12 2dai h LEU 33 CO 0.13 -0.34 0.23 -0.09 -0.34 0.00 0.00 178.44 178.03 2dai h ARG 34 N 0.01 0.40 0.16 1.25 9.65 0.00 0.81 114.38 126.66 2dai h ARG 34 Ca 0.57 -0.02 0.01 0.00 -1.10 0.00 0.00 59.98 59.44 2dai h ARG 34 Cb 1.12 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 29.57 2dai h ARG 34 CO -0.93 0.26 -0.50 1.96 2.80 0.00 0.00 179.97 183.56 2dai h GLN 35 N 0.41 -0.74 0.31 0.20 1.08 0.23 1.26 115.11 117.86 2dai h GLN 35 Ca 0.31 0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.55 2dai h GLN 35 Cb 0.38 0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.96 2dai h GLN 35 CO -0.31 -0.49 -0.37 -0.07 -0.95 0.00 0.00 178.83 176.64 2dai h LEU 36 N -0.76 -1.03 -1.88 1.46 3.38 -0.91 0.11 115.31 115.68 2dai h LEU 36 Ca -0.01 0.09 0.18 0.00 0.09 0.00 0.00 57.88 58.24 2dai h LEU 36 Cb 0.76 0.35 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 2dai h LEU 36 CO -0.26 -0.47 0.60 0.71 0.09 0.00 0.00 178.44 179.12 2dai h THR 37 N -0.69 0.37 0.00 0.22 1.35 -0.67 1.48 112.91 114.96 2dai h THR 37 Ca -0.04 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.72 2dai h THR 37 Cb 0.61 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 67.56 2dai h THR 37 CO -0.08 0.00 -0.48 -0.33 -0.25 0.00 0.00 175.52 174.39 2dai h GLU 38 N 0.00 0.00 0.00 4.72 5.08 0.36 -3.37 114.58 121.36 2dai h GLU 38 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2dai h GLU 38 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 2dai h GLU 38 CO -0.00 0.48 0.00 -1.33 -1.00 0.00 0.00 179.01 177.15 2dai n MET 39 N -3.35 0.00 0.00 2.33 2.81 0.50 -4.97 117.12 114.44 2dai n MET 39 Ca 0.01 0.49 0.00 0.00 -1.81 0.00 0.00 57.70 56.39 2dai n MET 39 Cb 0.65 -1.02 0.00 0.00 -0.71 0.00 0.00 33.22 32.15 2dai n MET 39 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dai n GLY 40 N 1.84 -0.55 3.07 3.03 0.00 -0.76 -5.11 105.19 106.71 2dai n GLY 40 Ca 0.00 0.24 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 2dai n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dai s PHE 41 N 0.00 0.16 0.82 1.61 0.08 -1.22 -5.02 117.98 114.40 2dai s PHE 41 Ca 0.00 -0.37 -0.12 0.00 0.12 0.00 0.00 56.93 56.57 2dai s PHE 41 Cb 0.00 -0.12 0.08 0.00 -0.57 0.00 0.00 43.02 42.41 2dai s PHE 41 CO 0.00 -0.28 1.10 -1.25 -0.10 0.00 0.00 175.22 174.69 2dai s PRO 42 N -1.78 1.92 0.01 0.24 0.04 -1.26 -3.87 135.00 130.29 2dai s PRO 42 Ca -0.12 0.58 -0.25 0.00 0.04 0.00 0.00 61.00 61.25 2dai s PRO 42 Cb -0.06 -1.90 -0.18 0.00 0.04 0.00 0.00 34.50 32.39 2dai s PRO 42 CO -0.01 -1.72 1.37 1.49 0.04 0.00 0.00 177.00 178.17 2dai h GLU 43 N -1.16 -0.11 -0.21 4.56 4.81 -1.97 -0.64 114.58 119.86 2dai h GLU 43 Ca -0.48 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.80 2dai h GLU 43 Cb 1.28 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.62 2dai h GLU 43 CO 0.60 0.22 -0.51 -0.97 -0.73 0.00 0.00 179.01 177.61 2dai h ASN 44 N -0.45 -1.66 0.00 1.04 -1.24 -1.97 1.42 115.58 112.72 2dai h ASN 44 Ca -0.01 0.20 0.00 0.00 0.71 0.00 0.00 56.30 57.20 2dai h ASN 44 Cb 0.38 0.66 0.00 0.00 0.73 0.00 0.00 38.32 40.09 2dai h ASN 44 CO 0.02 -0.43 0.00 0.54 -1.29 0.00 0.00 177.43 176.27 2dai n ARG 45 N -5.22 0.00 -0.34 6.67 1.74 -1.23 0.47 116.66 118.76 2dai n ARG 45 Ca -0.05 0.64 0.17 0.00 -0.77 0.00 0.00 57.85 57.84 2dai n ARG 45 Cb 0.34 -1.49 0.33 0.00 -1.02 0.00 0.00 32.46 30.62 2dai n ARG 45 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dai h ALA 46 N -1.71 1.31 0.64 7.54 0.00 -0.95 0.68 119.26 126.77 2dai h ALA 46 Ca 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 2dai h ALA 46 Cb 0.00 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2dai h ALA 46 CO 0.00 -0.62 -0.35 1.15 0.00 0.00 0.00 179.25 179.43 2dai h THR 47 N 0.02 0.00 -0.01 0.00 2.02 0.25 0.30 112.91 115.49 2dai h THR 47 Ca 0.63 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.83 2dai h THR 47 Cb 1.36 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 2dai h THR 47 CO -0.88 0.00 -0.51 0.50 0.37 0.00 0.00 175.52 175.00 2dai h LYS 48 N -0.92 -0.62 -0.52 6.66 3.64 0.28 0.18 116.57 125.27 2dai h LYS 48 Ca -0.09 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.40 2dai h LYS 48 Cb 0.72 0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 32.59 2dai h LYS 48 CO 0.11 -0.42 -0.52 0.00 -2.27 0.00 0.00 179.45 176.36 2dai h ALA 49 N -0.31 -0.61 -0.74 5.00 0.00 0.23 0.43 119.26 123.25 2dai h ALA 49 Ca 0.02 0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.15 2dai h ALA 49 Cb 0.71 1.09 -0.13 0.00 0.00 0.00 0.00 17.79 19.47 2dai h ALA 49 CO -0.35 -0.97 0.03 -0.07 0.00 0.00 0.00 179.25 177.89 2dai h LEU 50 N -0.31 -0.29 -2.12 0.00 3.38 0.34 1.83 115.31 118.14 2dai h LEU 50 Ca 0.12 0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 2dai h LEU 50 Cb 0.57 0.32 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 2dai h LEU 50 CO -0.66 -0.16 -0.02 1.56 0.09 0.00 0.00 178.44 179.25 2dai h GLN 51 N 0.12 0.00 -0.51 1.13 4.20 0.27 0.78 115.11 121.10 2dai h GLN 51 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 2dai h GLN 51 Cb 0.72 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.50 2dai h GLN 51 CO -0.63 0.02 0.00 1.28 -0.67 0.00 0.00 178.83 178.83 2dai n LEU 52 N -4.26 3.94 -2.11 1.46 4.77 0.50 -4.28 117.00 117.02 2dai n LEU 52 Ca -0.03 -2.32 -0.04 0.00 -0.03 0.00 0.00 56.01 53.59 2dai n LEU 52 Cb 0.11 -0.45 0.05 0.00 -2.33 0.00 0.00 43.42 40.80 2dai n LEU 52 CO 0.32 0.80 0.09 0.59 -1.33 0.00 0.00 177.39 177.85 2dai n ASN 53 N 0.77 2.19 -2.36 -1.43 3.02 0.50 -4.94 115.26 113.00 2dai n ASN 53 Ca 0.21 -2.60 -0.01 0.00 -0.03 0.00 0.00 54.58 52.15 2dai n ASN 53 Cb 0.70 -0.41 -0.00 0.00 -0.61 0.00 0.00 39.78 39.46 2dai n ASN 53 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2dai n HIS 54 N -0.43 -1.88 -2.97 3.10 8.25 -0.95 0.20 115.22 120.54 2dai n HIS 54 Ca 0.16 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.50 2dai n HIS 54 Cb 0.90 -1.10 0.06 0.00 1.12 0.00 0.00 29.99 30.98 2dai n HIS 54 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2dai n MET 55 N -2.38 -4.44 -3.81 -0.41 2.81 0.24 -5.01 117.12 104.12 2dai n MET 55 Ca -0.01 0.55 -0.37 0.00 -1.81 0.00 0.00 57.70 56.06 2dai n MET 55 Cb 0.46 -4.68 -0.06 0.00 -0.71 0.00 0.00 33.22 28.23 2dai n MET 55 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2dai s SER 56 N -3.77 6.41 -0.05 7.83 0.01 0.53 -4.98 113.70 119.67 2dai s SER 56 Ca 0.06 0.48 -0.24 0.00 1.31 0.00 0.00 55.95 57.56 2dai s SER 56 Cb -0.03 -2.10 -0.24 0.00 0.21 0.00 0.00 66.02 63.87 2dai s SER 56 CO 0.47 0.35 1.01 0.58 0.41 0.00 0.00 173.24 176.07 2dai h VAL 57 N 4.09 1.55 0.16 3.43 2.07 -1.92 -2.94 116.25 122.69 2dai h VAL 57 Ca -0.52 -1.98 -0.01 0.00 0.82 0.00 0.00 66.70 65.01 2dai h VAL 57 Cb 1.21 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.79 2dai h VAL 57 CO 0.62 0.54 -0.08 1.55 0.02 0.00 0.00 177.57 180.22 2dai h PRO 58 N -0.52 -0.21 -1.00 1.57 0.13 -1.97 -3.24 132.00 126.78 2dai h PRO 58 Ca -0.03 0.01 0.22 0.00 -0.87 0.00 0.00 66.00 65.33 2dai h PRO 58 Cb 1.03 0.05 -0.19 0.00 0.13 0.00 0.00 31.00 32.02 2dai h PRO 58 CO 0.05 -0.14 -0.17 1.96 -0.23 0.00 0.00 178.00 179.47 2dai h GLN 59 N -0.69 0.00 -0.76 0.86 1.08 -1.93 1.35 115.11 115.03 2dai h GLN 59 Ca -0.02 -0.00 0.17 0.00 -1.45 0.00 0.00 58.65 57.35 2dai h GLN 59 Cb 0.16 -0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.47 2dai h GLN 59 CO 0.04 0.00 0.09 0.00 -0.95 0.00 0.00 178.83 178.01 2dai h ALA 60 N 2.00 0.90 0.05 3.87 0.00 -1.63 0.02 119.26 124.47 2dai h ALA 60 Ca 0.51 0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.65 2dai h ALA 60 Cb 0.87 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2dai h ALA 60 CO -1.00 -0.40 -0.36 1.98 0.00 0.00 0.00 179.25 179.47 2dai h MET 61 N 0.17 -0.47 -0.80 0.00 -1.53 0.18 0.58 114.93 113.06 2dai h MET 61 Ca 0.43 0.03 0.17 0.00 -3.44 0.00 0.00 59.70 56.90 2dai h MET 61 Cb 0.77 0.11 -0.11 0.00 -0.55 0.00 0.00 31.60 31.81 2dai h MET 61 CO -0.61 -0.31 0.28 0.93 0.14 0.00 0.00 176.91 177.34 2dai h GLU 62 N -0.49 0.35 -0.59 0.39 4.39 -1.09 1.06 114.58 118.60 2dai h GLU 62 Ca -0.00 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2dai h GLU 62 Cb 0.50 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.04 2dai h GLU 62 CO -0.21 0.23 0.35 2.35 -1.16 0.00 0.00 179.01 180.57 2dai h TRP 63 N 0.36 0.78 0.00 4.33 7.01 -0.11 0.69 115.95 129.01 2dai h TRP 63 Ca 0.46 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 61.38 2dai h TRP 63 Cb 0.80 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.59 2dai h TRP 63 CO -0.20 0.53 -0.41 -0.07 -2.79 0.00 0.00 178.44 175.50 2dai h LEU 64 N 0.81 0.00 0.10 0.65 3.38 0.64 0.87 115.31 121.76 2dai h LEU 64 Ca 0.21 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.92 2dai h LEU 64 Cb -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2dai h LEU 64 CO -0.04 0.41 -1.21 0.40 0.09 0.00 0.00 178.44 178.09 2dai h ILE 65 N 0.00 1.52 0.08 1.22 2.04 0.27 -2.23 117.51 120.41 2dai h ILE 65 Ca -0.00 -3.13 -0.00 0.00 1.00 0.00 0.00 64.86 62.72 2dai h ILE 65 Cb 0.99 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 39.98 2dai h ILE 65 CO 0.05 0.91 -0.04 -0.33 0.00 0.00 0.00 178.15 178.74 2dai h GLU 66 N 0.06 -0.10 0.00 2.37 4.39 0.45 -3.27 114.58 118.47 2dai h GLU 66 Ca -0.11 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.59 2dai h GLU 66 Cb 1.93 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.60 2dai h GLU 66 CO 0.18 -0.07 0.12 0.45 -1.16 0.00 0.00 179.01 178.54 2dai h HIS 67 N -0.48 0.00 -0.43 4.33 3.86 -1.00 -0.26 115.15 121.17 2dai h HIS 67 Ca -0.01 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.32 2dai h HIS 67 Cb 0.08 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 2dai h HIS 67 CO 0.02 0.00 0.50 0.00 0.86 0.00 0.00 177.93 179.31 2dai h ALA 68 N 1.73 2.13 0.03 2.45 0.00 -1.45 0.62 119.26 124.77 2dai h ALA 68 Ca 0.00 -0.02 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 2dai h ALA 68 Cb 0.24 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2dai h ALA 68 CO 0.00 -0.72 -1.75 0.93 0.00 0.00 0.00 179.25 177.71 2dai h GLU 69 N 0.00 0.06 -6.68 0.00 5.08 -1.21 -3.47 114.58 108.37 2dai h GLU 69 Ca 0.20 -0.11 -0.53 0.00 -1.00 0.00 0.00 59.36 57.93 2dai h GLU 69 Cb 1.20 0.04 0.07 0.00 0.50 0.00 0.00 28.75 30.55 2dai h GLU 69 CO -0.00 0.67 0.96 -0.25 -1.00 0.00 0.00 179.01 179.39 2dai n ASP 70 N -3.15 3.90 0.00 1.42 8.00 0.22 -4.85 116.55 122.08 2dai n ASP 70 Ca -0.20 1.08 0.11 0.00 0.71 0.00 0.00 54.79 56.50 2dai n ASP 70 Cb 1.05 -1.57 0.63 0.00 -0.02 0.00 0.00 41.12 41.21 2dai n ASP 70 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2dai n PRO 71 N 3.47 0.50 -3.44 -0.24 -0.04 -1.26 -3.90 135.00 130.09 2dai n PRO 71 Ca 0.14 0.04 -0.26 0.00 -0.04 0.00 0.00 63.50 63.38 2dai n PRO 71 Cb 0.35 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.22 2dai n PRO 71 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2dai n THR 72 N -1.17 0.09 -0.10 0.52 -2.24 -1.26 -4.79 114.28 105.33 2dai n THR 72 Ca 0.14 -4.18 -0.18 0.00 -2.27 0.00 0.00 64.05 57.56 2dai n THR 72 Cb 0.14 -1.92 -0.08 0.00 -2.10 0.00 0.00 70.33 66.37 2dai n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dai n ILE 73 N 1.91 1.13 -0.03 2.28 3.06 -1.25 -4.78 119.36 121.69 2dai n ILE 73 Ca 0.25 -0.36 -0.00 0.00 -2.50 0.00 0.00 62.75 60.14 2dai n ILE 73 Cb 0.46 -1.47 -0.00 0.00 0.54 0.00 0.00 39.64 39.17 2dai n ILE 73 CO 0.00 0.00 0.00 -0.78 -2.50 0.00 0.00 176.55 173.27 2dai h ASP 74 N -0.35 0.00 -4.63 9.51 1.82 -1.91 -3.48 116.42 117.38 2dai h ASP 74 Ca -0.48 0.00 -0.17 0.00 -0.39 0.00 0.00 57.03 55.99 2dai h ASP 74 Cb 1.58 0.00 -0.22 0.00 0.68 0.00 0.00 39.33 41.36 2dai h ASP 74 CO -0.19 0.27 -0.57 -0.89 -1.61 0.00 0.00 179.24 176.26 2dai s THR 75 N -1.31 0.07 -0.48 2.25 2.01 -1.26 -5.04 115.64 111.88 2dai s THR 75 Ca -0.01 -0.54 -0.28 0.00 0.31 0.00 0.00 61.69 61.17 2dai s THR 75 Cb 0.00 -0.32 0.01 0.00 0.01 0.00 0.00 72.50 72.20 2dai s THR 75 CO 0.01 -0.30 1.45 -2.16 -0.69 0.00 0.00 174.62 172.93 2dai s PRO 76 N -0.98 3.41 -0.91 4.92 0.04 -1.26 -4.72 135.00 135.49 2dai s PRO 76 Ca -0.11 0.75 -0.24 0.00 0.04 0.00 0.00 61.00 61.44 2dai s PRO 76 Cb -0.06 -4.09 -0.04 0.00 0.04 0.00 0.00 34.50 30.35 2dai s PRO 76 CO 0.01 -1.78 1.89 -0.51 0.04 0.00 0.00 177.00 176.64 2dai s LEU 77 N 5.92 3.21 -0.34 -3.56 1.43 -1.26 -3.58 118.68 120.50 2dai s LEU 77 Ca 0.59 -0.74 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2dai s LEU 77 Cb -0.13 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.53 2dai s LEU 77 CO 0.29 -2.60 0.33 -0.24 0.23 0.00 0.00 176.35 174.36 2dai n SER 78 N 13.39 -4.79 -4.98 2.29 2.88 -1.26 -5.07 113.62 116.09 2dai n SER 78 Ca 0.39 -0.01 -0.23 0.00 -1.33 0.00 0.00 58.87 57.69 2dai n SER 78 Cb 0.47 -3.07 0.03 0.00 -0.75 0.00 0.00 64.21 60.90 2dai n SER 78 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dai s GLY 79 N -2.42 2.02 0.82 0.46 0.00 -1.23 -5.12 107.32 101.85 2dai s GLY 79 Ca 0.01 -1.74 -0.12 0.00 0.00 0.00 0.00 44.72 42.87 2dai s GLY 79 CO 0.36 -1.81 1.10 2.56 0.00 0.00 0.00 173.10 175.32 2dai s PRO 80 N -4.50 1.90 -0.21 2.90 0.04 -1.26 -5.03 135.00 128.84 2dai s PRO 80 Ca 0.49 0.57 -0.17 0.00 0.04 0.00 0.00 61.00 61.93 2dai s PRO 80 Cb -0.04 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 2dai s PRO 80 CO 0.31 -1.73 -0.35 0.43 0.04 0.00 0.00 177.00 175.70 2dai n SER 81 N -3.50 1.94 0.46 6.66 7.64 -1.26 -4.68 113.62 120.89 2dai n SER 81 Ca 0.07 0.34 -0.20 0.00 1.01 0.00 0.00 58.87 60.09 2dai n SER 81 Cb 0.57 -0.77 -0.10 0.00 -1.01 0.00 0.00 64.21 62.90 2dai n SER 81 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dai h SER 82 N -1.00 -1.25 0.00 6.43 0.87 -2.08 -3.57 113.55 112.95 2dai h SER 82 Ca -0.23 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 2dai h SER 82 Cb 1.19 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 2dai h SER 82 CO -0.14 -0.78 0.00 0.61 -0.53 0.00 0.00 176.83 175.99