#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dai n SER 2 N 0.00 0.00 0.00 1.61 2.88 -1.26 -5.19 113.62 111.66 2dai n SER 2 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2dai n SER 2 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dai n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dai n SER 3 N 0.00 0.00 -3.39 -3.46 2.88 -1.26 -5.16 113.62 103.23 2dai n SER 3 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 2dai n SER 3 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 2dai n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dai s GLY 4 N 0.00 0.72 0.20 0.46 0.00 -1.26 -5.18 107.32 102.25 2dai s GLY 4 Ca 0.00 -0.98 0.04 0.00 0.00 0.00 0.00 44.72 43.79 2dai s GLY 4 CO 0.00 -0.58 -0.05 -0.45 0.00 0.00 0.00 173.10 172.01 2dai s SER 5 N -3.09 1.91 -0.29 1.64 0.15 -1.26 -5.15 113.70 107.61 2dai s SER 5 Ca 0.21 -1.12 -0.14 0.00 0.70 0.00 0.00 55.95 55.60 2dai s SER 5 Cb -0.03 -0.02 0.11 0.00 -1.71 0.00 0.00 66.02 64.37 2dai s SER 5 CO 0.13 -0.41 0.71 -0.94 1.20 0.00 0.00 173.24 173.94 2dai s SER 6 N -3.26 -0.96 0.00 5.45 1.04 -1.26 -5.15 113.70 109.56 2dai s SER 6 Ca 0.23 1.45 0.00 0.00 0.48 0.00 0.00 55.95 58.12 2dai s SER 6 Cb 0.04 1.68 0.00 0.00 0.10 0.00 0.00 66.02 67.84 2dai s SER 6 CO 0.06 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.67 2dai n GLY 7 N 4.66 2.87 3.15 7.32 0.00 -1.26 -5.11 105.19 116.82 2dai n GLY 7 Ca -0.17 -2.04 0.06 0.00 0.00 0.00 0.00 46.02 43.86 2dai n GLY 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dai s ASP 8 N 0.00 -0.30 -0.48 1.61 -1.08 -1.26 -5.11 116.67 110.05 2dai s ASP 8 Ca 0.00 0.14 0.03 0.00 -0.52 0.00 0.00 52.55 52.20 2dai s ASP 8 Cb 0.00 1.23 0.13 0.00 -1.46 0.00 0.00 42.92 42.82 2dai s ASP 8 CO 0.00 -0.05 0.23 0.00 0.52 0.00 0.00 175.17 175.87 2dai s ALA 9 N 2.97 2.96 -0.07 3.66 0.00 -1.26 -5.05 121.76 124.97 2dai s ALA 9 Ca 0.05 -3.02 -0.02 0.00 0.00 0.00 0.00 51.96 48.97 2dai s ALA 9 Cb -0.07 -2.07 0.03 0.00 0.00 0.00 0.00 23.12 21.02 2dai s ALA 9 CO -0.13 -2.00 0.03 0.54 0.00 0.00 0.00 175.76 174.21 2dai s VAL 10 N -0.00 0.13 -0.06 0.00 0.11 -1.26 -5.13 120.40 114.19 2dai s VAL 10 Ca 0.16 0.22 -0.21 0.00 -2.93 0.00 0.00 61.98 59.23 2dai s VAL 10 Cb -0.25 -0.38 -0.04 0.00 -1.53 0.00 0.00 36.38 34.18 2dai s VAL 10 CO -0.01 0.17 0.60 -1.61 -3.33 0.00 0.00 175.10 170.93 2dai s GLU 11 N 2.07 4.37 0.09 1.54 2.02 -1.26 -5.07 118.70 122.47 2dai s GLU 11 Ca 0.05 0.71 0.02 0.00 0.02 0.00 0.00 54.97 55.77 2dai s GLU 11 Cb -0.13 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.66 2dai s GLU 11 CO -0.05 0.19 0.16 -0.51 0.02 0.00 0.00 175.26 175.08 2dai s LEU 12 N 0.43 4.09 0.02 1.80 2.01 -1.26 -5.12 118.68 120.64 2dai s LEU 12 Ca 0.32 0.10 0.01 0.00 0.01 0.00 0.00 54.13 54.57 2dai s LEU 12 Cb -0.17 -2.71 -0.01 0.00 0.01 0.00 0.00 46.19 43.30 2dai s LEU 12 CO 0.16 0.14 -0.04 0.72 1.01 0.00 0.00 176.35 178.34 2dai s PHE 13 N -1.53 0.33 -0.03 0.29 -0.71 -1.26 -5.15 117.98 109.92 2dai s PHE 13 Ca 0.32 -0.36 0.00 0.00 -1.04 0.00 0.00 56.93 55.85 2dai s PHE 13 Cb -0.12 -0.22 0.03 0.00 -1.21 0.00 0.00 43.02 41.50 2dai s PHE 13 CO 0.25 -0.10 0.01 0.21 -1.34 0.00 0.00 175.22 174.25 2dai s LYS 14 N -1.03 0.26 0.00 1.99 2.20 -1.26 -5.07 119.74 116.83 2dai s LYS 14 Ca -0.09 0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.63 2dai s LYS 14 Cb -0.07 -0.49 0.00 0.00 -1.51 0.00 0.00 37.83 35.76 2dai s LYS 14 CO -0.00 -0.16 0.00 1.17 -0.36 0.00 0.00 175.35 176.00 2dai n LYS 15 N 4.27 0.00 -3.26 4.03 0.00 -1.26 -5.05 118.16 116.89 2dai n LYS 15 Ca -0.24 0.00 -0.11 0.00 0.00 0.00 0.00 58.31 57.96 2dai n LYS 15 Cb 0.50 -0.21 0.01 0.00 0.00 0.00 0.00 35.03 35.33 2dai n LYS 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dai n ALA 16 N -1.92 -2.14 0.07 3.14 0.00 -1.26 -4.92 120.51 113.48 2dai n ALA 16 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2dai n ALA 16 Cb 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 0.84 -0.58 -0.06 0.00 5.15 -1.26 -4.96 115.26 114.40 2dai n ASN 17 Ca -0.02 0.25 -0.08 0.00 -0.60 0.00 0.00 54.58 54.13 2dai n ASN 17 Cb 0.54 0.69 -0.07 0.00 -0.53 0.00 0.00 39.78 40.41 2dai n ASN 17 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dai n ALA 18 N -2.90 1.73 -1.77 5.20 0.00 -1.26 -5.01 120.51 116.51 2dai n ALA 18 Ca 0.00 -0.58 -0.38 0.00 0.00 0.00 0.00 53.44 52.48 2dai n ALA 18 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 19.45 19.59 2dai n ALA 18 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2dai s MET 19 N -2.25 3.88 0.00 0.00 -2.45 -1.26 -5.02 119.30 112.20 2dai s MET 19 Ca -0.13 1.83 0.00 0.00 -1.25 0.00 0.00 55.69 56.13 2dai s MET 19 Cb 0.04 -2.53 0.00 0.00 1.25 0.00 0.00 34.83 33.59 2dai s MET 19 CO 0.33 -0.46 0.00 1.28 1.05 0.00 0.00 175.02 177.22 2dai n LEU 20 N -0.23 0.00 0.00 4.11 4.32 -1.26 -4.83 117.00 119.11 2dai n LEU 20 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 2dai n LEU 20 Cb 0.47 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 2dai n LEU 20 CO 0.49 0.00 0.00 0.47 -1.22 0.00 0.00 177.39 177.13 2dai n ASP 21 N 0.00 0.00 -4.13 -1.43 9.92 -1.26 -5.10 116.55 114.55 2dai n ASP 21 Ca 0.00 0.00 -0.20 0.00 -0.53 0.00 0.00 54.79 54.06 2dai n ASP 21 Cb 0.00 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.35 2dai n ASP 21 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2dai s GLU 22 N -0.90 0.92 -0.20 -1.24 -1.05 -1.26 -5.13 118.70 109.84 2dai s GLU 22 Ca 0.00 -0.72 -0.01 0.00 -0.15 0.00 0.00 54.97 54.09 2dai s GLU 22 Cb 0.00 -0.92 0.06 0.00 -0.44 0.00 0.00 34.13 32.83 2dai s GLU 22 CO 0.00 0.23 -0.02 0.34 0.95 0.00 0.00 175.26 176.76 2dai s ASP 23 N -1.07 3.26 0.50 0.83 -1.08 -1.26 -5.03 116.67 112.82 2dai s ASP 23 Ca 0.01 -0.93 0.02 0.00 -0.52 0.00 0.00 52.55 51.14 2dai s ASP 23 Cb -0.08 -0.89 0.02 0.00 -1.46 0.00 0.00 42.92 40.51 2dai s ASP 23 CO 0.01 -0.25 0.71 -1.61 0.52 0.00 0.00 175.17 174.55 2dai s GLU 24 N 1.63 2.73 0.27 4.34 2.02 -1.26 -5.12 118.70 123.30 2dai s GLU 24 Ca -0.03 -0.78 0.11 0.00 0.02 0.00 0.00 54.97 54.29 2dai s GLU 24 Cb -0.17 -2.56 -0.05 0.00 0.10 0.00 0.00 34.13 31.45 2dai s GLU 24 CO -0.07 -0.51 -0.11 0.34 0.02 0.00 0.00 175.26 174.93 2dai s ASP 25 N -4.35 4.03 0.27 -0.19 2.15 -1.26 -4.98 116.67 112.34 2dai s ASP 25 Ca 0.54 -0.84 0.00 0.00 0.43 0.00 0.00 52.55 52.69 2dai s ASP 25 Cb -0.10 -0.56 0.00 0.00 -0.30 0.00 0.00 42.92 41.96 2dai s ASP 25 CO 0.37 0.03 0.00 -0.62 -0.17 0.00 0.00 175.17 174.78 2dai n GLU 26 N -0.68 -5.09 -1.33 4.34 1.02 -1.26 -4.94 120.64 112.70 2dai n GLU 26 Ca -0.06 3.65 0.15 0.00 -0.02 0.00 0.00 57.16 60.88 2dai n GLU 26 Cb 0.59 -3.94 -0.08 0.00 -0.02 0.00 0.00 31.44 27.99 2dai n GLU 26 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2dai n ARG 27 N 1.18 -2.86 -1.10 3.49 5.12 -1.26 -4.86 116.66 116.38 2dai n ARG 27 Ca 0.00 2.30 -0.29 0.00 -1.93 0.00 0.00 57.85 57.93 2dai n ARG 27 Cb 0.00 -3.43 0.19 0.00 -1.16 0.00 0.00 32.46 28.06 2dai n ARG 27 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2dai s VAL 28 N -4.18 2.03 0.07 1.55 1.01 -1.26 -5.00 120.40 114.61 2dai s VAL 28 Ca 0.00 0.01 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 2dai s VAL 28 Cb 0.00 -2.45 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 2dai s VAL 28 CO 0.00 -0.01 0.50 -0.62 0.00 0.00 0.00 175.10 174.96 2dai s ASP 29 N -3.36 6.89 -0.14 3.32 2.15 -1.26 -5.00 116.67 119.27 2dai s ASP 29 Ca 0.66 1.08 -0.16 0.00 0.43 0.00 0.00 52.55 54.56 2dai s ASP 29 Cb -0.19 -2.29 -0.24 0.00 -0.30 0.00 0.00 42.92 39.89 2dai s ASP 29 CO 0.58 0.24 0.40 1.05 -0.17 0.00 0.00 175.17 177.28 2dai h GLU 30 N 4.30 0.16 -0.41 4.34 4.11 -1.98 -2.98 114.58 122.12 2dai h GLU 30 Ca -0.50 -0.27 0.08 0.00 0.07 0.00 0.00 59.36 58.74 2dai h GLU 30 Cb 1.21 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 30.47 2dai h GLU 30 CO 0.63 1.13 -0.27 0.00 0.07 0.00 0.00 179.01 180.58 2dai h ALA 31 N -0.16 -0.05 0.66 1.06 0.00 -1.99 0.64 119.26 119.42 2dai h ALA 31 Ca -0.34 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2dai h ALA 31 Cb 1.65 0.61 0.01 0.00 0.00 0.00 0.00 17.79 20.05 2dai h ALA 31 CO -0.03 -0.65 -0.32 0.00 0.00 0.00 0.00 179.25 178.26 2dai h ALA 32 N 0.95 -0.88 -0.90 0.00 0.00 -1.94 -2.31 119.26 114.19 2dai h ALA 32 Ca 0.19 -0.21 0.21 0.00 0.00 0.00 0.00 54.91 55.10 2dai h ALA 32 Cb 0.50 0.34 -0.17 0.00 0.00 0.00 0.00 17.79 18.46 2dai h ALA 32 CO -0.52 -0.94 -0.08 1.25 0.00 0.00 0.00 179.25 178.96 2dai h LEU 33 N -0.99 -0.59 -0.39 0.00 5.85 -1.21 0.74 115.31 118.72 2dai h LEU 33 Ca -0.09 0.26 0.07 0.00 0.84 0.00 0.00 57.88 58.96 2dai h LEU 33 Cb 0.71 0.48 -0.06 0.00 0.37 0.00 0.00 40.66 42.15 2dai h LEU 33 CO 0.15 -0.29 -0.00 -0.09 -0.34 0.00 0.00 178.44 177.87 2dai h ARG 34 N 0.03 0.10 -0.26 1.25 2.43 0.52 0.11 114.38 118.56 2dai h ARG 34 Ca 0.49 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.70 2dai h ARG 34 Cb 0.87 -0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.32 2dai h ARG 34 CO -0.86 0.06 -0.44 1.96 -1.51 0.00 0.00 179.97 179.18 2dai h GLN 35 N 0.10 -0.41 0.30 0.20 4.20 0.10 1.34 115.11 120.95 2dai h GLN 35 Ca 0.19 0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 2dai h GLN 35 Cb 0.27 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 2dai h GLN 35 CO -0.32 -0.28 -0.21 -0.07 -0.67 0.00 0.00 178.83 177.29 2dai h LEU 36 N -0.43 -0.54 -1.39 1.46 3.38 -0.83 0.21 115.31 117.17 2dai h LEU 36 Ca 0.10 0.03 0.37 0.00 0.09 0.00 0.00 57.88 58.47 2dai h LEU 36 Cb 0.61 0.16 -0.12 0.00 0.09 0.00 0.00 40.66 41.41 2dai h LEU 36 CO -0.49 -0.31 0.78 0.71 0.09 0.00 0.00 178.44 179.22 2dai h THR 37 N -0.49 0.26 -0.36 0.22 1.35 -0.53 1.49 112.91 114.86 2dai h THR 37 Ca -0.04 -0.07 -0.14 0.00 -0.55 0.00 0.00 66.41 65.61 2dai h THR 37 Cb 0.40 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 66.86 2dai h THR 37 CO 0.02 0.03 -0.35 -0.33 -0.25 0.00 0.00 175.52 174.65 2dai h GLU 38 N 0.19 0.82 0.60 4.72 4.39 0.25 -3.27 114.58 122.28 2dai h GLU 38 Ca 0.74 -0.40 -0.03 0.00 0.34 0.00 0.00 59.36 60.01 2dai h GLU 38 Cb 2.18 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.84 2dai h GLU 38 CO -0.38 1.04 -0.29 0.52 -1.16 0.00 0.00 179.01 178.74 2dai h MET 39 N 0.68 -0.77 0.00 2.33 2.86 0.52 -3.47 114.93 117.09 2dai h MET 39 Ca 0.07 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2dai h MET 39 Cb 0.90 0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2dai h MET 39 CO 0.08 -0.46 0.00 0.41 1.06 0.00 0.00 176.91 178.00 2dai n GLY 40 N -0.85 -0.93 3.02 8.32 0.00 -0.30 -5.10 105.19 109.36 2dai n GLY 40 Ca -0.12 0.19 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 0.36 0.14 1.61 0.08 -1.22 -5.01 117.98 113.95 2dai s PHE 41 Ca 0.00 -0.74 -0.30 0.00 0.12 0.00 0.00 56.93 56.01 2dai s PHE 41 Cb 0.00 -0.27 -0.07 0.00 -0.57 0.00 0.00 43.02 42.11 2dai s PHE 41 CO 0.00 -0.26 1.13 -1.25 -0.10 0.00 0.00 175.22 174.74 2dai s PRO 42 N -2.43 4.53 0.15 0.24 0.04 -1.26 -4.17 135.00 132.12 2dai s PRO 42 Ca -0.07 1.74 -0.18 0.00 0.04 0.00 0.00 61.00 62.53 2dai s PRO 42 Cb -0.03 -3.30 0.05 0.00 0.04 0.00 0.00 34.50 31.26 2dai s PRO 42 CO -0.05 -0.04 1.68 1.49 0.04 0.00 0.00 177.00 180.12 2dai h GLU 43 N 5.65 -0.01 -0.62 4.56 4.81 -1.96 1.22 114.58 128.23 2dai h GLU 43 Ca -0.43 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 58.88 2dai h GLU 43 Cb 1.21 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 30.49 2dai h GLU 43 CO 0.75 -0.01 -0.46 -2.95 -0.73 0.00 0.00 179.01 175.61 2dai h ASN 44 N -0.01 -1.60 0.51 1.04 -1.07 -1.99 1.25 115.58 113.70 2dai h ASN 44 Ca 0.16 0.26 -0.02 0.00 0.07 0.00 0.00 56.30 56.76 2dai h ASN 44 Cb 0.25 0.72 0.00 0.00 -2.07 0.00 0.00 38.32 37.23 2dai h ASN 44 CO -0.34 -0.33 -0.24 0.03 0.07 0.00 0.00 177.43 176.61 2dai h ARG 45 N -0.22 -0.65 -0.98 4.14 3.08 -1.75 -2.02 114.38 115.98 2dai h ARG 45 Ca 0.17 0.04 0.24 0.00 0.07 0.00 0.00 59.98 60.51 2dai h ARG 45 Cb 0.56 0.15 -0.18 0.00 0.08 0.00 0.00 29.97 30.57 2dai h ARG 45 CO -0.72 -0.37 -0.07 0.00 -1.07 0.00 0.00 179.97 177.75 2dai h ALA 46 N -0.91 0.98 0.73 0.04 0.00 0.20 1.50 119.26 121.80 2dai h ALA 46 Ca -0.07 0.36 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 2dai h ALA 46 Cb 0.59 0.65 0.01 0.00 0.00 0.00 0.00 17.79 19.03 2dai h ALA 46 CO 0.11 -0.50 -0.37 1.15 0.00 0.00 0.00 179.25 179.64 2dai h THR 47 N 0.01 0.00 0.01 0.00 2.02 0.16 0.23 112.91 115.34 2dai h THR 47 Ca 0.55 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.76 2dai h THR 47 Cb 1.05 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 2dai h THR 47 CO -0.95 0.00 -0.39 0.50 0.37 0.00 0.00 175.52 175.05 2dai h LYS 48 N -1.00 -0.53 -0.62 6.66 3.64 -0.05 -0.41 116.57 124.25 2dai h LYS 48 Ca -0.10 0.04 0.12 0.00 -1.27 0.00 0.00 60.65 59.43 2dai h LYS 48 Cb 0.78 0.12 -0.12 0.00 -0.41 0.00 0.00 32.23 32.60 2dai h LYS 48 CO 0.15 -0.35 -0.28 0.00 -2.27 0.00 0.00 179.45 176.70 2dai h ALA 49 N 0.04 0.12 -0.20 5.00 0.00 0.20 0.71 119.26 125.13 2dai h ALA 49 Ca 0.05 0.20 0.04 0.00 0.00 0.00 0.00 54.91 55.20 2dai h ALA 49 Cb 0.63 0.70 -0.07 0.00 0.00 0.00 0.00 17.79 19.05 2dai h ALA 49 CO -0.30 -0.59 -0.47 -0.07 0.00 0.00 0.00 179.25 177.82 2dai h LEU 50 N -0.11 -1.49 -1.67 0.00 3.38 0.52 1.64 115.31 117.58 2dai h LEU 50 Ca 0.26 0.20 0.27 0.00 0.09 0.00 0.00 57.88 58.70 2dai h LEU 50 Cb 0.54 0.61 -0.07 0.00 0.09 0.00 0.00 40.66 41.83 2dai h LEU 50 CO -0.69 -0.43 0.70 1.56 0.09 0.00 0.00 178.44 179.66 2dai h GLN 51 N -0.49 0.22 0.00 1.13 4.20 0.64 1.83 115.11 122.64 2dai h GLN 51 Ca 0.07 -0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.65 2dai h GLN 51 Cb 0.64 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.35 2dai h GLN 51 CO -0.45 0.14 -0.77 -0.07 -0.67 0.00 0.00 178.83 177.00 2dai h LEU 52 N 0.22 0.00 -3.98 1.46 3.38 0.19 -3.27 115.31 113.32 2dai h LEU 52 Ca 0.53 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.86 2dai h LEU 52 Cb 1.68 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 42.10 2dai h LEU 52 CO -0.15 0.51 0.39 0.59 0.09 0.00 0.00 178.44 179.87 2dai n ASN 53 N -3.11 6.89 -4.22 -0.43 5.03 0.51 -4.88 115.26 115.05 2dai n ASN 53 Ca -0.01 -3.78 -0.38 0.00 0.87 0.00 0.00 54.58 51.27 2dai n ASN 53 Cb 0.76 -0.80 -0.07 0.00 -1.02 0.00 0.00 39.78 38.65 2dai n ASN 53 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 2dai n HIS 54 N -0.84 -1.04 -3.42 3.10 -0.00 0.13 0.12 115.22 113.26 2dai n HIS 54 Ca 0.57 0.62 -0.19 0.00 0.46 0.00 0.00 57.72 59.18 2dai n HIS 54 Cb 0.73 -1.68 0.07 0.00 -0.12 0.00 0.00 29.99 28.99 2dai n HIS 54 CO 0.00 0.00 0.00 -1.33 0.46 0.00 0.00 176.34 175.47 2dai n MET 55 N -3.69 -3.59 -4.14 1.57 2.81 0.51 -4.96 117.12 105.62 2dai n MET 55 Ca 0.10 0.77 -0.35 0.00 -1.81 0.00 0.00 57.70 56.41 2dai n MET 55 Cb 0.41 -5.50 -0.09 0.00 -0.71 0.00 0.00 33.22 27.32 2dai n MET 55 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2dai s SER 56 N -3.79 5.62 -0.06 7.83 0.15 0.31 -4.97 113.70 118.80 2dai s SER 56 Ca 0.28 0.19 -0.25 0.00 0.70 0.00 0.00 55.95 56.88 2dai s SER 56 Cb -0.05 -1.78 -0.24 0.00 -1.71 0.00 0.00 66.02 62.24 2dai s SER 56 CO 0.77 0.32 1.00 0.58 1.20 0.00 0.00 173.24 177.11 2dai h VAL 57 N 4.37 1.56 0.16 4.45 2.07 -1.90 -2.87 116.25 124.09 2dai h VAL 57 Ca -0.47 -2.00 -0.01 0.00 0.82 0.00 0.00 66.70 65.04 2dai h VAL 57 Cb 1.19 2.83 0.00 0.00 -1.52 0.00 0.00 31.29 33.79 2dai h VAL 57 CO 0.61 0.55 -0.08 1.55 0.02 0.00 0.00 177.57 180.22 2dai h PRO 58 N -0.52 -0.20 -0.84 1.57 0.13 -1.97 -3.20 132.00 126.97 2dai h PRO 58 Ca -0.03 0.01 0.12 0.00 -0.87 0.00 0.00 66.00 65.22 2dai h PRO 58 Cb 1.04 0.05 -0.13 0.00 0.13 0.00 0.00 31.00 32.09 2dai h PRO 58 CO 0.05 -0.14 -0.45 1.96 -0.23 0.00 0.00 178.00 179.20 2dai h GLN 59 N -0.67 -0.08 -0.94 0.86 1.08 -1.93 0.17 115.11 113.60 2dai h GLN 59 Ca -0.02 0.01 0.11 0.00 -1.45 0.00 0.00 58.65 57.30 2dai h GLN 59 Cb 0.16 0.02 -0.13 0.00 -0.05 0.00 0.00 27.48 27.48 2dai h GLN 59 CO 0.04 -0.05 -0.50 0.00 -0.95 0.00 0.00 178.83 177.36 2dai h ALA 60 N 0.91 -0.27 -0.25 3.87 0.00 -1.65 -0.62 119.26 121.26 2dai h ALA 60 Ca 0.24 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.35 2dai h ALA 60 Cb 0.54 1.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.49 2dai h ALA 60 CO -0.86 -0.83 -0.14 -0.12 0.00 0.00 0.00 179.25 177.30 2dai n MET 61 N -5.35 -0.11 -0.26 0.00 0.00 0.60 0.84 117.12 112.83 2dai n MET 61 Ca 0.05 1.01 0.07 0.00 -0.00 0.00 0.00 57.70 58.83 2dai n MET 61 Cb 0.33 -1.51 0.19 0.00 0.00 0.00 0.00 33.22 32.23 2dai n MET 61 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2dai h GLU 62 N 0.00 0.15 -0.71 2.12 5.08 -1.04 1.47 114.58 121.66 2dai h GLU 62 Ca 0.04 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2dai h GLU 62 Cb 0.10 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 2dai h GLU 62 CO -0.23 0.10 0.47 2.35 -1.00 0.00 0.00 179.01 180.70 2dai h TRP 63 N 0.16 0.78 0.00 4.33 7.01 0.12 0.74 115.95 129.08 2dai h TRP 63 Ca 0.45 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.41 2dai h TRP 63 Cb 0.81 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.61 2dai h TRP 63 CO -0.36 0.43 -0.26 -0.07 -2.79 0.00 0.00 178.44 175.39 2dai h LEU 64 N 0.78 0.00 0.20 0.65 3.38 0.82 0.72 115.31 121.87 2dai h LEU 64 Ca 0.30 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.95 2dai h LEU 64 Cb 0.18 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.96 2dai h LEU 64 CO -0.09 0.26 -1.44 0.40 0.09 0.00 0.00 178.44 177.66 2dai h ILE 65 N 0.00 1.31 0.01 1.22 2.04 0.44 -2.66 117.51 119.86 2dai h ILE 65 Ca -0.00 -2.81 -0.00 0.00 1.00 0.00 0.00 64.86 63.05 2dai h ILE 65 Cb 0.89 2.97 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 2dai h ILE 65 CO 0.03 0.84 -0.00 -0.33 0.00 0.00 0.00 178.15 178.69 2dai h GLU 66 N 0.12 -0.01 -0.32 2.37 4.39 0.36 -3.29 114.58 118.21 2dai h GLU 66 Ca -0.23 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.57 2dai h GLU 66 Cb 2.09 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.73 2dai h GLU 66 CO 0.24 -0.00 0.57 0.45 -1.16 0.00 0.00 179.01 179.10 2dai h HIS 67 N -0.03 0.00 -0.98 4.33 3.86 -1.06 -0.70 115.15 120.57 2dai h HIS 67 Ca -0.00 0.00 0.26 0.00 -1.16 0.00 0.00 60.37 59.47 2dai h HIS 67 Cb 0.01 0.00 -0.18 0.00 1.06 0.00 0.00 27.41 28.29 2dai h HIS 67 CO 0.04 0.00 0.00 0.00 0.86 0.00 0.00 177.93 178.83 2dai h ALA 68 N 1.16 1.10 -0.16 2.45 0.00 -1.53 0.90 119.26 123.17 2dai h ALA 68 Ca 0.15 0.34 -0.16 0.00 0.00 0.00 0.00 54.91 55.25 2dai h ALA 68 Cb 1.29 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.69 2dai h ALA 68 CO -0.00 -0.55 -0.51 0.93 0.00 0.00 0.00 179.25 179.12 2dai h GLU 69 N 0.01 0.63 -6.17 0.00 5.08 -1.30 -3.45 114.58 109.39 2dai h GLU 69 Ca 0.58 -0.46 -0.73 0.00 -1.00 0.00 0.00 59.36 57.74 2dai h GLU 69 Cb 1.16 0.08 0.04 0.00 0.50 0.00 0.00 28.75 30.53 2dai h GLU 69 CO -0.92 1.08 0.54 -3.47 -1.00 0.00 0.00 179.01 175.25 2dai n ASP 70 N -4.17 1.57 0.23 1.42 -0.08 0.31 -4.81 116.55 111.02 2dai n ASP 70 Ca -0.07 1.12 0.14 0.00 -1.51 0.00 0.00 54.79 54.47 2dai n ASP 70 Cb 0.60 -1.11 0.44 0.00 2.34 0.00 0.00 41.12 43.39 2dai n ASP 70 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2dai h PRO 71 N 5.13 0.00 -2.64 -0.67 0.13 -1.87 -3.33 132.00 128.76 2dai h PRO 71 Ca -0.48 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.94 2dai h PRO 71 Cb 1.35 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.13 2dai h PRO 71 CO 0.83 0.00 0.15 0.25 -0.23 0.00 0.00 178.00 178.99 2dai n THR 72 N -2.98 3.94 -0.06 1.56 -2.24 -1.26 -4.28 114.28 108.96 2dai n THR 72 Ca 0.02 -5.59 -0.04 0.00 -2.27 0.00 0.00 64.05 56.18 2dai n THR 72 Cb 0.40 -2.11 -0.12 0.00 -2.10 0.00 0.00 70.33 66.40 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 1.18 0.82 0.02 2.28 3.06 -1.25 -4.98 119.36 120.49 2dai n ILE 73 Ca 0.27 -0.59 0.00 0.00 -2.50 0.00 0.00 62.75 59.93 2dai n ILE 73 Cb 0.37 -0.44 0.00 0.00 0.54 0.00 0.00 39.64 40.11 2dai n ILE 73 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 2dai n ASP 74 N -2.46 -0.44 -4.39 9.51 2.03 -1.26 -4.95 116.55 114.58 2dai n ASP 74 Ca -0.20 0.33 -0.31 0.00 0.52 0.00 0.00 54.79 55.13 2dai n ASP 74 Cb 0.88 0.68 -0.14 0.00 -0.72 0.00 0.00 41.12 41.81 2dai n ASP 74 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2dai s THR 75 N -2.00 2.43 -0.56 5.18 2.01 -1.26 -5.08 115.64 116.36 2dai s THR 75 Ca 0.00 -1.22 -0.28 0.00 0.31 0.00 0.00 61.69 60.51 2dai s THR 75 Cb 0.00 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.55 2dai s THR 75 CO 0.00 0.41 1.50 -2.16 -0.69 0.00 0.00 174.62 173.68 2dai s PRO 76 N -1.17 3.19 0.20 4.92 0.04 -1.26 -4.77 135.00 136.15 2dai s PRO 76 Ca 0.12 0.50 0.05 0.00 0.04 0.00 0.00 61.00 61.72 2dai s PRO 76 Cb -0.10 -4.17 -0.05 0.00 0.04 0.00 0.00 34.50 30.22 2dai s PRO 76 CO 0.03 -2.07 -0.08 -0.51 0.04 0.00 0.00 177.00 174.41 2dai s LEU 77 N 6.56 2.44 -0.12 -3.56 1.43 -1.26 -5.08 118.68 119.10 2dai s LEU 77 Ca 0.55 -1.09 -0.15 0.00 -1.03 0.00 0.00 54.13 52.41 2dai s LEU 77 Cb -0.12 -0.43 -0.14 0.00 0.03 0.00 0.00 46.19 45.53 2dai s LEU 77 CO 0.24 -0.35 0.42 0.28 0.23 0.00 0.00 176.35 177.17 2dai h SER 78 N 2.59 -0.00 0.00 2.29 0.02 -1.95 -3.47 113.55 113.03 2dai h SER 78 Ca -0.38 -0.53 0.00 0.00 -0.84 0.00 0.00 61.79 60.05 2dai h SER 78 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2dai h SER 78 CO 0.64 0.76 0.00 0.61 -1.14 0.00 0.00 176.83 177.70 2dai n GLY 79 N 1.67 0.43 2.60 -3.77 0.00 -1.26 -4.66 105.19 100.20 2dai n GLY 79 Ca -0.05 -1.77 -0.33 0.00 0.00 0.00 0.00 46.02 43.86 2dai n GLY 79 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dai n PRO 80 N 0.00 2.61 -3.83 1.61 -0.04 -1.26 -4.79 135.00 129.29 2dai n PRO 80 Ca 0.00 -1.89 -0.13 0.00 -0.04 0.00 0.00 63.50 61.44 2dai n PRO 80 Cb 0.00 -2.73 -0.14 0.00 -0.04 0.00 0.00 33.50 30.58 2dai n PRO 80 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dai s SER 81 N 3.22 -0.00 -0.06 3.54 0.15 -1.26 -5.09 113.70 114.19 2dai s SER 81 Ca 0.53 0.05 -0.01 0.00 0.70 0.00 0.00 55.95 57.22 2dai s SER 81 Cb 0.14 0.02 -0.03 0.00 -1.71 0.00 0.00 66.02 64.43 2dai s SER 81 CO -0.03 -0.04 0.02 -0.94 1.20 0.00 0.00 173.24 173.45 2dai s SER 82 N 0.33 5.33 0.00 5.45 1.04 -1.26 -5.03 113.70 119.56 2dai s SER 82 Ca -0.03 0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.54 2dai s SER 82 Cb -0.04 -1.50 0.00 0.00 0.10 0.00 0.00 66.02 64.58 2dai s SER 82 CO -0.01 0.35 0.14 0.61 0.98 0.00 0.00 173.24 175.31