#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 -1.20 -1.23 0.00 0.00 175.04 172.61 2dai n SER 3 N 0.00 0.00 -3.24 -3.46 7.64 -1.26 -5.19 113.62 108.11 2dai n SER 3 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 2dai n SER 3 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 2dai n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dai s GLY 4 N 0.00 0.24 0.03 0.23 0.00 -1.26 -5.19 107.32 101.37 2dai s GLY 4 Ca 0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 44.72 43.81 2dai s GLY 4 CO 0.00 -0.25 1.17 -1.35 0.00 0.00 0.00 173.10 172.66 2dai s SER 5 N -3.02 -0.11 0.16 1.64 1.04 -1.26 -5.19 113.70 106.96 2dai s SER 5 Ca 0.14 -0.21 -0.16 0.00 0.48 0.00 0.00 55.95 56.21 2dai s SER 5 Cb -0.05 0.27 0.03 0.00 0.10 0.00 0.00 66.02 66.37 2dai s SER 5 CO 0.10 -0.50 0.43 -0.55 0.98 0.00 0.00 173.24 173.71 2dai s SER 6 N -2.91 -0.21 0.00 7.02 0.15 -1.26 -5.18 113.70 111.31 2dai s SER 6 Ca 0.13 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2dai s SER 6 Cb 0.02 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2dai s SER 6 CO -0.02 -0.94 0.00 0.61 1.20 0.00 0.00 173.24 174.09 2dai n GLY 7 N -0.27 4.85 3.73 9.45 0.00 -1.26 -5.19 105.19 116.51 2dai n GLY 7 Ca -0.13 -1.51 -0.06 0.00 0.00 0.00 0.00 46.02 44.32 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 0.36 -0.27 0.26 1.61 2.15 -1.26 -5.19 116.67 114.33 2dai s ASP 8 Ca 0.00 -0.39 -0.15 0.00 0.43 0.00 0.00 52.55 52.45 2dai s ASP 8 Cb 0.00 0.57 0.00 0.00 -0.30 0.00 0.00 42.92 43.19 2dai s ASP 8 CO 0.00 -1.03 0.54 0.00 -0.17 0.00 0.00 175.17 174.51 2dai s ALA 9 N -3.53 -0.47 -0.25 3.66 0.00 -1.26 -5.18 121.76 114.73 2dai s ALA 9 Ca 0.10 -0.75 -0.26 0.00 0.00 0.00 0.00 51.96 51.04 2dai s ALA 9 Cb -0.03 1.01 0.13 0.00 0.00 0.00 0.00 23.12 24.23 2dai s ALA 9 CO 0.01 -0.90 1.05 0.54 0.00 0.00 0.00 175.76 176.45 2dai s VAL 10 N -3.93 0.00 0.35 0.00 0.11 -1.26 -5.18 120.40 110.48 2dai s VAL 10 Ca 0.20 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.31 2dai s VAL 10 Cb -0.02 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.76 2dai s VAL 10 CO 0.09 0.00 -0.00 -1.61 -3.33 0.00 0.00 175.10 170.25 2dai s GLU 11 N -0.10 1.75 0.30 1.54 2.02 -1.26 -5.16 118.70 117.79 2dai s GLU 11 Ca 0.02 -1.95 0.02 0.00 0.02 0.00 0.00 54.97 53.08 2dai s GLU 11 Cb -0.04 -1.28 -0.02 0.00 0.10 0.00 0.00 34.13 32.89 2dai s GLU 11 CO -0.05 -0.06 0.29 -0.51 0.02 0.00 0.00 175.26 174.96 2dai s LEU 12 N -3.57 1.36 0.24 1.80 1.43 -1.26 -5.18 118.68 113.51 2dai s LEU 12 Ca 0.34 -1.56 0.09 0.00 -1.03 0.00 0.00 54.13 51.97 2dai s LEU 12 Cb 0.07 0.77 -0.05 0.00 0.03 0.00 0.00 46.19 47.02 2dai s LEU 12 CO 0.16 -1.06 -0.15 0.72 0.23 0.00 0.00 176.35 176.25 2dai s PHE 13 N -3.57 1.94 0.35 0.29 -0.12 -1.26 -5.16 117.98 110.45 2dai s PHE 13 Ca 0.37 -0.51 0.05 0.00 -0.05 0.00 0.00 56.93 56.79 2dai s PHE 13 Cb 0.03 -0.91 -0.07 0.00 -0.63 0.00 0.00 43.02 41.44 2dai s PHE 13 CO 0.21 0.47 0.03 -1.59 -0.05 0.00 0.00 175.22 174.29 2dai s LYS 14 N -3.61 1.76 0.12 1.99 0.00 -1.26 -5.16 119.74 113.58 2dai s LYS 14 Ca 0.26 -1.98 0.02 0.00 0.00 0.00 0.00 55.97 54.27 2dai s LYS 14 Cb -0.01 -1.19 -0.04 0.00 0.00 0.00 0.00 37.83 36.58 2dai s LYS 14 CO 0.10 -0.11 -0.07 -1.59 0.00 0.00 0.00 175.35 173.68 2dai s LYS 15 N -3.81 0.93 0.01 1.78 0.00 -1.26 -5.16 119.74 112.23 2dai s LYS 15 Ca 0.35 -1.39 0.01 0.00 0.00 0.00 0.00 55.97 54.94 2dai s LYS 15 Cb 0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 37.83 37.59 2dai s LYS 15 CO 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 175.35 175.48 2dai s ALA 16 N -3.55 0.21 0.10 0.59 0.00 -1.26 -5.16 121.76 112.69 2dai s ALA 16 Ca 0.15 -0.30 0.01 0.00 0.00 0.00 0.00 51.96 51.82 2dai s ALA 16 Cb 0.05 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 2dai s ALA 16 CO -0.02 -0.01 -0.05 -0.80 0.00 0.00 0.00 175.76 174.88 2dai s ASN 17 N -0.58 1.00 0.16 0.00 0.01 -1.26 -5.17 114.94 109.10 2dai s ASN 17 Ca -0.05 -1.03 -0.05 0.00 -0.71 0.00 0.00 52.86 51.02 2dai s ASN 17 Cb -0.04 0.12 -0.02 0.00 0.41 0.00 0.00 41.25 41.72 2dai s ASN 17 CO -0.00 -0.51 0.18 0.00 -1.51 0.00 0.00 177.10 175.26 2dai s ALA 18 N -3.70 0.48 -0.13 0.60 0.00 -1.26 -5.17 121.76 112.59 2dai s ALA 18 Ca 0.13 -1.23 -0.09 0.00 0.00 0.00 0.00 51.96 50.77 2dai s ALA 18 Cb 0.06 0.94 0.04 0.00 0.00 0.00 0.00 23.12 24.16 2dai s ALA 18 CO -0.04 -0.59 0.32 0.00 0.00 0.00 0.00 175.76 175.44 2dai s MET 19 N -4.03 0.33 0.00 0.00 0.23 -1.26 -5.12 119.30 109.46 2dai s MET 19 Ca 0.23 0.53 0.00 0.00 -1.03 0.00 0.00 55.69 55.42 2dai s MET 19 Cb 0.05 0.06 0.00 0.00 -1.53 0.00 0.00 34.83 33.42 2dai s MET 19 CO 0.03 -0.10 0.00 1.28 -2.03 0.00 0.00 175.02 174.20 2dai n LEU 20 N 3.51 0.00 -1.83 0.18 4.77 -1.26 -5.14 117.00 117.23 2dai n LEU 20 Ca -0.18 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.80 2dai n LEU 20 Cb 0.56 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.65 2dai n LEU 20 CO 0.14 0.00 -0.30 0.47 -1.33 0.00 0.00 177.39 176.37 2dai n ASP 21 N 0.00 -6.34 -4.75 -1.43 9.92 -1.26 -4.93 116.55 107.76 2dai n ASP 21 Ca 0.00 1.12 -0.37 0.00 -0.53 0.00 0.00 54.79 55.01 2dai n ASP 21 Cb 0.00 -3.56 0.04 0.00 -0.64 0.00 0.00 41.12 36.96 2dai n ASP 21 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2dai s GLU 22 N -1.15 2.89 -0.30 -1.24 2.02 -1.26 -4.92 118.70 114.74 2dai s GLU 22 Ca -0.01 1.94 -0.29 0.00 0.02 0.00 0.00 54.97 56.63 2dai s GLU 22 Cb 0.00 -1.95 -0.00 0.00 0.10 0.00 0.00 34.13 32.28 2dai s GLU 22 CO 0.02 -1.30 1.35 0.16 0.02 0.00 0.00 175.26 175.51 2dai s ASP 23 N -1.46 6.61 0.44 -0.19 1.47 -1.26 -5.00 116.67 117.28 2dai s ASP 23 Ca 0.78 1.22 0.06 0.00 1.18 0.00 0.00 52.55 55.79 2dai s ASP 23 Cb -0.34 -2.54 0.01 0.00 -0.34 0.00 0.00 42.92 39.72 2dai s ASP 23 CO 0.37 -1.13 0.61 -1.61 0.68 0.00 0.00 175.17 174.08 2dai s GLU 24 N 4.30 2.82 0.24 2.11 0.41 -1.26 -5.13 118.70 122.18 2dai s GLU 24 Ca 0.59 -1.04 0.07 0.00 -0.41 0.00 0.00 54.97 54.18 2dai s GLU 24 Cb -0.17 -2.69 -0.05 0.00 -1.78 0.00 0.00 34.13 29.44 2dai s GLU 24 CO 0.25 -0.33 -0.10 -0.51 -0.49 0.00 0.00 175.26 174.07 2dai s ASP 25 N -4.33 2.62 0.32 -0.19 1.01 -1.26 -5.04 116.67 109.80 2dai s ASP 25 Ca 0.54 -1.10 0.00 0.00 0.71 0.00 0.00 52.55 52.70 2dai s ASP 25 Cb -0.10 -0.14 0.00 0.00 1.01 0.00 0.00 42.92 43.69 2dai s ASP 25 CO 0.34 -0.26 0.00 -0.62 0.21 0.00 0.00 175.17 174.85 2dai n GLU 26 N -0.47 -5.15 -1.55 8.23 1.02 -1.26 -4.96 120.64 116.50 2dai n GLU 26 Ca -0.07 3.70 0.10 0.00 -0.02 0.00 0.00 57.16 60.88 2dai n GLU 26 Cb 0.62 -4.04 -0.06 0.00 -0.02 0.00 0.00 31.44 27.94 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 0.86 -3.81 -1.42 3.49 5.12 -1.26 -4.89 116.66 114.76 2dai n ARG 27 Ca 0.00 3.04 -0.29 0.00 -1.93 0.00 0.00 57.85 58.67 2dai n ARG 27 Cb 0.00 -4.07 0.14 0.00 -1.16 0.00 0.00 32.46 27.36 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 -4.86 2.27 -0.16 1.55 1.01 -1.26 -5.00 120.40 113.95 2dai s VAL 28 Ca 0.00 0.09 -0.21 0.00 0.00 0.00 0.00 61.98 61.86 2dai s VAL 28 Cb 0.00 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 2dai s VAL 28 CO 0.00 -0.12 0.64 -0.62 0.00 0.00 0.00 175.10 175.00 2dai s ASP 29 N -3.81 6.76 0.10 3.32 2.15 -1.26 -4.95 116.67 118.98 2dai s ASP 29 Ca 0.64 0.92 -0.11 0.00 0.43 0.00 0.00 52.55 54.42 2dai s ASP 29 Cb -0.16 -2.36 -0.18 0.00 -0.30 0.00 0.00 42.92 39.93 2dai s ASP 29 CO 0.55 -0.22 1.25 1.05 -0.17 0.00 0.00 175.17 177.63 2dai h GLU 30 N 7.25 0.67 -0.02 4.34 4.11 -1.98 -2.41 114.58 126.53 2dai h GLU 30 Ca -0.34 -0.66 0.03 0.00 0.07 0.00 0.00 59.36 58.45 2dai h GLU 30 Cb 1.16 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 30.52 2dai h GLU 30 CO 0.77 1.26 -0.48 0.00 0.07 0.00 0.00 179.01 180.63 2dai h ALA 31 N 0.52 -0.79 0.69 1.06 0.00 -1.99 0.42 119.26 119.16 2dai h ALA 31 Ca -0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2dai h ALA 31 Cb 1.59 0.86 -0.00 0.00 0.00 0.00 0.00 17.79 20.23 2dai h ALA 31 CO 0.18 -1.03 -0.42 0.00 0.00 0.00 0.00 179.25 177.98 2dai h ALA 32 N -0.20 -1.08 -0.99 0.00 0.00 -1.94 -2.09 119.26 112.97 2dai h ALA 32 Ca 0.04 -0.21 0.31 0.00 0.00 0.00 0.00 54.91 55.05 2dai h ALA 32 Cb 0.69 0.52 -0.18 0.00 0.00 0.00 0.00 17.79 18.81 2dai h ALA 32 CO -0.35 -1.12 0.19 1.25 0.00 0.00 0.00 179.25 179.21 2dai h LEU 33 N -1.05 -0.23 -0.25 0.00 5.85 -1.05 1.13 115.31 119.72 2dai h LEU 33 Ca -0.09 0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.96 2dai h LEU 33 Cb 0.84 0.42 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 2dai h LEU 33 CO 0.09 -0.37 -0.09 -0.09 -0.34 0.00 0.00 178.44 177.64 2dai h ARG 34 N 0.01 -0.04 -0.51 1.25 2.43 0.52 0.33 114.38 118.38 2dai h ARG 34 Ca 0.67 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.95 2dai h ARG 34 Cb 1.53 0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.99 2dai h ARG 34 CO -0.87 -0.03 -0.14 1.96 -1.51 0.00 0.00 179.97 179.38 2dai h GLN 35 N -0.04 -0.01 0.30 0.20 4.20 0.17 1.22 115.11 121.14 2dai h GLN 35 Ca 0.13 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 2dai h GLN 35 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2dai h GLN 35 CO -0.28 -0.01 -0.14 -0.07 -0.67 0.00 0.00 178.83 177.65 2dai h LEU 36 N -0.01 -0.34 -1.16 1.46 3.38 -0.78 0.92 115.31 118.78 2dai h LEU 36 Ca 0.24 0.01 0.36 0.00 0.09 0.00 0.00 57.88 58.58 2dai h LEU 36 Cb 0.39 0.09 -0.14 0.00 0.09 0.00 0.00 40.66 41.08 2dai h LEU 36 CO -0.53 -0.21 0.66 0.71 0.09 0.00 0.00 178.44 179.16 2dai h THR 37 N -0.47 0.24 -0.42 0.22 1.35 -0.11 1.46 112.91 115.18 2dai h THR 37 Ca -0.04 -0.08 -0.13 0.00 -0.55 0.00 0.00 66.41 65.61 2dai h THR 37 Cb 0.31 -0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 66.71 2dai h THR 37 CO 0.07 0.04 -0.26 -0.33 -0.25 0.00 0.00 175.52 174.79 2dai h GLU 38 N 0.23 0.89 0.16 4.72 4.39 0.17 -3.20 114.58 121.94 2dai h GLU 38 Ca 0.76 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 60.06 2dai h GLU 38 Cb 1.98 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.60 2dai h GLU 38 CO -0.54 1.04 -0.08 0.52 -1.16 0.00 0.00 179.01 178.79 2dai h MET 39 N 0.76 -0.21 0.00 2.33 2.86 0.45 -3.47 114.93 117.65 2dai h MET 39 Ca 0.09 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2dai h MET 39 Cb 0.81 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.52 2dai h MET 39 CO 0.07 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.45 2dai n GLY 40 N -0.71 -0.43 3.09 8.32 0.00 -0.04 -5.10 105.19 110.33 2dai n GLY 40 Ca -0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 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 0.71 -0.16 1.61 0.08 -1.20 -5.00 117.98 114.02 2dai s PHE 41 Ca 0.00 -0.65 -0.29 0.00 0.12 0.00 0.00 56.93 56.10 2dai s PHE 41 Cb 0.00 -0.43 -0.02 0.00 -0.57 0.00 0.00 43.02 42.01 2dai s PHE 41 CO 0.00 -0.12 1.27 -1.25 -0.10 0.00 0.00 175.22 175.02 2dai s PRO 42 N -2.36 4.23 0.29 0.24 0.04 -1.26 -4.20 135.00 131.97 2dai s PRO 42 Ca -0.03 1.68 0.02 0.00 0.04 0.00 0.00 61.00 62.71 2dai s PRO 42 Cb -0.05 -3.77 0.71 0.00 0.04 0.00 0.00 34.50 31.44 2dai s PRO 42 CO -0.02 -0.70 1.65 1.49 0.04 0.00 0.00 177.00 179.46 2dai h GLU 43 N 8.23 0.22 -0.07 4.56 4.81 -1.96 0.85 114.58 131.22 2dai h GLU 43 Ca -0.27 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.96 2dai h GLU 43 Cb 1.11 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 2dai h GLU 43 CO 0.97 0.15 -0.15 -0.97 -0.73 0.00 0.00 179.01 178.28 2dai h ASN 44 N 0.23 -0.48 0.46 1.04 -1.24 -1.99 0.91 115.58 114.51 2dai h ASN 44 Ca 0.55 0.06 -0.02 0.00 0.71 0.00 0.00 56.30 57.60 2dai h ASN 44 Cb 1.11 0.19 0.00 0.00 0.73 0.00 0.00 38.32 40.35 2dai h ASN 44 CO -0.64 -0.12 -0.22 0.03 -1.29 0.00 0.00 177.43 175.19 2dai h ARG 45 N -0.13 -0.59 -0.99 6.67 3.08 -1.64 -2.44 114.38 118.35 2dai h ARG 45 Ca 0.01 0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.30 2dai h ARG 45 Cb 0.17 0.13 -0.19 0.00 0.08 0.00 0.00 29.97 30.17 2dai h ARG 45 CO -0.14 -0.35 -0.25 0.00 -1.07 0.00 0.00 179.97 178.16 2dai h ALA 46 N -0.20 0.62 -0.04 0.04 0.00 0.89 0.89 119.26 121.46 2dai h ALA 46 Ca -0.06 0.38 0.03 0.00 0.00 0.00 0.00 54.91 55.26 2dai h ALA 46 Cb 0.52 0.76 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 2dai h ALA 46 CO 0.10 -0.39 -0.16 1.15 0.00 0.00 0.00 179.25 179.95 2dai h THR 47 N -0.00 0.60 0.59 0.00 2.02 0.11 0.24 112.91 116.46 2dai h THR 47 Ca 0.47 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.62 2dai h THR 47 Cb 0.71 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 2dai h THR 47 CO -1.01 0.00 -0.31 0.50 0.37 0.00 0.00 175.52 175.06 2dai h LYS 48 N -0.25 -0.79 -0.97 6.66 3.64 0.79 -2.53 116.57 123.12 2dai h LYS 48 Ca 0.07 0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.63 2dai h LYS 48 Cb 0.33 0.18 -0.15 0.00 -0.41 0.00 0.00 32.23 32.19 2dai h LYS 48 CO -0.18 -0.53 -0.44 0.00 -2.27 0.00 0.00 179.45 176.03 2dai h ALA 49 N -1.53 -0.04 -0.61 5.00 0.00 0.53 0.15 119.26 122.76 2dai h ALA 49 Ca -0.08 0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.11 2dai h ALA 49 Cb 0.64 1.09 -0.07 0.00 0.00 0.00 0.00 17.79 19.45 2dai h ALA 49 CO 0.11 -0.72 -0.36 -0.07 0.00 0.00 0.00 179.25 178.21 2dai h LEU 50 N -0.02 -1.33 -0.59 0.00 3.38 -0.37 1.55 115.31 117.93 2dai h LEU 50 Ca 0.29 0.20 0.06 0.00 0.09 0.00 0.00 57.88 58.53 2dai h LEU 50 Cb 0.55 0.59 -0.09 0.00 0.09 0.00 0.00 40.66 41.80 2dai h LEU 50 CO -0.96 -0.14 -0.56 1.56 0.09 0.00 0.00 178.44 178.43 2dai h GLN 51 N -0.01 -0.26 -0.09 1.13 4.20 -0.31 2.05 115.11 121.83 2dai h GLN 51 Ca 0.10 0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.85 2dai h GLN 51 Cb 0.26 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 2dai h GLN 51 CO -0.58 -0.17 0.14 -0.07 -0.67 0.00 0.00 178.83 177.48 2dai h LEU 52 N -0.27 0.00 -3.84 1.46 3.38 -0.04 0.30 115.31 116.30 2dai h LEU 52 Ca 0.10 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.54 2dai h LEU 52 Cb 0.53 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.99 2dai h LEU 52 CO -0.70 0.00 0.38 0.59 0.09 0.00 0.00 178.44 178.80 2dai n ASN 53 N -3.59 5.35 -4.22 -0.43 5.03 0.54 -4.90 115.26 113.04 2dai n ASN 53 Ca -0.01 -3.74 -0.33 0.00 0.87 0.00 0.00 54.58 51.37 2dai n ASN 53 Cb 0.24 -0.78 -0.08 0.00 -1.02 0.00 0.00 39.78 38.13 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 -0.98 -1.12 -3.65 3.10 -0.00 0.10 0.16 115.22 112.83 2dai n HIS 54 Ca 0.54 0.59 -0.29 0.00 0.46 0.00 0.00 57.72 59.02 2dai n HIS 54 Cb 1.03 -2.23 0.04 0.00 -0.12 0.00 0.00 29.99 28.71 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 -4.09 -1.24 -4.47 1.57 2.81 0.57 -4.93 117.12 107.34 2dai n MET 55 Ca -0.14 0.54 -0.34 0.00 -1.81 0.00 0.00 57.70 55.95 2dai n MET 55 Cb 0.55 -4.11 -0.11 0.00 -0.71 0.00 0.00 33.22 28.85 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 -3.41 4.94 -0.05 7.83 0.01 0.12 -4.98 113.70 118.17 2dai s SER 56 Ca 0.42 0.03 -0.24 0.00 1.31 0.00 0.00 55.95 57.48 2dai s SER 56 Cb -0.15 -1.42 -0.25 0.00 0.21 0.00 0.00 66.02 64.41 2dai s SER 56 CO 0.86 0.33 0.99 0.58 0.41 0.00 0.00 173.24 176.41 2dai h VAL 57 N 4.38 1.55 0.15 3.43 2.07 -1.90 -2.92 116.25 123.01 2dai h VAL 57 Ca -0.46 -2.10 -0.01 0.00 0.82 0.00 0.00 66.70 64.95 2dai h VAL 57 Cb 1.18 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.83 2dai h VAL 57 CO 0.55 0.58 -0.07 1.55 0.02 0.00 0.00 177.57 180.20 2dai h PRO 58 N -0.47 -0.20 -0.68 1.57 0.13 -1.97 -3.13 132.00 127.25 2dai h PRO 58 Ca -0.05 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 65.16 2dai h PRO 58 Cb 1.14 0.05 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 2dai h PRO 58 CO 0.07 -0.13 -0.51 1.96 -0.23 0.00 0.00 178.00 179.16 2dai h GLN 59 N -0.65 -0.14 -0.99 0.86 1.08 -1.93 0.19 115.11 113.54 2dai h GLN 59 Ca -0.02 0.01 0.15 0.00 -1.45 0.00 0.00 58.65 57.34 2dai h GLN 59 Cb 0.16 0.03 -0.16 0.00 -0.05 0.00 0.00 27.48 27.46 2dai h GLN 59 CO 0.03 -0.09 -0.38 0.00 -0.95 0.00 0.00 178.83 177.44 2dai n ALA 60 N -3.15 -0.12 -0.10 3.87 0.00 -1.10 -0.98 120.51 118.93 2dai n ALA 60 Ca -0.00 0.99 -0.03 0.00 0.00 0.00 0.00 53.44 54.40 2dai n ALA 60 Cb 0.26 -0.44 -0.02 0.00 0.00 0.00 0.00 19.45 19.24 2dai n ALA 60 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2dai n MET 61 N -5.46 -0.11 -0.19 0.00 0.00 0.65 0.59 117.12 112.61 2dai n MET 61 Ca 0.10 1.09 -0.01 0.00 0.00 0.00 0.00 57.70 58.88 2dai n MET 61 Cb 0.40 -1.62 0.07 0.00 0.00 0.00 0.00 33.22 32.06 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 0.05 -0.89 2.12 5.08 -0.85 0.93 114.58 121.03 2dai h GLU 62 Ca 0.04 -0.00 0.20 0.00 -1.00 0.00 0.00 59.36 58.60 2dai h GLU 62 Cb 0.10 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.27 2dai h GLU 62 CO -0.23 0.03 0.59 2.35 -1.00 0.00 0.00 179.01 180.76 2dai h TRP 63 N 0.05 0.52 0.00 4.33 7.01 0.68 1.35 115.95 129.90 2dai h TRP 63 Ca 0.28 0.02 -0.16 0.00 2.11 0.00 0.00 58.89 61.14 2dai h TRP 63 Cb 0.45 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.32 2dai h TRP 63 CO -0.41 0.14 -0.77 -0.07 -2.79 0.00 0.00 178.44 174.55 2dai h LEU 64 N 0.39 0.00 -0.31 0.65 3.38 0.62 0.14 115.31 120.19 2dai h LEU 64 Ca 0.46 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.23 2dai h LEU 64 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 2dai h LEU 64 CO -0.17 0.77 -0.82 0.40 0.09 0.00 0.00 178.44 178.71 2dai h ILE 65 N 0.00 1.40 0.02 1.22 2.04 0.53 -0.23 117.51 122.49 2dai h ILE 65 Ca -0.01 -2.30 -0.00 0.00 1.00 0.00 0.00 64.86 63.55 2dai h ILE 65 Cb 1.45 2.26 0.00 0.00 -0.74 0.00 0.00 36.82 39.79 2dai h ILE 65 CO 0.10 0.69 -0.01 -0.08 0.00 0.00 0.00 178.15 178.85 2dai h GLU 66 N 0.24 -0.02 0.00 2.37 4.22 0.78 -3.24 114.58 118.92 2dai h GLU 66 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.39 2dai h GLU 66 Cb 1.42 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.68 2dai h GLU 66 CO 0.14 0.53 0.00 0.72 -2.18 0.00 0.00 179.01 178.22 2dai n HIS 67 N -4.71 0.12 -0.70 0.92 8.25 0.48 -2.97 115.22 116.61 2dai n HIS 67 Ca -0.06 0.05 0.53 0.00 -0.26 0.00 0.00 57.72 57.98 2dai n HIS 67 Cb 0.27 -0.58 0.82 0.00 1.12 0.00 0.00 29.99 31.62 2dai n HIS 67 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dai h ALA 68 N 2.30 3.82 -2.08 -1.41 0.00 -1.06 0.37 119.26 121.20 2dai h ALA 68 Ca 0.00 -0.06 -0.52 0.00 0.00 0.00 0.00 54.91 54.33 2dai h ALA 68 Cb 0.17 0.15 -0.41 0.00 0.00 0.00 0.00 17.79 17.71 2dai h ALA 68 CO 0.00 -2.39 -0.96 0.39 0.00 0.00 0.00 179.25 176.28 2dai n GLU 69 N -3.98 1.95 -4.33 0.00 1.02 -1.16 -5.08 120.64 109.06 2dai n GLU 69 Ca 0.44 -4.00 -0.28 0.00 -0.02 0.00 0.00 57.16 53.30 2dai n GLU 69 Cb 1.99 -1.92 -0.11 0.00 -0.02 0.00 0.00 31.44 31.38 2dai n GLU 69 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dai s ASP 70 N -2.89 3.84 -0.08 1.62 2.15 0.13 -5.06 116.67 116.38 2dai s ASP 70 Ca 0.43 -0.63 -0.23 0.00 0.43 0.00 0.00 52.55 52.55 2dai s ASP 70 Cb 0.33 -0.50 -0.19 0.00 -0.30 0.00 0.00 42.92 42.25 2dai s ASP 70 CO -0.10 0.15 0.86 1.55 -0.17 0.00 0.00 175.17 177.46 2dai h PRO 71 N 3.47 -0.08 -0.49 4.34 0.13 -1.96 -3.26 132.00 134.16 2dai h PRO 71 Ca -0.49 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 64.72 2dai h PRO 71 Cb 1.18 0.02 -0.10 0.00 0.13 0.00 0.00 31.00 32.24 2dai h PRO 71 CO 0.47 0.51 -0.46 1.79 -0.23 0.00 0.00 178.00 180.08 2dai h THR 72 N -0.83 0.07 -1.01 1.56 1.35 -1.97 0.53 112.91 112.62 2dai h THR 72 Ca -0.01 0.00 0.36 0.00 -0.55 0.00 0.00 66.41 66.21 2dai h THR 72 Cb 0.63 0.07 -0.16 0.00 -1.73 0.00 0.00 68.15 66.97 2dai h THR 72 CO 0.01 0.00 0.57 -0.29 -0.25 0.00 0.00 175.52 175.56 2dai h ILE 73 N -0.30 0.19 -3.41 6.82 2.10 -1.91 -3.46 117.51 117.55 2dai h ILE 73 Ca 0.14 -0.07 0.37 0.00 1.08 0.00 0.00 64.86 66.38 2dai h ILE 73 Cb 0.58 -0.03 -0.15 0.00 -1.09 0.00 0.00 36.82 36.12 2dai h ILE 73 CO -0.63 0.04 -0.94 -0.67 -1.08 0.00 0.00 178.15 174.87 2dai n ASP 74 N -5.11 -8.64 -3.80 2.19 -0.08 0.19 -4.99 116.55 96.30 2dai n ASP 74 Ca 0.34 1.07 -0.13 0.00 -1.51 0.00 0.00 54.79 54.57 2dai n ASP 74 Cb 1.10 -4.74 -0.10 0.00 2.34 0.00 0.00 41.12 39.72 2dai n ASP 74 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2dai s THR 75 N -3.37 0.05 0.74 5.18 2.01 -1.26 -5.04 115.64 113.95 2dai s THR 75 Ca 0.00 -0.39 -0.13 0.00 0.31 0.00 0.00 61.69 61.48 2dai s THR 75 Cb 0.00 -0.49 0.18 0.00 0.01 0.00 0.00 72.50 72.19 2dai s THR 75 CO 0.00 -0.21 0.82 -0.81 -0.69 0.00 0.00 174.62 173.72 2dai n PRO 76 N 1.83 -1.65 -5.23 4.92 -0.04 -1.26 -5.07 135.00 128.50 2dai n PRO 76 Ca -0.19 -1.28 -0.32 0.00 -0.04 0.00 0.00 63.50 61.67 2dai n PRO 76 Cb 0.56 -1.01 -0.16 0.00 -0.04 0.00 0.00 33.50 32.85 2dai n PRO 76 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dai s LEU 77 N 0.00 2.12 0.00 1.53 1.02 -1.26 -4.98 118.68 117.11 2dai s LEU 77 Ca 0.49 -0.51 0.00 0.00 0.02 0.00 0.00 54.13 54.14 2dai s LEU 77 Cb -0.03 -1.40 0.00 0.00 0.02 0.00 0.00 46.19 44.79 2dai s LEU 77 CO 0.36 0.23 0.00 -1.54 0.02 0.00 0.00 176.35 175.42 2dai n SER 78 N 3.07 0.00 0.00 2.29 3.41 -1.26 -5.17 113.62 115.96 2dai n SER 78 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 2dai n SER 78 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2dai n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dai n GLY 79 N 1.78 -0.53 3.79 5.00 0.00 -1.26 -5.13 105.19 108.83 2dai n GLY 79 Ca 0.00 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 2dai n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dai s PRO 80 N -1.80 3.98 0.07 1.61 0.04 -1.26 -4.97 135.00 132.68 2dai s PRO 80 Ca 0.00 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.49 2dai s PRO 80 Cb 0.00 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2dai s PRO 80 CO 0.00 -0.29 0.00 -1.13 0.04 0.00 0.00 177.00 175.62 2dai n SER 81 N -0.50 0.32 -3.54 6.66 3.41 -1.26 -5.13 113.62 113.58 2dai n SER 81 Ca 0.07 0.11 -0.11 0.00 -0.26 0.00 0.00 58.87 58.68 2dai n SER 81 Cb 0.51 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 2dai n SER 81 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dai s SER 82 N -5.31 -0.38 0.00 4.04 0.01 -1.26 -5.32 113.70 105.48 2dai s SER 82 Ca 0.00 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.08 2dai s SER 82 Cb 0.00 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.76 2dai s SER 82 CO 0.00 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.36