#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 -0.19 0.26 1.61 0.01 -1.26 -5.19 113.70 108.94 2dai s SER 2 Ca 0.00 -0.35 -0.14 0.00 1.31 0.00 0.00 55.95 56.77 2dai s SER 2 Cb 0.00 0.46 -0.00 0.00 0.21 0.00 0.00 66.02 66.69 2dai s SER 2 CO 0.00 -0.84 0.51 -0.94 0.41 0.00 0.00 173.24 172.38 2dai s SER 3 N -2.90 -0.09 0.00 2.44 1.04 -1.26 -5.17 113.70 107.77 2dai s SER 3 Ca 0.12 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.64 2dai s SER 3 Cb -0.01 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2dai s SER 3 CO 0.01 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 173.66 2dai n GLY 4 N -0.40 1.57 3.60 7.32 0.00 -1.26 -5.18 105.19 110.85 2dai n GLY 4 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 2dai n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dai s SER 5 N 0.54 -0.23 0.00 1.61 1.04 -1.26 -5.19 113.70 110.21 2dai s SER 5 Ca 0.00 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.65 2dai s SER 5 Cb 0.00 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.32 2dai s SER 5 CO 0.00 -0.24 0.00 -1.20 0.98 0.00 0.00 173.24 172.78 2dai n SER 6 N 0.54 0.00 -2.95 7.02 7.64 -1.26 -5.19 113.62 119.42 2dai n SER 6 Ca -0.06 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.74 2dai n SER 6 Cb 0.58 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.81 2dai n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dai s GLY 7 N 0.00 0.35 0.17 0.23 0.00 -1.26 -5.19 107.32 101.62 2dai s GLY 7 Ca 0.00 -0.72 -0.24 0.00 0.00 0.00 0.00 44.72 43.76 2dai s GLY 7 CO 0.00 -0.05 0.72 0.99 0.00 0.00 0.00 173.10 174.76 2dai s ASP 8 N -3.11 -0.41 0.27 1.64 1.01 -1.26 -5.19 116.67 109.63 2dai s ASP 8 Ca 0.16 -0.21 -0.01 0.00 0.71 0.00 0.00 52.55 53.20 2dai s ASP 8 Cb -0.05 0.59 -0.02 0.00 1.01 0.00 0.00 42.92 44.44 2dai s ASP 8 CO 0.11 -1.01 0.28 0.00 0.21 0.00 0.00 175.17 174.76 2dai s ALA 9 N -3.64 1.07 -0.25 5.23 0.00 -1.26 -5.17 121.76 117.74 2dai s ALA 9 Ca 0.06 -1.65 -0.18 0.00 0.00 0.00 0.00 51.96 50.19 2dai s ALA 9 Cb -0.02 1.32 0.07 0.00 0.00 0.00 0.00 23.12 24.49 2dai s ALA 9 CO -0.05 -0.69 0.64 0.54 0.00 0.00 0.00 175.76 176.20 2dai s VAL 10 N -3.74 -0.00 -0.01 0.00 0.11 -1.26 -5.16 120.40 110.33 2dai s VAL 10 Ca 0.35 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.45 2dai s VAL 10 Cb 0.03 -0.91 -0.03 0.00 -1.53 0.00 0.00 36.38 33.95 2dai s VAL 10 CO 0.17 0.00 -0.10 -0.70 -3.33 0.00 0.00 175.10 171.15 2dai s GLU 11 N 1.01 2.50 0.13 1.54 2.56 -1.26 -5.12 118.70 120.05 2dai s GLU 11 Ca -0.05 -0.73 -0.09 0.00 0.00 0.00 0.00 54.97 54.10 2dai s GLU 11 Cb -0.05 -2.44 -0.00 0.00 2.00 0.00 0.00 34.13 33.63 2dai s GLU 11 CO -0.09 0.61 0.24 -0.51 -0.56 0.00 0.00 175.26 174.94 2dai s LEU 12 N -1.17 1.18 -0.18 2.70 1.43 -1.26 -5.18 118.68 116.20 2dai s LEU 12 Ca 0.15 -0.76 -0.35 0.00 -1.03 0.00 0.00 54.13 52.13 2dai s LEU 12 Cb -0.11 1.12 0.14 0.00 0.03 0.00 0.00 46.19 47.37 2dai s LEU 12 CO 0.05 -0.81 1.24 0.12 0.23 0.00 0.00 176.35 177.17 2dai s PHE 13 N -3.92 -0.10 -0.35 0.29 2.19 -1.26 -5.10 117.98 109.73 2dai s PHE 13 Ca 0.11 0.05 0.02 0.00 0.33 0.00 0.00 56.93 57.44 2dai s PHE 13 Cb 0.04 0.52 0.29 0.00 -1.31 0.00 0.00 43.02 42.56 2dai s PHE 13 CO -0.05 -0.19 1.26 1.63 1.83 0.00 0.00 175.22 179.70 2dai n LYS 14 N -0.13 0.27 -4.00 10.12 5.02 -1.26 -5.15 118.16 123.03 2dai n LYS 14 Ca 0.00 -0.90 -0.34 0.00 -2.02 0.00 0.00 58.31 55.05 2dai n LYS 14 Cb 0.58 -0.38 -0.06 0.00 -0.02 0.00 0.00 35.03 35.15 2dai n LYS 14 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2dai s LYS 15 N 0.15 3.27 -0.30 1.97 -2.85 -1.26 -5.08 119.74 115.64 2dai s LYS 15 Ca 0.24 -0.35 -0.11 0.00 -1.00 0.00 0.00 55.97 54.76 2dai s LYS 15 Cb 0.25 -3.01 0.17 0.00 -2.06 0.00 0.00 37.83 33.18 2dai s LYS 15 CO -0.14 0.69 0.91 0.00 0.10 0.00 0.00 175.35 176.91 2dai s ALA 16 N -1.18 -2.89 0.00 0.59 0.00 -1.26 -5.14 121.76 111.88 2dai s ALA 16 Ca 0.22 1.75 0.00 0.00 0.00 0.00 0.00 51.96 53.93 2dai s ALA 16 Cb -0.12 -2.26 0.00 0.00 0.00 0.00 0.00 23.12 20.74 2dai s ALA 16 CO 0.13 -1.26 0.00 -1.71 0.00 0.00 0.00 175.76 172.92 2dai n ASN 17 N 5.32 0.00 0.13 0.00 5.15 -1.26 -5.07 115.26 119.53 2dai n ASN 17 Ca -0.06 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.92 2dai n ASN 17 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 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 0.00 0.00 -2.33 5.20 0.00 -1.26 -5.14 120.51 116.98 2dai n ALA 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2dai n ALA 18 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2dai n ALA 18 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2dai n MET 19 N -3.02 -5.26 -3.15 0.00 2.81 -1.26 -5.07 117.12 102.18 2dai n MET 19 Ca 0.00 3.79 0.05 0.00 -1.81 0.00 0.00 57.70 59.73 2dai n MET 19 Cb 0.00 -4.67 -0.01 0.00 -0.71 0.00 0.00 33.22 27.82 2dai n MET 19 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2dai s LEU 20 N -0.59 -0.72 -0.29 4.03 1.02 -1.26 -5.14 118.68 115.73 2dai s LEU 20 Ca 0.00 0.44 -0.10 0.00 0.02 0.00 0.00 54.13 54.49 2dai s LEU 20 Cb 0.00 1.60 -0.03 0.00 0.02 0.00 0.00 46.19 47.78 2dai s LEU 20 CO 0.00 -0.14 0.17 -0.62 0.02 0.00 0.00 176.35 175.78 2dai s ASP 21 N 2.93 5.78 -0.43 2.29 -1.08 -1.26 -5.00 116.67 119.90 2dai s ASP 21 Ca 0.06 -0.18 0.05 0.00 -0.52 0.00 0.00 52.55 51.96 2dai s ASP 21 Cb -0.11 -2.07 0.19 0.00 -1.46 0.00 0.00 42.92 39.47 2dai s ASP 21 CO -0.14 -0.09 0.45 -0.62 0.52 0.00 0.00 175.17 175.29 2dai n GLU 22 N 5.03 0.34 -1.45 4.34 -0.58 -1.26 -5.11 120.64 121.94 2dai n GLU 22 Ca -0.14 -2.92 0.15 0.00 -0.42 0.00 0.00 57.16 53.84 2dai n GLU 22 Cb 0.51 -1.57 -0.09 0.00 -0.57 0.00 0.00 31.44 29.73 2dai n GLU 22 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2dai n ASP 23 N 2.63 -7.72 -4.68 1.62 2.03 -1.26 -4.82 116.55 104.34 2dai n ASP 23 Ca 0.26 1.48 -0.32 0.00 0.52 0.00 0.00 54.79 56.73 2dai n ASP 23 Cb 0.51 -4.96 0.15 0.00 -0.72 0.00 0.00 41.12 36.09 2dai n ASP 23 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2dai s GLU 24 N -4.50 1.26 0.16 -0.67 0.41 -1.26 -5.04 118.70 109.06 2dai s GLU 24 Ca 0.00 1.60 -0.17 0.00 -0.41 0.00 0.00 54.97 55.99 2dai s GLU 24 Cb 0.00 -1.75 0.03 0.00 -1.78 0.00 0.00 34.13 30.64 2dai s GLU 24 CO 0.00 -2.46 0.48 -0.51 -0.49 0.00 0.00 175.26 172.28 2dai s ASP 25 N -2.54 -0.28 0.09 -0.19 1.01 -1.26 -5.07 116.67 108.43 2dai s ASP 25 Ca 0.69 -0.37 -0.25 0.00 0.71 0.00 0.00 52.55 53.33 2dai s ASP 25 Cb -0.24 0.54 -0.09 0.00 1.01 0.00 0.00 42.92 44.14 2dai s ASP 25 CO 0.55 -0.96 1.41 -0.33 0.21 0.00 0.00 175.17 176.05 2dai h GLU 26 N 2.24 -0.35 -6.30 8.23 5.08 -2.02 -3.42 114.58 118.04 2dai h GLU 26 Ca -0.31 0.02 -0.57 0.00 -1.00 0.00 0.00 59.36 57.50 2dai h GLU 26 Cb 1.27 0.08 0.19 0.00 0.50 0.00 0.00 28.75 30.79 2dai h GLU 26 CO 0.41 -0.23 -0.93 -2.13 -1.00 0.00 0.00 179.01 175.13 2dai n ARG 27 N -4.72 0.15 -2.21 2.33 0.00 -1.26 -4.96 116.66 106.00 2dai n ARG 27 Ca -0.03 0.07 -0.26 0.00 -0.00 0.00 0.00 57.85 57.63 2dai n ARG 27 Cb 0.27 -1.39 0.07 0.00 0.00 0.00 0.00 32.46 31.41 2dai n ARG 27 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2dai s VAL 28 N -1.95 2.33 0.12 5.15 1.01 -1.26 -5.06 120.40 120.74 2dai s VAL 28 Ca 0.58 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 62.13 2dai s VAL 28 Cb -0.37 -3.02 -0.07 0.00 0.00 0.00 0.00 36.38 32.92 2dai s VAL 28 CO 0.65 -0.02 0.58 -0.62 0.00 0.00 0.00 175.10 175.69 2dai s ASP 29 N -4.51 6.95 -0.19 3.32 -1.08 -1.26 -5.00 116.67 114.90 2dai s ASP 29 Ca 0.60 1.19 -0.20 0.00 -0.52 0.00 0.00 52.55 53.62 2dai s ASP 29 Cb -0.11 -2.33 -0.21 0.00 -1.46 0.00 0.00 42.92 38.81 2dai s ASP 29 CO 0.45 0.17 0.28 -0.33 0.52 0.00 0.00 175.17 176.25 2dai h GLU 30 N 3.97 0.04 -0.64 4.34 4.39 -1.98 -3.08 114.58 121.62 2dai h GLU 30 Ca -0.49 -0.07 0.12 0.00 0.34 0.00 0.00 59.36 59.26 2dai h GLU 30 Cb 1.20 0.03 -0.12 0.00 -0.10 0.00 0.00 28.75 29.76 2dai h GLU 30 CO 0.65 1.03 -0.29 0.00 -1.16 0.00 0.00 179.01 179.23 2dai h ALA 31 N -0.39 0.10 0.90 3.43 0.00 -1.99 0.74 119.26 122.05 2dai h ALA 31 Ca -0.34 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2dai h ALA 31 Cb 1.39 0.73 0.01 0.00 0.00 0.00 0.00 17.79 19.91 2dai h ALA 31 CO -0.16 -0.60 -0.43 0.00 0.00 0.00 0.00 179.25 178.06 2dai h ALA 32 N 1.20 -1.26 -0.96 0.00 0.00 -1.94 -2.67 119.26 113.63 2dai h ALA 32 Ca 0.27 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2dai h ALA 32 Cb 0.55 0.47 -0.14 0.00 0.00 0.00 0.00 17.79 18.66 2dai h ALA 32 CO -0.71 -1.17 -0.45 1.25 0.00 0.00 0.00 179.25 178.17 2dai h LEU 33 N -1.27 -1.66 -0.85 0.00 5.85 -1.20 0.83 115.31 117.01 2dai h LEU 33 Ca -0.12 0.31 0.19 0.00 0.84 0.00 0.00 57.88 59.10 2dai h LEU 33 Cb 0.93 0.81 -0.16 0.00 0.37 0.00 0.00 40.66 42.61 2dai h LEU 33 CO 0.20 -0.27 -0.09 0.03 -0.34 0.00 0.00 178.44 177.97 2dai h ARG 34 N -0.02 0.04 -0.35 1.25 -0.00 0.56 0.37 114.38 116.23 2dai h ARG 34 Ca 0.28 -0.00 0.08 0.00 -0.50 0.00 0.00 59.98 59.83 2dai h ARG 34 Cb 0.54 -0.01 -0.08 0.00 0.00 0.00 0.00 29.97 30.42 2dai h ARG 34 CO -0.95 0.02 -0.24 1.96 0.00 0.00 0.00 179.97 180.76 2dai h GLN 35 N 0.04 -0.19 0.37 0.04 4.20 0.10 1.40 115.11 121.07 2dai h GLN 35 Ca 0.45 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 59.15 2dai h GLN 35 Cb 0.78 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2dai h GLN 35 CO -0.81 -0.12 -0.18 -0.07 -0.67 0.00 0.00 178.83 176.97 2dai h LEU 36 N -0.19 -0.42 -1.65 1.46 3.38 -0.00 0.12 115.31 118.00 2dai h LEU 36 Ca 0.17 0.01 0.39 0.00 0.09 0.00 0.00 57.88 58.55 2dai h LEU 36 Cb 0.47 0.11 -0.09 0.00 0.09 0.00 0.00 40.66 41.24 2dai h LEU 36 CO -0.47 -0.27 0.89 0.71 0.09 0.00 0.00 178.44 179.39 2dai h THR 37 N -0.55 0.29 -0.17 0.22 1.35 -0.36 1.47 112.91 115.15 2dai h THR 37 Ca -0.05 -0.04 -0.19 0.00 -0.55 0.00 0.00 66.41 65.57 2dai h THR 37 Cb 0.38 0.15 0.00 0.00 -1.73 0.00 0.00 68.15 66.95 2dai h THR 37 CO 0.08 0.02 -0.66 -0.33 -0.25 0.00 0.00 175.52 174.38 2dai h GLU 38 N 0.13 0.67 0.27 4.72 4.39 0.22 -3.28 114.58 121.69 2dai h GLU 38 Ca 0.71 -0.49 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 2dai h GLU 38 Cb 2.40 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 31.14 2dai h GLU 38 CO -0.21 1.11 -0.13 0.52 -1.16 0.00 0.00 179.01 179.14 2dai h MET 39 N 0.49 -0.35 0.00 2.33 2.86 0.47 -3.47 114.93 117.26 2dai h MET 39 Ca -0.02 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2dai h MET 39 Cb 1.26 0.08 0.00 0.00 0.06 0.00 0.00 31.60 33.00 2dai h MET 39 CO 0.13 -0.10 0.00 0.41 1.06 0.00 0.00 176.91 178.41 2dai n GLY 40 N -0.70 -0.30 3.14 8.32 0.00 -0.29 -5.10 105.19 110.27 2dai n GLY 40 Ca -0.10 0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 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 0.96 -0.11 1.61 0.08 -1.20 -5.01 117.98 114.30 2dai s PHE 41 Ca 0.00 -0.61 -0.30 0.00 0.12 0.00 0.00 56.93 56.14 2dai s PHE 41 Cb 0.00 -0.54 -0.02 0.00 -0.57 0.00 0.00 43.02 41.89 2dai s PHE 41 CO 0.00 -0.03 1.25 -1.25 -0.10 0.00 0.00 175.22 175.09 2dai s PRO 42 N -2.43 4.28 0.22 0.24 0.04 -1.26 -4.18 135.00 131.92 2dai s PRO 42 Ca 0.01 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.61 2dai s PRO 42 Cb -0.05 -3.67 0.29 0.00 0.04 0.00 0.00 34.50 31.11 2dai s PRO 42 CO -0.00 -0.60 1.62 1.49 0.04 0.00 0.00 177.00 179.56 2dai h GLU 43 N 7.90 0.02 -0.33 4.56 4.22 -1.96 0.96 114.58 129.94 2dai h GLU 43 Ca -0.30 -0.00 0.03 0.00 0.08 0.00 0.00 59.36 59.17 2dai h GLU 43 Cb 1.13 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 2dai h GLU 43 CO 0.93 0.01 -0.23 -2.95 -2.18 0.00 0.00 179.01 174.59 2dai h ASN 44 N 0.02 -0.82 0.44 1.04 -1.07 -1.99 1.47 115.58 114.66 2dai h ASN 44 Ca 0.34 0.12 -0.02 0.00 0.07 0.00 0.00 56.30 56.81 2dai h ASN 44 Cb 0.53 0.36 0.00 0.00 -2.07 0.00 0.00 38.32 37.14 2dai h ASN 44 CO -0.69 -0.11 -0.21 0.03 0.07 0.00 0.00 177.43 176.52 2dai h ARG 45 N -0.05 -0.57 -0.99 4.14 3.08 -1.70 -2.45 114.38 115.84 2dai h ARG 45 Ca 0.05 0.04 0.21 0.00 0.07 0.00 0.00 59.98 60.35 2dai h ARG 45 Cb 0.18 0.13 -0.19 0.00 0.08 0.00 0.00 29.97 30.18 2dai h ARG 45 CO -0.33 -0.30 -0.21 0.00 -1.07 0.00 0.00 179.97 178.06 2dai h ALA 46 N -0.29 0.73 0.22 0.04 0.00 0.15 1.22 119.26 121.33 2dai h ALA 46 Ca -0.06 0.38 0.01 0.00 0.00 0.00 0.00 54.91 55.24 2dai h ALA 46 Cb 0.54 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2dai h ALA 46 CO 0.10 -0.41 -0.27 1.15 0.00 0.00 0.00 179.25 179.82 2dai h THR 47 N 0.00 0.41 0.87 0.00 2.02 0.22 0.99 112.91 117.42 2dai h THR 47 Ca 0.49 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.63 2dai h THR 47 Cb 0.80 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2dai h THR 47 CO -1.01 0.00 -0.50 0.50 0.37 0.00 0.00 175.52 174.89 2dai h LYS 48 N -0.55 -1.22 -0.97 6.66 3.64 0.47 -1.95 116.57 122.65 2dai h LYS 48 Ca 0.00 0.08 0.23 0.00 -1.27 0.00 0.00 60.65 59.69 2dai h LYS 48 Cb 0.53 0.28 -0.18 0.00 -0.41 0.00 0.00 32.23 32.44 2dai h LYS 48 CO -0.09 -0.81 -0.11 0.00 -2.27 0.00 0.00 179.45 176.16 2dai h ALA 49 N -1.23 0.88 0.17 5.00 0.00 0.13 0.47 119.26 124.68 2dai h ALA 49 Ca -0.12 0.36 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2dai h ALA 49 Cb 1.00 0.66 -0.04 0.00 0.00 0.00 0.00 17.79 19.41 2dai h ALA 49 CO 0.14 -0.47 -0.50 -0.07 0.00 0.00 0.00 179.25 178.36 2dai h LEU 50 N 0.01 -1.47 -0.89 0.00 3.38 -0.35 1.50 115.31 117.50 2dai h LEU 50 Ca 0.52 0.15 0.24 0.00 0.09 0.00 0.00 57.88 58.88 2dai h LEU 50 Cb 0.94 0.54 -0.14 0.00 0.09 0.00 0.00 40.66 42.08 2dai h LEU 50 CO -0.95 -0.56 0.25 1.56 0.09 0.00 0.00 178.44 178.83 2dai h GLN 51 N -0.76 0.20 0.00 1.13 4.20 0.62 1.90 115.11 122.39 2dai h GLN 51 Ca -0.00 -0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.57 2dai h GLN 51 Cb 0.76 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 2dai h GLN 51 CO -0.25 0.14 -0.61 -0.07 -0.67 0.00 0.00 178.83 177.37 2dai h LEU 52 N 0.21 0.00 -3.95 1.46 3.38 0.28 -2.95 115.31 113.74 2dai h LEU 52 Ca 0.56 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.92 2dai h LEU 52 Cb 1.14 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.61 2dai h LEU 52 CO -0.66 0.61 0.78 0.59 0.09 0.00 0.00 178.44 179.86 2dai n ASN 53 N -3.63 6.48 -4.10 -0.43 3.02 0.52 -4.86 115.26 112.25 2dai n ASN 53 Ca -0.01 -3.68 -0.36 0.00 -0.03 0.00 0.00 54.58 50.50 2dai n ASN 53 Cb 0.65 -0.94 -0.07 0.00 -0.61 0.00 0.00 39.78 38.81 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 -0.91 -1.08 -3.33 3.10 8.25 0.63 0.11 115.22 121.99 2dai n HIS 54 Ca 0.60 0.58 -0.16 0.00 -0.26 0.00 0.00 57.72 58.47 2dai n HIS 54 Cb 0.94 -1.61 0.07 0.00 1.12 0.00 0.00 29.99 30.52 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 -3.59 -3.65 -4.23 -0.41 2.81 0.52 -4.95 117.12 103.62 2dai n MET 55 Ca 0.10 0.84 -0.35 0.00 -1.81 0.00 0.00 57.70 56.48 2dai n MET 55 Cb 0.40 -5.77 -0.09 0.00 -0.71 0.00 0.00 33.22 27.05 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 -3.72 5.43 -0.06 7.83 0.15 0.30 -4.98 113.70 118.66 2dai s SER 56 Ca 0.30 0.14 -0.25 0.00 0.70 0.00 0.00 55.95 56.85 2dai s SER 56 Cb -0.04 -1.70 -0.24 0.00 -1.71 0.00 0.00 66.02 62.32 2dai s SER 56 CO 0.74 0.31 1.00 0.58 1.20 0.00 0.00 173.24 177.07 2dai h VAL 57 N 4.41 1.56 0.15 4.45 2.07 -1.90 -2.85 116.25 124.16 2dai h VAL 57 Ca -0.46 -2.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.02 2dai h VAL 57 Cb 1.19 2.86 0.00 0.00 -1.52 0.00 0.00 31.29 33.82 2dai h VAL 57 CO 0.60 0.56 -0.07 1.55 0.02 0.00 0.00 177.57 180.22 2dai h PRO 58 N -0.53 -0.20 -0.85 1.57 0.13 -1.97 -3.24 132.00 126.91 2dai h PRO 58 Ca -0.04 0.01 0.15 0.00 -0.87 0.00 0.00 66.00 65.25 2dai h PRO 58 Cb 1.06 0.05 -0.15 0.00 0.13 0.00 0.00 31.00 32.09 2dai h PRO 58 CO 0.05 -0.13 -0.32 1.96 -0.23 0.00 0.00 178.00 179.33 2dai h GLN 59 N -0.66 -0.04 -0.93 0.86 1.08 -1.93 0.18 115.11 113.66 2dai h GLN 59 Ca -0.02 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.29 2dai h GLN 59 Cb 0.16 0.01 -0.13 0.00 -0.05 0.00 0.00 27.48 27.47 2dai h GLN 59 CO 0.03 -0.03 -0.52 0.00 -0.95 0.00 0.00 178.83 177.37 2dai h ALA 60 N 1.43 -0.34 -0.39 3.87 0.00 -1.63 -0.43 119.26 121.77 2dai h ALA 60 Ca 0.34 0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.44 2dai h ALA 60 Cb 0.60 1.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.57 2dai h ALA 60 CO -0.88 -0.86 -0.23 -0.12 0.00 0.00 0.00 179.25 177.15 2dai n MET 61 N -5.34 -0.17 -0.24 0.00 0.00 0.62 0.78 117.12 112.77 2dai n MET 61 Ca 0.04 1.10 -0.00 0.00 -0.00 0.00 0.00 57.70 58.84 2dai n MET 61 Cb 0.31 -1.63 0.06 0.00 0.00 0.00 0.00 33.22 31.97 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 -0.03 -0.73 2.12 4.39 -1.05 1.73 114.58 121.01 2dai h GLU 62 Ca 0.06 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.86 2dai h GLU 62 Cb 0.16 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.77 2dai h GLU 62 CO -0.37 -0.02 0.48 2.35 -1.16 0.00 0.00 179.01 180.29 2dai h TRP 63 N -0.04 0.68 0.00 4.33 7.01 0.66 1.41 115.95 130.00 2dai h TRP 63 Ca 0.32 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 61.21 2dai h TRP 63 Cb 0.53 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.35 2dai h TRP 63 CO -0.59 0.33 -0.62 -0.07 -2.79 0.00 0.00 178.44 174.69 2dai h LEU 64 N 0.65 0.00 0.12 0.65 3.38 0.82 0.29 115.31 121.22 2dai h LEU 64 Ca 0.33 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 58.00 2dai h LEU 64 Cb 0.44 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.22 2dai h LEU 64 CO -0.12 0.62 -1.26 0.40 0.09 0.00 0.00 178.44 178.18 2dai h ILE 65 N 0.00 1.29 0.14 1.22 2.04 0.63 -1.15 117.51 121.68 2dai h ILE 65 Ca -0.01 -2.49 -0.01 0.00 1.00 0.00 0.00 64.86 63.36 2dai h ILE 65 Cb 1.27 2.71 0.00 0.00 -0.74 0.00 0.00 36.82 40.06 2dai h ILE 65 CO 0.08 0.76 -0.07 -0.33 0.00 0.00 0.00 178.15 178.59 2dai h GLU 66 N 0.27 -0.18 0.00 2.37 4.39 0.17 -3.16 114.58 118.44 2dai h GLU 66 Ca -0.19 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.52 2dai h GLU 66 Cb 1.93 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.62 2dai h GLU 66 CO 0.24 0.21 0.00 0.72 -1.16 0.00 0.00 179.01 179.03 2dai n HIS 67 N -4.88 0.08 -0.71 4.33 8.25 0.10 -3.01 115.22 119.39 2dai n HIS 67 Ca -0.06 0.04 0.53 0.00 -0.26 0.00 0.00 57.72 57.97 2dai n HIS 67 Cb 0.24 -0.56 0.82 0.00 1.12 0.00 0.00 29.99 31.61 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 2.32 3.85 -2.10 -1.41 0.00 -1.16 0.27 119.26 121.03 2dai h ALA 68 Ca 0.00 -0.06 -0.53 0.00 0.00 0.00 0.00 54.91 54.32 2dai h ALA 68 Cb 0.18 0.15 -0.41 0.00 0.00 0.00 0.00 17.79 17.71 2dai h ALA 68 CO 0.00 -2.42 -0.98 0.39 0.00 0.00 0.00 179.25 176.24 2dai n GLU 69 N -3.96 1.74 -4.41 0.00 -0.58 -1.16 -5.07 120.64 107.19 2dai n GLU 69 Ca 0.45 -3.90 -0.27 0.00 -0.42 0.00 0.00 57.16 53.01 2dai n GLU 69 Cb 2.01 -1.85 -0.12 0.00 -0.57 0.00 0.00 31.44 30.91 2dai n GLU 69 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2dai s ASP 70 N -2.62 3.49 -0.08 1.62 2.15 0.94 -5.06 116.67 117.10 2dai s ASP 70 Ca 0.42 -0.85 -0.25 0.00 0.43 0.00 0.00 52.55 52.31 2dai s ASP 70 Cb 0.30 -0.28 -0.20 0.00 -0.30 0.00 0.00 42.92 42.43 2dai s ASP 70 CO -0.10 0.12 0.91 1.55 -0.17 0.00 0.00 175.17 177.49 2dai h PRO 71 N 3.19 -0.05 -0.46 4.34 0.13 -1.91 -3.28 132.00 133.96 2dai h PRO 71 Ca -0.46 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.74 2dai h PRO 71 Cb 1.21 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.26 2dai h PRO 71 CO 0.48 0.60 -0.46 1.79 -0.23 0.00 0.00 178.00 180.17 2dai h THR 72 N -0.80 0.08 -1.30 1.56 1.35 -1.97 0.69 112.91 112.52 2dai h THR 72 Ca -0.01 0.00 0.41 0.00 -0.55 0.00 0.00 66.41 66.27 2dai h THR 72 Cb 0.67 0.08 -0.12 0.00 -1.73 0.00 0.00 68.15 67.05 2dai h THR 72 CO 0.01 0.00 0.85 -0.29 -0.25 0.00 0.00 175.52 175.83 2dai h ILE 73 N -0.32 0.19 -3.16 6.82 2.10 -1.90 -3.34 117.51 117.90 2dai h ILE 73 Ca 0.13 -0.04 -0.58 0.00 1.08 0.00 0.00 64.86 65.46 2dai h ILE 73 Cb 0.58 0.05 -0.06 0.00 -1.09 0.00 0.00 36.82 36.30 2dai h ILE 73 CO -0.61 0.02 0.68 -0.62 -1.08 0.00 0.00 178.15 176.54 2dai s ASP 74 N -4.61 7.10 -0.00 2.19 -1.08 0.24 -5.02 116.67 115.49 2dai s ASP 74 Ca -0.08 1.37 -0.04 0.00 -0.52 0.00 0.00 52.55 53.29 2dai s ASP 74 Cb 0.29 -2.53 -0.00 0.00 -1.46 0.00 0.00 42.92 39.22 2dai s ASP 74 CO 0.82 -0.58 0.08 -0.89 0.52 0.00 0.00 175.17 175.12 2dai s THR 75 N 2.79 0.07 -0.50 1.71 2.01 -1.26 -4.93 115.64 115.54 2dai s THR 75 Ca 0.44 -0.55 -0.28 0.00 0.31 0.00 0.00 61.69 61.60 2dai s THR 75 Cb -0.16 -0.30 0.01 0.00 0.01 0.00 0.00 72.50 72.06 2dai s THR 75 CO 0.10 -0.30 1.46 -2.16 -0.69 0.00 0.00 174.62 173.02 2dai s PRO 76 N -0.99 3.36 -0.41 4.92 0.04 -1.26 -4.97 135.00 135.69 2dai s PRO 76 Ca -0.11 0.69 -0.11 0.00 0.04 0.00 0.00 61.00 61.51 2dai s PRO 76 Cb -0.06 -4.11 0.05 0.00 0.04 0.00 0.00 34.50 30.42 2dai s PRO 76 CO 0.00 -1.85 0.25 -0.51 0.04 0.00 0.00 177.00 174.93 2dai s LEU 77 N 6.08 5.01 0.25 -3.56 1.43 -1.26 -4.93 118.68 121.70 2dai s LEU 77 Ca 0.58 -1.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2dai s LEU 77 Cb -0.12 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.07 2dai s LEU 77 CO 0.28 -0.48 0.00 -0.24 0.23 0.00 0.00 176.35 176.14 2dai n SER 78 N 4.99 -4.32 0.00 2.29 2.88 -1.26 -4.98 113.62 113.22 2dai n SER 78 Ca -0.11 0.67 0.00 0.00 -1.33 0.00 0.00 58.87 58.09 2dai n SER 78 Cb 0.44 -1.72 0.00 0.00 -0.75 0.00 0.00 64.21 62.18 2dai n SER 78 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dai n GLY 79 N -1.29 -1.82 0.20 0.46 0.00 -1.26 -4.76 105.19 96.73 2dai n GLY 79 Ca 0.00 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.73 2dai n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dai h PRO 80 N 0.00 0.68 -5.34 1.61 0.13 -2.04 -3.49 132.00 123.55 2dai h PRO 80 Ca 0.00 -0.66 -0.02 0.00 -0.87 0.00 0.00 66.00 64.45 2dai h PRO 80 Cb 0.00 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.30 2dai h PRO 80 CO 0.00 1.26 -0.81 0.45 -0.23 0.00 0.00 178.00 178.67 2dai n SER 81 N -3.86 -7.81 -4.67 1.44 2.88 -1.26 -4.83 113.62 95.50 2dai n SER 81 Ca -0.09 0.94 -0.42 0.00 -1.33 0.00 0.00 58.87 57.97 2dai n SER 81 Cb 0.83 -4.97 -0.03 0.00 -0.75 0.00 0.00 64.21 59.28 2dai n SER 81 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dai s SER 82 N -1.98 6.51 0.00 -3.46 0.01 -1.26 -5.22 113.70 108.30 2dai s SER 82 Ca 0.12 2.57 0.03 0.00 1.31 0.00 0.00 55.95 59.98 2dai s SER 82 Cb -0.03 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.68 2dai s SER 82 CO 0.74 -0.99 0.60 0.61 0.41 0.00 0.00 173.24 174.61