#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 1.92 -1.40 1.61 7.64 -1.26 -5.11 113.62 117.03 2dai n SER 2 Ca 0.00 0.39 0.17 0.00 1.01 0.00 0.00 58.87 60.44 2dai n SER 2 Cb 0.00 -0.78 -0.08 0.00 -1.01 0.00 0.00 64.21 62.34 2dai n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dai n SER 3 N -4.46 -7.65 0.00 6.43 7.64 -1.26 -5.05 113.62 109.27 2dai n SER 3 Ca -0.18 1.21 0.00 0.00 1.01 0.00 0.00 58.87 60.91 2dai n SER 3 Cb 0.52 -4.68 0.00 0.00 -1.01 0.00 0.00 64.21 59.05 2dai n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dai n GLY 4 N -4.23 2.21 3.63 0.23 0.00 -1.26 -5.14 105.19 100.63 2dai n GLY 4 Ca -0.07 -1.91 -0.02 0.00 0.00 0.00 0.00 46.02 44.02 2dai n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dai s SER 5 N 0.00 -0.12 -0.09 1.61 0.01 -1.26 -5.16 113.70 108.69 2dai s SER 5 Ca 0.00 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2dai s SER 5 Cb 0.00 0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.47 2dai s SER 5 CO 0.00 -0.40 -0.09 -0.44 0.41 0.00 0.00 173.24 172.73 2dai s SER 6 N -2.73 1.95 0.33 2.44 0.01 -1.26 -5.11 113.70 109.33 2dai s SER 6 Ca 0.12 -0.28 0.04 0.00 1.31 0.00 0.00 55.95 57.14 2dai s SER 6 Cb 0.02 -0.80 -0.03 0.00 0.21 0.00 0.00 66.02 65.42 2dai s SER 6 CO -0.04 -0.07 0.17 -0.83 0.41 0.00 0.00 173.24 172.89 2dai s GLY 7 N 1.33 2.24 0.16 3.44 0.00 -1.26 -5.05 107.32 108.18 2dai s GLY 7 Ca -0.02 -1.69 -0.23 0.00 0.00 0.00 0.00 44.72 42.78 2dai s GLY 7 CO -0.04 -1.63 1.62 -1.80 0.00 0.00 0.00 173.10 171.25 2dai h ASP 8 N 2.09 -0.91 -0.50 1.64 3.58 -2.07 -3.41 116.42 116.85 2dai h ASP 8 Ca -0.33 0.16 0.15 0.00 0.42 0.00 0.00 57.03 57.43 2dai h ASP 8 Cb 1.25 0.42 -0.19 0.00 1.72 0.00 0.00 39.33 42.53 2dai h ASP 8 CO 0.51 -0.30 -0.14 0.00 -2.88 0.00 0.00 179.24 176.42 2dai s ALA 9 N -6.05 -3.53 0.43 -0.78 0.00 -1.26 -4.99 121.76 105.59 2dai s ALA 9 Ca -0.15 1.23 0.32 0.00 0.00 0.00 0.00 51.96 53.36 2dai s ALA 9 Cb 0.13 -2.76 1.75 0.00 0.00 0.00 0.00 23.12 22.24 2dai s ALA 9 CO 0.68 -2.05 1.98 -0.24 0.00 0.00 0.00 175.76 176.13 2dai h VAL 10 N 4.90 0.00 -3.80 0.00 3.04 -2.00 -3.47 116.25 114.92 2dai h VAL 10 Ca -0.06 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 2dai h VAL 10 Cb 1.18 0.72 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 2dai h VAL 10 CO -0.01 0.00 -0.95 -0.62 -1.01 0.00 0.00 177.57 174.98 2dai n GLU 11 N -2.75 -4.54 -3.97 4.17 1.02 -1.26 -4.95 120.64 108.36 2dai n GLU 11 Ca -0.02 3.42 -0.29 0.00 -0.02 0.00 0.00 57.16 60.25 2dai n GLU 11 Cb 0.19 -3.98 -0.16 0.00 -0.02 0.00 0.00 31.44 27.47 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 -4.08 1.67 -0.29 -4.62 2.96 -1.26 -5.10 118.68 107.96 2dai s LEU 12 Ca 0.00 -0.54 -0.22 0.00 -0.22 0.00 0.00 54.13 53.15 2dai s LEU 12 Cb 0.00 -1.08 0.15 0.00 0.50 0.00 0.00 46.19 45.76 2dai s LEU 12 CO 0.00 -0.10 1.14 0.12 -1.32 0.00 0.00 176.35 176.19 2dai s PHE 13 N 1.54 -0.36 -0.40 5.38 5.36 -1.26 -5.11 117.98 123.13 2dai s PHE 13 Ca 0.03 0.81 -0.02 0.00 -0.96 0.00 0.00 56.93 56.79 2dai s PHE 13 Cb -0.14 0.36 0.21 0.00 -0.34 0.00 0.00 43.02 43.11 2dai s PHE 13 CO -0.09 -0.17 0.99 1.17 -1.46 0.00 0.00 175.22 175.65 2dai n LYS 14 N 2.49 0.24 -3.59 10.12 4.81 -1.26 -5.16 118.16 125.81 2dai n LYS 14 Ca -0.14 -1.17 -0.10 0.00 -0.87 0.00 0.00 58.31 56.02 2dai n LYS 14 Cb 0.57 -0.37 -0.03 0.00 0.02 0.00 0.00 35.03 35.21 2dai n LYS 14 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2dai s LYS 15 N 0.93 1.33 0.14 1.64 2.36 -1.26 -5.10 119.74 119.78 2dai s LYS 15 Ca 0.26 -0.68 0.00 0.00 -2.55 0.00 0.00 55.97 53.00 2dai s LYS 15 Cb 0.09 0.55 0.00 0.00 -1.05 0.00 0.00 37.83 37.42 2dai s LYS 15 CO -0.09 -0.57 0.00 0.00 1.55 0.00 0.00 175.35 176.24 2dai n ALA 16 N -0.35 3.00 -2.25 3.13 0.00 -1.26 -5.14 120.51 117.64 2dai n ALA 16 Ca -0.13 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.31 2dai n ALA 16 Cb 0.63 0.09 -0.00 0.00 0.00 0.00 0.00 19.45 20.17 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 -3.21 -9.03 0.06 0.00 5.15 -1.26 -5.02 115.26 101.95 2dai n ASN 17 Ca 0.00 1.73 0.00 0.00 -0.60 0.00 0.00 54.58 55.71 2dai n ASN 17 Cb 0.00 -4.91 0.00 0.00 -0.53 0.00 0.00 39.78 34.34 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 1.69 0.00 -2.79 5.20 0.00 -1.26 -5.14 120.51 118.22 2dai n ALA 18 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2dai n ALA 18 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2dai n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dai s MET 19 N -2.00 2.97 -0.56 0.00 0.23 -1.26 -5.07 119.30 113.60 2dai s MET 19 Ca 0.00 -0.61 0.04 0.00 -1.03 0.00 0.00 55.69 54.09 2dai s MET 19 Cb 0.00 -2.78 0.15 0.00 -1.53 0.00 0.00 34.83 30.67 2dai s MET 19 CO 0.00 0.59 0.36 -0.51 -2.03 0.00 0.00 175.02 173.43 2dai s LEU 20 N -2.20 3.84 0.26 0.18 1.02 -1.26 -4.79 118.68 115.73 2dai s LEU 20 Ca 0.28 -3.26 0.00 0.00 0.02 0.00 0.00 54.13 51.16 2dai s LEU 20 Cb -0.12 -1.37 0.00 0.00 0.02 0.00 0.00 46.19 44.71 2dai s LEU 20 CO 0.20 -0.17 0.00 0.47 0.02 0.00 0.00 176.35 176.86 2dai n ASP 21 N 2.73 -1.41 -2.74 2.29 9.92 -1.26 -4.96 116.55 121.12 2dai n ASP 21 Ca 0.14 0.47 -0.27 0.00 -0.53 0.00 0.00 54.79 54.60 2dai n ASP 21 Cb 0.35 1.47 -0.02 0.00 -0.64 0.00 0.00 41.12 42.28 2dai n ASP 21 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 2dai n GLU 22 N -3.17 3.36 -2.21 -1.24 0.28 -1.26 -5.03 120.64 111.37 2dai n GLU 22 Ca 0.00 -4.68 -0.43 0.00 -0.16 0.00 0.00 57.16 51.89 2dai n GLU 22 Cb 0.00 -2.25 -0.02 0.00 1.43 0.00 0.00 31.44 30.60 2dai n GLU 22 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 2dai s ASP 23 N -3.44 6.30 0.35 -1.84 1.47 -1.26 -4.96 116.67 113.30 2dai s ASP 23 Ca 0.48 1.25 -0.29 0.00 1.18 0.00 0.00 52.55 55.18 2dai s ASP 23 Cb 0.34 -2.53 -0.11 0.00 -0.34 0.00 0.00 42.92 40.27 2dai s ASP 23 CO -0.17 -1.38 1.45 -1.61 0.68 0.00 0.00 175.17 174.14 2dai s GLU 24 N 4.89 4.18 -0.66 2.11 2.02 -1.26 -4.80 118.70 125.19 2dai s GLU 24 Ca 0.68 2.46 -0.28 0.00 0.02 0.00 0.00 54.97 57.85 2dai s GLU 24 Cb -0.20 -3.01 -0.12 0.00 0.10 0.00 0.00 34.13 30.90 2dai s GLU 24 CO 0.30 -0.45 2.50 -0.25 0.02 0.00 0.00 175.26 177.39 2dai n ASP 25 N 0.82 1.62 0.00 -0.19 9.92 -1.26 -4.69 116.55 122.77 2dai n ASP 25 Ca 0.02 -0.22 0.00 0.00 -0.53 0.00 0.00 54.79 54.06 2dai n ASP 25 Cb 0.40 -1.34 0.00 0.00 -0.64 0.00 0.00 41.12 39.54 2dai n ASP 25 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2dai n GLU 26 N 8.79 0.00 -1.66 -1.24 1.02 -1.26 -5.02 120.64 121.27 2dai n GLU 26 Ca 0.47 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 57.17 2dai n GLU 26 Cb 0.35 -0.18 -0.01 0.00 -0.02 0.00 0.00 31.44 31.58 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 -2.28 1.84 -1.23 3.49 1.74 -1.26 -4.95 116.66 114.01 2dai n ARG 27 Ca 0.00 0.65 -0.29 0.00 -0.77 0.00 0.00 57.85 57.43 2dai n ARG 27 Cb 0.00 -2.18 0.15 0.00 -1.02 0.00 0.00 32.46 29.41 2dai n ARG 27 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2dai s VAL 28 N -0.86 2.48 0.15 1.55 1.01 -1.26 -5.01 120.40 118.46 2dai s VAL 28 Ca 0.59 0.16 -0.22 0.00 0.00 0.00 0.00 61.98 62.51 2dai s VAL 28 Cb -0.63 -2.67 -0.08 0.00 0.00 0.00 0.00 36.38 33.00 2dai s VAL 28 CO 0.59 -0.20 0.71 -0.62 0.00 0.00 0.00 175.10 175.57 2dai s ASP 29 N -3.50 7.22 -0.08 3.32 -1.08 -1.26 -4.98 116.67 116.31 2dai s ASP 29 Ca 0.64 1.48 -0.08 0.00 -0.52 0.00 0.00 52.55 54.07 2dai s ASP 29 Cb -0.18 -2.44 -0.28 0.00 -1.46 0.00 0.00 42.92 38.56 2dai s ASP 29 CO 0.57 0.18 0.55 1.05 0.52 0.00 0.00 175.17 178.04 2dai h GLU 30 N 4.15 0.31 -0.10 4.34 4.11 -1.98 -3.02 114.58 122.40 2dai h GLU 30 Ca -0.48 -0.54 0.04 0.00 0.07 0.00 0.00 59.36 58.46 2dai h GLU 30 Cb 1.20 0.20 -0.06 0.00 0.50 0.00 0.00 28.75 30.59 2dai h GLU 30 CO 0.65 1.23 -0.33 0.00 0.07 0.00 0.00 179.01 180.63 2dai h ALA 31 N 0.16 -0.42 0.33 1.06 0.00 -1.99 0.58 119.26 118.97 2dai h ALA 31 Ca -0.37 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2dai h ALA 31 Cb 2.06 0.62 0.00 0.00 0.00 0.00 0.00 17.79 20.47 2dai h ALA 31 CO 0.13 -0.82 -0.16 0.00 0.00 0.00 0.00 179.25 178.41 2dai h ALA 32 N 0.34 -0.44 -0.76 0.00 0.00 -1.94 -2.69 119.26 113.76 2dai h ALA 32 Ca 0.08 -0.12 0.16 0.00 0.00 0.00 0.00 54.91 55.03 2dai h ALA 32 Cb 0.56 0.17 -0.14 0.00 0.00 0.00 0.00 17.79 18.38 2dai h ALA 32 CO -0.34 -0.72 -0.17 1.25 0.00 0.00 0.00 179.25 179.27 2dai h LEU 33 N -0.51 -0.68 -0.57 0.00 5.85 -1.29 0.36 115.31 118.47 2dai h LEU 33 Ca -0.05 0.23 0.11 0.00 0.84 0.00 0.00 57.88 59.02 2dai h LEU 33 Cb 0.38 0.46 -0.11 0.00 0.37 0.00 0.00 40.66 41.77 2dai h LEU 33 CO 0.07 -0.25 -0.16 0.03 -0.34 0.00 0.00 178.44 177.80 2dai h ARG 34 N 0.01 -0.02 -0.41 1.25 -0.00 0.46 0.73 114.38 116.39 2dai h ARG 34 Ca 0.37 0.00 0.09 0.00 -0.50 0.00 0.00 59.98 59.94 2dai h ARG 34 Cb 0.58 0.00 -0.08 0.00 0.00 0.00 0.00 29.97 30.47 2dai h ARG 34 CO -0.78 -0.01 -0.14 1.96 0.00 0.00 0.00 179.97 180.99 2dai h GLN 35 N -0.02 -0.05 0.41 0.04 4.20 -0.03 1.41 115.11 121.06 2dai h GLN 35 Ca 0.27 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.97 2dai h GLN 35 Cb 0.44 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2dai h GLN 35 CO -0.60 -0.03 -0.20 -0.07 -0.67 0.00 0.00 178.83 177.26 2dai h LEU 36 N -0.05 -0.46 -1.56 1.46 3.38 -0.38 0.72 115.31 118.41 2dai h LEU 36 Ca 0.20 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.28 2dai h LEU 36 Cb 0.36 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2dai h LEU 36 CO -0.46 -0.27 0.60 0.71 0.09 0.00 0.00 178.44 179.12 2dai h THR 37 N -0.68 0.13 0.04 0.22 1.35 0.58 1.47 112.91 116.02 2dai h THR 37 Ca -0.06 0.00 -0.25 0.00 -0.55 0.00 0.00 66.41 65.55 2dai h THR 37 Cb 0.42 0.46 -0.03 0.00 -1.73 0.00 0.00 68.15 67.28 2dai h THR 37 CO 0.09 0.00 -1.30 -0.33 -0.25 0.00 0.00 175.52 173.73 2dai h GLU 38 N 0.00 0.08 -0.15 4.72 4.39 0.23 -3.34 114.58 120.50 2dai h GLU 38 Ca 0.14 -0.13 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 2dai h GLU 38 Cb 1.35 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 30.04 2dai h GLU 38 CO -0.00 0.92 -0.11 0.52 -1.16 0.00 0.00 179.01 179.18 2dai h MET 39 N 0.02 0.35 0.00 2.33 2.86 0.44 -3.47 114.93 117.46 2dai h MET 39 Ca -0.13 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 2dai h MET 39 Cb 1.90 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.56 2dai h MET 39 CO 0.13 0.70 0.00 0.41 1.06 0.00 0.00 176.91 179.21 2dai n GLY 40 N 0.11 0.01 3.19 8.32 0.00 -0.60 -5.10 105.19 111.11 2dai n GLY 40 Ca -0.06 -0.04 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 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 1.14 -0.11 1.61 0.08 -1.22 -5.03 117.98 114.45 2dai s PHE 41 Ca 0.00 -0.60 -0.30 0.00 0.12 0.00 0.00 56.93 56.15 2dai s PHE 41 Cb 0.00 -0.62 -0.02 0.00 -0.57 0.00 0.00 43.02 41.81 2dai s PHE 41 CO 0.00 0.04 1.25 -1.25 -0.10 0.00 0.00 175.22 175.16 2dai s PRO 42 N -2.61 4.28 0.23 0.24 0.04 -1.26 -4.29 135.00 131.63 2dai s PRO 42 Ca 0.05 1.69 -0.11 0.00 0.04 0.00 0.00 61.00 62.67 2dai s PRO 42 Cb -0.04 -3.68 0.33 0.00 0.04 0.00 0.00 34.50 31.14 2dai s PRO 42 CO 0.01 -0.60 1.63 1.49 0.04 0.00 0.00 177.00 179.56 2dai h GLU 43 N 7.92 0.04 -0.27 4.56 4.81 -1.96 1.17 114.58 130.85 2dai h GLU 43 Ca -0.30 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.95 2dai h GLU 43 Cb 1.13 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.46 2dai h GLU 43 CO 0.93 0.03 -0.22 -2.95 -0.73 0.00 0.00 179.01 176.07 2dai h ASN 44 N 0.04 -0.76 0.34 1.04 -1.07 -1.99 1.35 115.58 114.53 2dai h ASN 44 Ca 0.35 0.11 -0.02 0.00 0.07 0.00 0.00 56.30 56.82 2dai h ASN 44 Cb 0.58 0.33 0.00 0.00 -2.07 0.00 0.00 38.32 37.16 2dai h ASN 44 CO -0.67 -0.12 -0.16 0.03 0.07 0.00 0.00 177.43 176.58 2dai h ARG 45 N -0.07 -0.44 -0.97 4.14 3.08 -1.66 -2.50 114.38 115.96 2dai h ARG 45 Ca 0.04 0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.30 2dai h ARG 45 Cb 0.18 0.10 -0.17 0.00 0.08 0.00 0.00 29.97 30.16 2dai h ARG 45 CO -0.29 -0.18 -0.30 0.00 -1.07 0.00 0.00 179.97 178.13 2dai h ALA 46 N -0.07 0.45 -0.29 0.04 0.00 0.19 0.91 119.26 120.49 2dai h ALA 46 Ca -0.05 0.34 0.05 0.00 0.00 0.00 0.00 54.91 55.25 2dai h ALA 46 Cb 0.46 0.84 -0.05 0.00 0.00 0.00 0.00 17.79 19.05 2dai h ALA 46 CO 0.08 -0.48 0.01 1.15 0.00 0.00 0.00 179.25 180.00 2dai h THR 47 N -0.01 0.79 0.18 0.00 2.02 0.19 0.12 112.91 116.21 2dai h THR 47 Ca 0.42 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.56 2dai h THR 47 Cb 0.67 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.76 2dai h THR 47 CO -0.99 0.02 -0.12 0.50 0.37 0.00 0.00 175.52 175.30 2dai h LYS 48 N 0.09 -0.27 -0.98 6.66 3.64 0.11 -2.30 116.57 123.52 2dai h LYS 48 Ca 0.14 0.02 0.15 0.00 -1.27 0.00 0.00 60.65 59.69 2dai h LYS 48 Cb 0.18 0.06 -0.16 0.00 -0.41 0.00 0.00 32.23 31.91 2dai h LYS 48 CO -0.23 -0.18 -0.38 0.00 -2.27 0.00 0.00 179.45 176.39 2dai n ALA 49 N -2.28 -0.10 -0.06 5.00 0.00 0.11 -0.74 120.51 122.44 2dai n ALA 49 Ca -0.03 0.99 -0.02 0.00 0.00 0.00 0.00 53.44 54.38 2dai n ALA 49 Cb 0.12 -0.45 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 2dai n ALA 49 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2dai h LEU 50 N 0.00 -0.29 -0.36 0.00 3.38 -0.54 1.44 115.31 118.93 2dai h LEU 50 Ca 0.35 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.40 2dai h LEU 50 Cb 0.60 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 2dai h LEU 50 CO -0.98 -0.03 -0.23 1.56 0.09 0.00 0.00 178.44 178.84 2dai h GLN 51 N -0.00 -0.03 -1.04 1.13 4.20 -0.36 1.76 115.11 120.78 2dai h GLN 51 Ca 0.02 0.00 0.27 0.00 0.06 0.00 0.00 58.65 59.01 2dai h GLN 51 Cb 0.06 0.01 -0.11 0.00 0.30 0.00 0.00 27.48 27.73 2dai h GLN 51 CO -0.13 -0.02 0.64 -0.07 -0.67 0.00 0.00 178.83 178.59 2dai h LEU 52 N -0.03 0.54 -3.65 1.46 3.38 -0.58 1.44 115.31 117.88 2dai h LEU 52 Ca 0.06 0.12 -0.46 0.00 0.09 0.00 0.00 57.88 57.69 2dai h LEU 52 Cb 0.18 0.04 -0.22 0.00 0.09 0.00 0.00 40.66 40.74 2dai h LEU 52 CO -0.35 0.05 0.60 0.59 0.09 0.00 0.00 178.44 179.41 2dai n ASN 53 N -4.78 5.71 -4.11 -0.43 3.02 0.48 -4.87 115.26 110.27 2dai n ASN 53 Ca 0.27 -3.35 -0.44 0.00 -0.03 0.00 0.00 54.58 51.03 2dai n ASN 53 Cb 0.87 -0.91 0.01 0.00 -0.61 0.00 0.00 39.78 39.13 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 -0.49 -1.30 -3.99 3.10 8.25 0.49 -0.66 115.22 120.63 2dai n HIS 54 Ca 0.46 0.11 -0.39 0.00 -0.26 0.00 0.00 57.72 57.64 2dai n HIS 54 Cb 0.93 -2.67 0.01 0.00 1.12 0.00 0.00 29.99 29.38 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 -4.92 -0.53 -4.23 -0.41 2.81 0.52 -4.90 117.12 105.46 2dai n MET 55 Ca -0.13 0.17 -0.35 0.00 -1.81 0.00 0.00 57.70 55.58 2dai n MET 55 Cb 0.56 -2.15 -0.09 0.00 -0.71 0.00 0.00 33.22 30.83 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 -3.47 5.45 -0.07 7.83 0.01 0.17 -4.97 113.70 118.65 2dai s SER 56 Ca 0.35 0.16 -0.25 0.00 1.31 0.00 0.00 55.95 57.52 2dai s SER 56 Cb -0.20 -1.69 -0.25 0.00 0.21 0.00 0.00 66.02 64.09 2dai s SER 56 CO 0.89 0.33 0.96 0.58 0.41 0.00 0.00 173.24 176.40 2dai h VAL 57 N 4.35 1.59 0.14 3.43 2.07 -1.89 -2.89 116.25 123.06 2dai h VAL 57 Ca -0.47 -2.12 -0.01 0.00 0.82 0.00 0.00 66.70 64.93 2dai h VAL 57 Cb 1.19 2.96 0.00 0.00 -1.52 0.00 0.00 31.29 33.93 2dai h VAL 57 CO 0.59 0.58 -0.07 1.55 0.02 0.00 0.00 177.57 180.23 2dai h PRO 58 N -0.58 -0.19 -0.86 1.57 0.13 -1.97 -3.26 132.00 126.83 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 1.10 0.04 -0.15 0.00 0.13 0.00 0.00 31.00 32.12 2dai h PRO 58 CO 0.05 -0.13 -0.31 1.96 -0.23 0.00 0.00 178.00 179.35 2dai h GLN 59 N -0.62 -0.03 -0.85 0.86 1.08 -1.92 0.72 115.11 114.34 2dai h GLN 59 Ca -0.02 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.26 2dai h GLN 59 Cb 0.15 0.01 -0.10 0.00 -0.05 0.00 0.00 27.48 27.49 2dai h GLN 59 CO 0.03 -0.02 -0.50 0.00 -0.95 0.00 0.00 178.83 177.39 2dai n ALA 60 N -3.39 -0.54 -0.07 3.87 0.00 -1.09 -1.28 120.51 118.00 2dai n ALA 60 Ca 0.10 0.72 -0.02 0.00 0.00 0.00 0.00 53.44 54.25 2dai n ALA 60 Cb 0.41 -0.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.79 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 -4.93 -0.07 -0.32 0.00 0.00 0.24 0.48 117.12 112.51 2dai n MET 61 Ca 0.02 0.96 0.09 0.00 0.00 0.00 0.00 57.70 58.77 2dai n MET 61 Cb 0.22 -1.43 0.21 0.00 0.00 0.00 0.00 33.22 32.22 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 -0.25 2.12 4.39 -1.13 1.22 114.58 120.96 2dai h GLU 62 Ca 0.03 -0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.76 2dai h GLU 62 Cb 0.07 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.68 2dai h GLU 62 CO -0.15 0.02 0.04 2.35 -1.16 0.00 0.00 179.01 180.11 2dai h TRP 63 N 0.03 0.06 0.00 4.33 7.01 0.12 1.57 115.95 129.08 2dai h TRP 63 Ca 0.51 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.52 2dai h TRP 63 Cb 0.95 0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 28.02 2dai h TRP 63 CO -0.55 0.01 -0.01 -0.07 -2.79 0.00 0.00 178.44 175.03 2dai h LEU 64 N 0.13 0.00 0.12 0.65 3.38 0.57 1.32 115.31 121.48 2dai h LEU 64 Ca 0.11 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.75 2dai h LEU 64 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2dai h LEU 64 CO -0.16 0.01 -1.75 0.40 0.09 0.00 0.00 178.44 177.03 2dai h ILE 65 N 0.00 0.90 0.00 1.22 2.04 0.42 -2.64 117.51 119.45 2dai h ILE 65 Ca -0.00 -2.58 0.00 0.00 1.00 0.00 0.00 64.86 63.28 2dai h ILE 65 Cb 0.17 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 2dai h ILE 65 CO 0.00 0.80 -0.03 -0.08 0.00 0.00 0.00 178.15 178.84 2dai h GLU 66 N 0.07 0.00 0.00 2.37 4.57 0.32 -3.31 114.58 118.61 2dai h GLU 66 Ca -0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 2dai h GLU 66 Cb 2.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.63 2dai h GLU 66 CO 0.13 0.00 0.00 0.72 -1.18 0.00 0.00 179.01 178.68 2dai n HIS 67 N -4.40 0.09 -0.35 0.92 8.25 0.44 -3.14 115.22 117.04 2dai n HIS 67 Ca -0.00 0.04 0.10 0.00 -0.26 0.00 0.00 57.72 57.60 2dai n HIS 67 Cb 0.02 -0.56 0.22 0.00 1.12 0.00 0.00 29.99 30.78 2dai n HIS 67 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dai n ALA 68 N -1.53 0.37 -2.81 -1.41 0.00 -1.00 -0.17 120.51 113.96 2dai n ALA 68 Ca 0.02 1.08 -0.34 0.00 0.00 0.00 0.00 53.44 54.20 2dai n ALA 68 Cb 0.12 -0.72 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 2dai n ALA 68 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dai n GLU 69 N -5.56 4.35 -4.34 0.00 1.02 -1.19 -5.01 120.64 109.91 2dai n GLU 69 Ca 0.20 -4.76 -0.18 0.00 -0.02 0.00 0.00 57.16 52.40 2dai n GLU 69 Cb 0.63 -2.36 -0.10 0.00 -0.02 0.00 0.00 31.44 29.59 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 -2.36 2.45 -0.07 1.62 2.15 0.76 -5.08 116.67 116.13 2dai s ASP 70 Ca 0.43 -1.06 -0.21 0.00 0.43 0.00 0.00 52.55 52.15 2dai s ASP 70 Cb 0.23 -0.11 -0.17 0.00 -0.30 0.00 0.00 42.92 42.57 2dai s ASP 70 CO -0.12 -0.24 0.79 1.55 -0.17 0.00 0.00 175.17 176.97 2dai h PRO 71 N 2.54 -0.12 -0.74 4.34 0.13 -1.89 -3.32 132.00 132.94 2dai h PRO 71 Ca -0.38 0.01 0.10 0.00 -0.87 0.00 0.00 66.00 64.86 2dai h PRO 71 Cb 1.22 0.03 -0.12 0.00 0.13 0.00 0.00 31.00 32.26 2dai h PRO 71 CO 0.63 0.39 -0.45 1.79 -0.23 0.00 0.00 178.00 180.13 2dai h THR 72 N -0.87 0.05 -1.52 1.56 1.35 -1.98 1.38 112.91 112.89 2dai h THR 72 Ca -0.01 0.00 0.47 0.00 -0.55 0.00 0.00 66.41 66.31 2dai h THR 72 Cb 0.57 0.05 -0.10 0.00 -1.73 0.00 0.00 68.15 66.94 2dai h THR 72 CO 0.02 0.00 1.04 -0.29 -0.25 0.00 0.00 175.52 176.04 2dai h ILE 73 N -0.14 0.13 -3.69 6.82 2.10 -1.84 -3.28 117.51 117.60 2dai h ILE 73 Ca 0.21 -0.02 -0.67 0.00 1.08 0.00 0.00 64.86 65.47 2dai h ILE 73 Cb 0.55 0.07 -0.18 0.00 -1.09 0.00 0.00 36.82 36.17 2dai h ILE 73 CO -0.80 0.01 -0.37 -0.62 -1.08 0.00 0.00 178.15 175.29 2dai s ASP 74 N -4.39 6.13 0.05 2.19 2.15 0.47 -4.95 116.67 118.32 2dai s ASP 74 Ca -0.06 -0.29 0.05 0.00 0.43 0.00 0.00 52.55 52.67 2dai s ASP 74 Cb 0.28 -2.17 -0.04 0.00 -0.30 0.00 0.00 42.92 40.69 2dai s ASP 74 CO 0.84 -0.29 -0.08 -0.89 -0.17 0.00 0.00 175.17 174.59 2dai s THR 75 N 1.89 3.52 0.61 1.71 2.01 -1.24 -4.87 115.64 119.27 2dai s THR 75 Ca 0.09 -1.02 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 2dai s THR 75 Cb -0.17 -2.59 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 2dai s THR 75 CO 0.11 0.25 1.05 -2.16 -0.69 0.00 0.00 174.62 173.18 2dai s PRO 76 N -1.82 3.28 0.30 4.92 0.04 -1.26 -4.80 135.00 135.66 2dai s PRO 76 Ca 0.20 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.36 2dai s PRO 76 Cb -0.11 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2dai s PRO 76 CO 0.11 -0.84 0.00 1.28 0.04 0.00 0.00 177.00 177.59 2dai n LEU 77 N -2.27 -5.02 0.03 -3.56 4.77 -1.26 -5.03 117.00 104.65 2dai n LEU 77 Ca 0.08 2.47 0.00 0.00 -0.03 0.00 0.00 56.01 58.53 2dai n LEU 77 Cb 0.53 -2.15 0.00 0.00 -2.33 0.00 0.00 43.42 39.47 2dai n LEU 77 CO 0.49 -0.40 -0.25 -0.24 -1.33 0.00 0.00 177.39 175.67 2dai n SER 78 N 0.14 0.53 0.00 -1.43 2.88 -1.26 -5.15 113.62 109.33 2dai n SER 78 Ca 0.00 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 2dai n SER 78 Cb 0.00 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 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 3.20 0.30 3.78 0.46 0.00 -1.26 -5.00 105.19 106.67 2dai n GLY 79 Ca 0.00 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.93 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 0.00 0.47 -0.24 1.61 0.04 -1.26 -5.09 135.00 130.53 2dai s PRO 80 Ca 0.00 0.03 -0.29 0.00 0.04 0.00 0.00 61.00 60.79 2dai s PRO 80 Cb 0.00 -1.78 0.16 0.00 0.04 0.00 0.00 34.50 32.92 2dai s PRO 80 CO 0.00 -2.60 1.21 0.45 0.04 0.00 0.00 177.00 176.10 2dai s SER 81 N -4.21 -0.19 -0.26 6.66 0.15 -1.26 -5.17 113.70 109.41 2dai s SER 81 Ca 0.68 0.24 -0.18 0.00 0.70 0.00 0.00 55.95 57.39 2dai s SER 81 Cb -0.11 0.20 0.07 0.00 -1.71 0.00 0.00 66.02 64.47 2dai s SER 81 CO 0.54 -0.15 0.66 -0.55 1.20 0.00 0.00 173.24 174.94 2dai s SER 82 N -0.85 -0.83 0.00 5.45 0.15 -1.26 -5.33 113.70 111.03 2dai s SER 82 Ca 0.04 1.42 0.00 0.00 0.70 0.00 0.00 55.95 58.11 2dai s SER 82 Cb -0.01 1.34 0.00 0.00 -1.71 0.00 0.00 66.02 65.63 2dai s SER 82 CO -0.05 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.76