#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dir n SER 2 N 0.00 -2.22 -3.92 1.61 3.41 -1.26 -4.92 113.62 106.32 2dir n SER 2 Ca 0.00 -1.13 -0.14 0.00 -0.26 0.00 0.00 58.87 57.34 2dir n SER 2 Cb 0.00 -2.22 -0.14 0.00 -0.26 0.00 0.00 64.21 61.59 2dir n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dir s SER 3 N -3.42 0.35 0.00 4.04 0.01 -1.26 -5.08 113.70 108.34 2dir s SER 3 Ca 0.68 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.89 2dir s SER 3 Cb -0.39 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 65.80 2dir s SER 3 CO 0.97 0.03 0.00 0.61 0.41 0.00 0.00 173.24 175.26 2dir n GLY 4 N 3.05 -3.13 1.66 3.44 0.00 -1.26 -5.07 105.19 103.87 2dir n GLY 4 Ca -0.13 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.89 2dir n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dir n SER 5 N -0.53 0.12 -4.27 1.61 3.41 -1.26 -5.06 113.62 107.64 2dir n SER 5 Ca 0.00 0.17 -0.35 0.00 -0.26 0.00 0.00 58.87 58.43 2dir n SER 5 Cb 0.00 0.07 -0.14 0.00 -0.26 0.00 0.00 64.21 63.88 2dir n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dir s SER 6 N -5.16 4.06 0.22 4.04 0.01 -1.26 -5.08 113.70 110.54 2dir s SER 6 Ca 0.00 -0.46 -0.32 0.00 1.31 0.00 0.00 55.95 56.48 2dir s SER 6 Cb 0.00 -1.68 -0.13 0.00 0.21 0.00 0.00 66.02 64.41 2dir s SER 6 CO 0.00 -0.02 1.45 0.61 0.41 0.00 0.00 173.24 175.68 2dir n GLY 7 N 4.76 0.86 2.85 3.44 0.00 -1.26 -4.99 105.19 110.85 2dir n GLY 7 Ca -0.19 0.53 -0.14 0.00 0.00 0.00 0.00 46.02 46.22 2dir n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dir s LYS 8 N -0.14 0.23 0.23 1.61 2.47 -1.26 -5.03 119.74 117.85 2dir s LYS 8 Ca 0.70 0.41 -0.04 0.00 -1.56 0.00 0.00 55.97 55.48 2dir s LYS 8 Cb -0.65 -0.77 0.42 0.00 -1.46 0.00 0.00 37.83 35.37 2dir s LYS 8 CO 0.47 -0.59 1.24 0.00 0.16 0.00 0.00 175.35 176.64 2dir n ALA 9 N 5.34 0.24 -0.33 3.13 0.00 -1.26 0.60 120.51 128.23 2dir n ALA 9 Ca -0.05 0.87 0.06 0.00 0.00 0.00 0.00 53.44 54.32 2dir n ALA 9 Cb 0.50 -0.55 0.13 0.00 0.00 0.00 0.00 19.45 19.53 2dir n ALA 9 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dir n PHE 10 N -5.26 0.34 -0.06 0.00 -0.00 -1.26 0.22 117.46 111.45 2dir n PHE 10 Ca 0.14 1.13 -0.05 0.00 -0.00 0.00 0.00 57.45 58.67 2dir n PHE 10 Cb 0.45 -1.04 -0.03 0.00 -0.00 0.00 0.00 39.48 38.85 2dir n PHE 10 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2dir h LEU 11 N 0.00 0.00 -0.41 -2.13 3.38 -0.27 -3.21 115.31 112.67 2dir h LEU 11 Ca 0.45 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.26 2dir h LEU 11 Cb 0.69 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2dir h LEU 11 CO -0.95 0.72 -0.31 -0.33 0.09 0.00 0.00 178.44 177.66 2dir h GLU 12 N -1.00 -0.08 -0.73 1.13 4.39 -0.63 0.21 114.58 117.88 2dir h GLU 12 Ca -0.03 0.01 0.16 0.00 0.34 0.00 0.00 59.36 59.84 2dir h GLU 12 Cb 0.38 0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 28.94 2dir h GLU 12 CO -0.02 -0.05 0.12 -0.44 -1.16 0.00 0.00 179.01 177.46 2dir h ASP 13 N -0.08 -0.10 -0.19 1.42 5.19 -0.43 -0.66 116.42 121.56 2dir h ASP 13 Ca 0.07 0.16 0.04 0.00 -0.62 0.00 0.00 57.03 56.68 2dir h ASP 13 Cb 0.26 0.24 -0.04 0.00 0.18 0.00 0.00 39.33 39.97 2dir h ASP 13 CO -0.43 -0.08 -0.06 -0.03 -3.12 0.00 0.00 179.24 175.52 2dir h MET 14 N 0.21 -0.02 -0.59 3.56 1.85 -0.87 -1.73 114.93 117.33 2dir h MET 14 Ca 0.41 0.00 0.12 0.00 -0.61 0.00 0.00 59.70 59.62 2dir h MET 14 Cb 0.70 0.00 -0.11 0.00 0.43 0.00 0.00 31.60 32.62 2dir h MET 14 CO -0.55 -0.01 -0.16 0.87 -0.40 0.00 0.00 176.91 176.66 2dir h LYS 15 N -0.02 -0.01 0.93 0.39 1.57 0.87 0.55 116.57 120.86 2dir h LYS 15 Ca 0.10 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2dir h LYS 15 Cb 0.17 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.49 2dir h LYS 15 CO -0.21 -0.01 -0.49 0.87 -0.57 0.00 0.00 179.45 179.05 2dir h LYS 16 N -0.01 -1.25 0.09 3.15 1.57 -1.08 -1.42 116.57 117.62 2dir h LYS 16 Ca 0.28 0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2dir h LYS 16 Cb 0.44 0.28 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 2dir h LYS 16 CO -0.61 -0.84 -0.08 -0.92 -0.57 0.00 0.00 179.45 176.44 2dir h TYR 17 N -1.30 -0.21 -1.24 -1.35 3.20 -0.80 0.78 116.97 116.04 2dir h TYR 17 Ca -0.13 0.00 0.45 0.00 3.14 0.00 0.00 58.73 62.19 2dir h TYR 17 Cb 1.01 0.08 -0.15 0.00 1.54 0.00 0.00 36.73 39.21 2dir h TYR 17 CO -0.03 -0.11 0.77 0.00 -1.64 0.00 0.00 178.16 177.15 2dir n ALA 18 N -2.29 1.24 -0.11 1.82 0.00 0.19 0.88 120.51 122.24 2dir n ALA 18 Ca -0.02 0.89 0.00 0.00 0.00 0.00 0.00 53.44 54.31 2dir n ALA 18 Cb 0.07 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.50 2dir n ALA 18 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2dir n GLU 19 N -4.81 0.00 0.22 0.00 2.13 -0.53 -0.04 120.64 117.61 2dir n GLU 19 Ca 0.39 0.44 0.10 0.00 0.66 0.00 0.00 57.16 58.75 2dir n GLU 19 Cb 1.46 -1.13 0.51 0.00 0.27 0.00 0.00 31.44 32.54 2dir n GLU 19 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2dir h THR 20 N 0.00 0.00 0.07 6.31 1.03 0.10 0.76 112.91 121.18 2dir h THR 20 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 66.41 66.04 2dir h THR 20 Cb 0.00 0.42 -0.04 0.00 -1.07 0.00 0.00 68.15 67.46 2dir h THR 20 CO 0.00 0.00 -2.11 0.33 -0.01 0.00 0.00 175.52 173.73 2dir n PHE 21 N -2.32 0.84 1.00 0.00 7.35 0.25 -4.16 117.46 120.42 2dir n PHE 21 Ca -0.01 0.19 0.11 0.00 -0.76 0.00 0.00 57.45 56.98 2dir n PHE 21 Cb 0.32 -1.12 0.33 0.00 0.35 0.00 0.00 39.48 39.36 2dir n PHE 21 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2dir n LEU 22 N -3.34 2.19 0.12 -2.13 4.77 0.94 -4.39 117.00 115.16 2dir n LEU 22 Ca -0.34 -0.90 -0.14 0.00 -0.03 0.00 0.00 56.01 54.60 2dir n LEU 22 Cb 1.04 -0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 41.93 2dir n LEU 22 CO 0.39 0.45 0.61 -0.33 -1.33 0.00 0.00 177.39 177.18 2dir h GLU 23 N 2.94 -0.60 0.00 3.23 5.08 0.22 1.19 114.58 126.64 2dir h GLU 23 Ca 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2dir h GLU 23 Cb 0.64 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2dir h GLU 23 CO 0.00 -0.40 0.00 -0.35 -1.00 0.00 0.00 179.01 177.26 2dir n PRO 24 N -5.45 0.15 -0.04 2.33 -0.04 -1.26 0.33 135.00 131.02 2dir n PRO 24 Ca -0.07 0.18 0.01 0.00 -0.04 0.00 0.00 63.50 63.58 2dir n PRO 24 Cb 0.36 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.20 2dir n PRO 24 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2dir n TRP 25 N -1.35 0.00 0.00 0.54 8.01 -0.21 -4.59 117.44 119.84 2dir n TRP 25 Ca 0.06 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.25 2dir n TRP 25 Cb 0.13 -0.55 0.00 0.00 -2.01 0.00 0.00 31.31 28.88 2dir n TRP 25 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.69 177.87 2dir n PHE 26 N -2.30 0.00 -2.56 -5.99 3.72 0.39 -4.34 117.46 106.38 2dir n PHE 26 Ca -0.13 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.86 2dir n PHE 26 Cb 0.69 0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 39.22 2dir n PHE 26 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2dir s LYS 27 N -1.71 4.61 0.87 -1.08 2.20 1.01 -3.90 119.74 121.74 2dir s LYS 27 Ca 0.00 1.65 -0.17 0.00 -0.36 0.00 0.00 55.97 57.10 2dir s LYS 27 Cb 0.00 -3.31 -0.13 0.00 -1.51 0.00 0.00 37.83 32.89 2dir s LYS 27 CO 0.00 0.09 -0.47 0.00 -0.36 0.00 0.00 175.35 174.61 2dir n ALA 28 N 2.59 -4.48 0.90 3.13 0.00 -1.26 -2.20 120.51 119.19 2dir n ALA 28 Ca 0.03 -0.52 0.08 0.00 0.00 0.00 0.00 53.44 53.03 2dir n ALA 28 Cb 0.47 -1.30 0.44 0.00 0.00 0.00 0.00 19.45 19.06 2dir n ALA 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2dir n PRO 29 N 1.70 0.41 -2.75 0.00 -0.04 -1.26 -4.82 135.00 128.24 2dir n PRO 29 Ca 0.02 0.04 -0.33 0.00 -0.04 0.00 0.00 63.50 63.19 2dir n PRO 29 Cb 0.53 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 2dir n PRO 29 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2dir s ASN 30 N -2.17 6.81 -0.02 3.54 0.01 -0.93 -5.06 114.94 117.12 2dir s ASN 30 Ca 0.21 1.58 -0.31 0.00 -0.71 0.00 0.00 52.86 53.63 2dir s ASN 30 Cb 0.11 -2.50 0.12 0.00 0.41 0.00 0.00 41.25 39.38 2dir s ASN 30 CO 0.19 -0.40 1.25 -1.59 -1.51 0.00 0.00 177.10 175.04 2dir s LYS 31 N -3.43 0.46 0.00 -0.60 -2.85 -1.25 -3.82 119.74 108.25 2dir s LYS 31 Ca 0.60 -0.24 0.00 0.00 -1.00 0.00 0.00 55.97 55.32 2dir s LYS 31 Cb -0.09 0.16 0.00 0.00 -2.06 0.00 0.00 37.83 35.84 2dir s LYS 31 CO 0.19 -0.21 0.00 0.41 0.10 0.00 0.00 175.35 175.84 2dir n GLY 32 N -0.43 0.62 3.92 0.59 0.00 -1.26 -4.99 105.19 103.65 2dir n GLY 32 Ca -0.07 -1.65 -0.19 0.00 0.00 0.00 0.00 46.02 44.10 2dir n GLY 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dir s THR 33 N -3.24 2.79 0.21 2.61 -4.23 -1.26 -1.39 115.64 111.13 2dir s THR 33 Ca 0.00 -1.22 -0.23 0.00 -1.18 0.00 0.00 61.69 59.06 2dir s THR 33 Cb 0.00 -3.00 0.06 0.00 1.34 0.00 0.00 72.50 70.90 2dir s THR 33 CO 0.00 -0.00 0.93 0.72 -0.54 0.00 0.00 174.62 175.73 2dir s PHE 34 N -2.43 -0.05 -0.07 3.99 -0.71 -1.23 -2.36 117.98 115.11 2dir s PHE 34 Ca 0.51 -0.34 -0.03 0.00 -1.04 0.00 0.00 56.93 56.02 2dir s PHE 34 Cb -0.06 0.69 0.04 0.00 -1.21 0.00 0.00 43.02 42.48 2dir s PHE 34 CO 0.30 -1.00 0.07 1.14 -1.34 0.00 0.00 175.22 174.39 2dir s GLN 35 N -2.96 -0.04 -0.01 1.99 -2.07 -0.61 0.49 119.66 116.45 2dir s GLN 35 Ca 0.15 0.28 -0.18 0.00 -1.82 0.00 0.00 55.36 53.79 2dir s GLN 35 Cb -0.03 -0.80 -0.06 0.00 -1.09 0.00 0.00 33.01 31.04 2dir s GLN 35 CO 0.05 -0.41 0.50 0.42 -1.32 0.00 0.00 175.29 174.54 2dir s ILE 36 N 2.17 4.97 -0.04 3.63 1.01 -1.26 -1.34 121.20 130.34 2dir s ILE 36 Ca 0.04 1.05 0.01 0.00 0.00 0.00 0.00 60.65 61.75 2dir s ILE 36 Cb -0.13 -3.83 0.02 0.00 0.01 0.00 0.00 42.46 38.54 2dir s ILE 36 CO -0.04 0.48 -0.02 -0.69 0.00 0.00 0.00 174.94 174.67 2dir s VAL 37 N -0.49 0.33 -0.52 2.92 1.01 -1.05 -5.00 120.40 117.59 2dir s VAL 37 Ca 0.27 0.00 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 2dir s VAL 37 Cb -0.17 -0.40 0.06 0.00 0.00 0.00 0.00 36.38 35.87 2dir s VAL 37 CO 0.15 0.18 0.66 -0.47 0.00 0.00 0.00 175.10 175.62 2dir s TYR 38 N 1.00 3.02 -0.36 5.22 5.04 -1.26 -1.48 117.35 128.52 2dir s TYR 38 Ca -0.10 -0.55 -0.11 0.00 -2.44 0.00 0.00 57.07 53.88 2dir s TYR 38 Cb -0.14 -3.65 0.02 0.00 0.35 0.00 0.00 41.96 38.54 2dir s TYR 38 CO -0.01 -1.10 0.19 0.15 -1.34 0.00 0.00 175.55 173.45 2dir s LYS 39 N 2.76 2.96 0.24 4.97 1.02 -0.86 -5.00 119.74 125.84 2dir s LYS 39 Ca 0.16 -0.98 0.08 0.00 0.02 0.00 0.00 55.97 55.25 2dir s LYS 39 Cb -0.19 -3.69 -0.05 0.00 -0.52 0.00 0.00 37.83 33.38 2dir s LYS 39 CO 0.12 -0.63 -0.13 -1.54 -0.92 0.00 0.00 175.35 172.25 2dir s SER 40 N 1.57 2.87 0.15 2.83 1.04 -1.26 -2.60 113.70 118.30 2dir s SER 40 Ca 0.03 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.39 2dir s SER 40 Cb -0.19 -0.19 0.00 0.00 0.10 0.00 0.00 66.02 65.75 2dir s SER 40 CO 0.07 -0.17 0.00 -1.14 0.98 0.00 0.00 173.24 172.98 2dir n ARG 41 N -0.49 0.00 -2.79 4.02 0.00 -1.26 -5.00 116.66 111.13 2dir n ARG 41 Ca -0.07 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.38 2dir n ARG 41 Cb 0.61 -0.31 -0.05 0.00 0.00 0.00 0.00 32.46 32.71 2dir n ARG 41 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2dir s ASN 42 N -5.54 7.53 -0.74 6.15 -0.87 -1.26 -4.89 114.94 115.32 2dir s ASN 42 Ca 0.00 1.82 -0.33 0.00 -1.57 0.00 0.00 52.86 52.78 2dir s ASN 42 Cb 0.00 -2.58 -0.19 0.00 -0.02 0.00 0.00 41.25 38.46 2dir s ASN 42 CO 0.00 0.07 2.28 -3.20 -2.57 0.00 0.00 177.10 173.68 2dir n ASN 43 N 2.08 0.43 -4.62 -1.22 5.15 -1.26 -4.85 115.26 110.96 2dir n ASN 43 Ca -0.01 0.34 -0.39 0.00 -0.60 0.00 0.00 54.58 53.92 2dir n ASN 43 Cb 0.48 -0.84 -0.09 0.00 -0.53 0.00 0.00 39.78 38.81 2dir n ASN 43 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2dir s SER 44 N 7.22 6.27 -0.02 1.20 0.15 -1.26 -4.98 113.70 122.28 2dir s SER 44 Ca 1.19 0.31 -0.24 0.00 0.70 0.00 0.00 55.95 57.91 2dir s SER 44 Cb -1.24 -2.21 -0.18 0.00 -1.71 0.00 0.00 66.02 60.69 2dir s SER 44 CO 0.51 -0.15 1.17 1.12 1.20 0.00 0.00 173.24 177.09 2dir h HIS 45 N 8.00 -0.17 -2.81 3.44 2.07 -2.06 -3.44 115.15 120.18 2dir h HIS 45 Ca -0.33 -0.00 -0.58 0.00 -2.85 0.00 0.00 60.37 56.60 2dir h HIS 45 Cb 1.16 0.06 0.09 0.00 2.57 0.00 0.00 27.41 31.29 2dir h HIS 45 CO 0.74 0.24 0.51 1.55 -3.07 0.00 0.00 177.93 177.90 2dir n VAL 46 N -4.97 1.37 -2.34 6.12 3.14 -1.26 -4.91 118.33 115.48 2dir n VAL 46 Ca -0.09 -0.34 -0.41 0.00 -2.96 0.00 0.00 64.34 60.54 2dir n VAL 46 Cb 0.25 -1.42 -0.03 0.00 -1.06 0.00 0.00 33.84 31.58 2dir n VAL 46 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2dir s ASN 47 N 0.01 7.04 0.41 6.55 0.01 -1.26 -4.92 114.94 122.76 2dir s ASN 47 Ca 0.64 2.24 0.19 0.00 -0.71 0.00 0.00 52.86 55.22 2dir s ASN 47 Cb -0.64 -2.60 0.86 0.00 0.41 0.00 0.00 41.25 39.27 2dir s ASN 47 CO 0.55 -0.43 1.83 0.08 -1.51 0.00 0.00 177.10 177.61 2dir h ARG 48 N 5.58 0.00 -0.25 -0.60 -0.00 -1.94 -3.14 114.38 114.03 2dir h ARG 48 Ca -0.44 0.00 0.05 0.00 -0.00 0.00 0.00 59.98 59.59 2dir h ARG 48 Cb 1.21 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 31.13 2dir h ARG 48 CO 0.77 0.32 -0.08 1.05 -0.00 0.00 0.00 179.97 182.03 2dir h GLU 49 N 0.00 -0.02 -0.79 0.08 4.11 -1.98 0.20 114.58 116.17 2dir h GLU 49 Ca -0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.36 59.50 2dir h GLU 49 Cb 0.72 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.91 2dir h GLU 49 CO 0.04 -0.02 0.47 0.93 0.07 0.00 0.00 179.01 180.50 2dir h GLU 50 N -0.03 0.81 0.44 1.06 4.39 -1.96 0.45 114.58 119.76 2dir h GLU 50 Ca 0.12 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.75 2dir h GLU 50 Cb 0.21 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2dir h GLU 50 CO -0.27 0.54 -0.21 0.28 -1.16 0.00 0.00 179.01 178.18 2dir h VAL 51 N 0.84 0.00 0.00 3.13 2.07 -1.43 -2.40 116.25 118.47 2dir h VAL 51 Ca 0.36 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2dir h VAL 51 Cb 0.22 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 2dir h VAL 51 CO -0.19 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 177.02 2dir n ILE 52 N -4.28 0.00 -0.31 4.57 5.41 0.62 -0.17 119.36 125.19 2dir n ILE 52 Ca -0.07 1.44 0.24 0.00 1.00 0.00 0.00 62.75 65.36 2dir n ILE 52 Cb 0.24 -2.25 0.46 0.00 -0.71 0.00 0.00 39.64 37.37 2dir n ILE 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2dir n ARG 53 N -2.17 -0.06 0.17 0.38 5.12 0.14 -1.08 116.66 119.16 2dir n ARG 53 Ca 0.00 1.35 -0.07 0.00 -1.93 0.00 0.00 57.85 57.20 2dir n ARG 53 Cb 0.00 -2.32 -0.03 0.00 -1.16 0.00 0.00 32.46 28.95 2dir n ARG 53 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 2dir h GLU 54 N 0.00 -0.43 -0.78 5.56 4.57 -0.88 -2.04 114.58 120.58 2dir h GLU 54 Ca 0.72 0.03 0.28 0.00 -1.18 0.00 0.00 59.36 59.21 2dir h GLU 54 Cb 1.78 0.10 -0.14 0.00 -0.16 0.00 0.00 28.75 30.33 2dir h GLU 54 CO -0.79 -0.29 0.24 1.28 -1.18 0.00 0.00 179.01 178.27 2dir n LEU 55 N -3.56 0.11 -0.07 1.64 4.77 0.76 0.19 117.00 120.83 2dir n LEU 55 Ca -0.06 1.31 -0.12 0.00 -0.03 0.00 0.00 56.01 57.11 2dir n LEU 55 Cb 0.18 -0.56 -0.06 0.00 -2.33 0.00 0.00 43.42 40.64 2dir n LEU 55 CO 0.13 -1.40 0.66 0.00 -1.33 0.00 0.00 177.39 175.45 2dir h ALA 56 N 1.56 0.27 -0.21 -1.18 0.00 -1.33 -2.76 119.26 115.61 2dir h ALA 56 Ca 0.58 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 55.26 2dir h ALA 56 Cb 1.40 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2dir h ALA 56 CO -0.66 0.10 0.29 0.78 0.00 0.00 0.00 179.25 179.76 2dir h GLY 57 N 0.09 0.00 0.02 0.00 0.00 0.28 -2.11 103.07 101.35 2dir h GLY 57 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 2dir h GLY 57 CO 0.03 0.00 -0.24 -2.22 0.00 0.00 0.00 176.54 174.11 2dir h ILE 58 N 0.00 1.64 -1.32 2.60 2.04 -1.15 -3.32 117.51 118.00 2dir h ILE 58 Ca 0.10 -2.32 0.46 0.00 1.00 0.00 0.00 64.86 64.10 2dir h ILE 58 Cb 0.67 3.19 -0.14 0.00 -0.74 0.00 0.00 36.82 39.80 2dir h ILE 58 CO -0.00 0.56 0.84 0.52 0.00 0.00 0.00 178.15 180.07 2dir n VAL 59 N -4.57 -0.27 0.19 1.67 0.31 -0.80 0.12 118.33 114.99 2dir n VAL 59 Ca -0.14 1.80 -0.13 0.00 -0.01 0.00 0.00 64.34 65.86 2dir n VAL 59 Cb 0.52 -2.95 -0.07 0.00 -0.91 0.00 0.00 33.84 30.43 2dir n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dir n THR 61 N -5.17 0.00 0.02 0.00 5.66 0.12 -0.91 114.28 114.00 2dir n THR 61 Ca -0.10 1.32 -0.01 0.00 -3.05 0.00 0.00 64.05 62.21 2dir n THR 61 Cb 0.28 -2.27 -0.00 0.00 -1.55 0.00 0.00 70.33 66.78 2dir n THR 61 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 2dir h LEU 62 N 0.00 -0.06 -7.65 1.09 3.38 -1.39 -3.46 115.31 107.23 2dir h LEU 62 Ca 0.69 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 58.20 2dir h LEU 62 Cb 3.24 0.01 -0.36 0.00 0.09 0.00 0.00 40.66 43.64 2dir h LEU 62 CO -0.01 0.03 -0.78 0.21 0.09 0.00 0.00 178.44 177.98 2dir s ASN 63 N -3.18 1.67 0.48 -0.43 3.84 -0.09 -4.60 114.94 112.64 2dir s ASN 63 Ca -0.01 -0.18 0.21 0.00 0.21 0.00 0.00 52.86 53.09 2dir s ASN 63 Cb 0.00 -0.61 1.24 0.00 -0.55 0.00 0.00 41.25 41.33 2dir s ASN 63 CO 0.03 -0.12 1.96 0.28 -2.79 0.00 0.00 177.10 176.46 2dir h SER 64 N 7.93 0.18 0.22 -4.21 0.02 -1.89 0.27 113.55 116.07 2dir h SER 64 Ca -0.28 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 2dir h SER 64 Cb 1.14 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.65 2dir h SER 64 CO 0.37 0.09 -0.07 -0.33 -1.14 0.00 0.00 176.83 175.76 2dir h GLU 65 N 0.19 0.00 -6.58 3.45 4.39 -1.94 -3.42 114.58 110.67 2dir h GLU 65 Ca 0.31 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.48 2dir h GLU 65 Cb 0.95 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.63 2dir h GLU 65 CO -0.05 0.07 0.88 -0.80 -1.16 0.00 0.00 179.01 177.94 2dir s ASN 66 N -6.10 6.62 -0.24 1.42 0.01 0.94 -4.33 114.94 113.26 2dir s ASN 66 Ca -0.04 2.56 -0.02 0.00 -0.71 0.00 0.00 52.86 54.65 2dir s ASN 66 Cb 0.14 -2.59 0.12 0.00 0.41 0.00 0.00 41.25 39.33 2dir s ASN 66 CO 0.56 -0.81 0.30 -0.54 -1.51 0.00 0.00 177.10 175.10 2dir s LYS 67 N 1.35 0.29 -0.07 -0.60 1.02 -0.48 -4.75 119.74 116.49 2dir s LYS 67 Ca 0.70 0.24 -0.29 0.00 0.02 0.00 0.00 55.97 56.63 2dir s LYS 67 Cb -0.42 -0.79 -0.07 0.00 -0.52 0.00 0.00 37.83 36.02 2dir s LYS 67 CO 0.31 -0.75 1.95 0.54 -0.92 0.00 0.00 175.35 176.48 2dir s VAL 68 N 2.42 3.17 0.11 3.17 0.11 -1.26 -3.56 120.40 124.55 2dir s VAL 68 Ca 0.10 0.19 0.10 0.00 -2.93 0.00 0.00 61.98 59.44 2dir s VAL 68 Cb -0.15 -3.15 -0.04 0.00 -1.53 0.00 0.00 36.38 31.51 2dir s VAL 68 CO -0.19 -0.05 -0.25 -0.62 -3.33 0.00 0.00 175.10 170.66 2dir s ASP 69 N 5.19 3.37 0.00 3.54 2.15 0.18 -4.80 116.67 126.30 2dir s ASP 69 Ca 0.87 -0.68 0.13 0.00 0.43 0.00 0.00 52.55 53.30 2dir s ASP 69 Cb -0.37 -0.29 0.21 0.00 -0.30 0.00 0.00 42.92 42.17 2dir s ASP 69 CO 0.37 0.20 1.07 0.18 -0.17 0.00 0.00 175.17 176.82 2dir n LEU 70 N 1.12 2.49 -0.05 -1.34 4.77 -1.26 -3.92 117.00 118.80 2dir n LEU 70 Ca -0.17 -1.41 -0.10 0.00 -0.03 0.00 0.00 56.01 54.29 2dir n LEU 70 Cb 0.53 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 2dir n LEU 70 CO 0.24 0.54 -0.66 0.41 -1.33 0.00 0.00 177.39 176.59 2dir n THR 71 N 0.70 1.19 -2.68 -5.08 -1.04 -1.26 -4.80 114.28 101.30 2dir n THR 71 Ca 0.10 0.06 -0.27 0.00 -2.04 0.00 0.00 64.05 61.90 2dir n THR 71 Cb 0.38 -1.91 -0.02 0.00 -1.82 0.00 0.00 70.33 66.96 2dir n THR 71 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2dir n ASN 72 N -3.92 4.69 -4.71 8.00 3.02 -1.26 -5.06 115.26 116.02 2dir n ASN 72 Ca -0.18 -3.71 -0.42 0.00 -0.03 0.00 0.00 54.58 50.25 2dir n ASN 72 Cb 0.47 -0.52 -0.03 0.00 -0.61 0.00 0.00 39.78 39.09 2dir n ASN 72 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2dir s PRO 73 N -3.53 4.31 -0.05 3.52 0.04 -1.26 -4.83 135.00 133.20 2dir s PRO 73 Ca 0.48 2.03 0.03 0.00 0.04 0.00 0.00 61.00 63.58 2dir s PRO 73 Cb 0.34 -3.36 -0.25 0.00 0.04 0.00 0.00 34.50 31.27 2dir s PRO 73 CO -0.17 -0.47 0.62 1.96 0.04 0.00 0.00 177.00 178.98 2dir h GLN 74 N 7.15 0.14 -4.22 4.56 1.08 -1.80 -3.46 115.11 118.56 2dir h GLN 74 Ca -0.41 -0.23 -0.52 0.00 -1.45 0.00 0.00 58.65 56.04 2dir h GLN 74 Cb 1.20 0.09 -0.37 0.00 -0.05 0.00 0.00 27.48 28.35 2dir h GLN 74 CO 0.87 0.87 -0.80 0.71 -0.95 0.00 0.00 178.83 179.53 2dir s TYR 75 N -2.59 1.41 -0.38 2.96 2.02 -1.00 -2.86 117.35 116.90 2dir s TYR 75 Ca -0.11 -0.67 -0.17 0.00 -0.37 0.00 0.00 57.07 55.75 2dir s TYR 75 Cb 0.07 -1.17 0.01 0.00 -0.40 0.00 0.00 41.96 40.47 2dir s TYR 75 CO 0.81 -0.47 0.44 0.99 -1.57 0.00 0.00 175.55 175.76 2dir s THR 76 N 1.59 5.08 -0.51 -0.71 2.01 -0.37 -1.57 115.64 121.17 2dir s THR 76 Ca 0.02 -0.05 -0.13 0.00 0.31 0.00 0.00 61.69 61.85 2dir s THR 76 Cb -0.13 -3.97 0.12 0.00 0.01 0.00 0.00 72.50 68.54 2dir s THR 76 CO -0.07 -0.29 0.43 0.68 -0.69 0.00 0.00 174.62 174.69 2dir s VAL 77 N 2.20 4.82 -0.01 3.82 -7.23 -0.45 -0.71 120.40 122.84 2dir s VAL 77 Ca 0.14 -1.57 -0.04 0.00 -1.81 0.00 0.00 61.98 58.70 2dir s VAL 77 Cb -0.16 -4.10 -0.04 0.00 0.56 0.00 0.00 36.38 32.64 2dir s VAL 77 CO 0.13 -0.80 0.20 0.68 -0.31 0.00 0.00 175.10 175.00 2dir s VAL 78 N 1.51 5.40 -0.32 1.32 -7.23 -0.55 -2.54 120.40 117.99 2dir s VAL 78 Ca 0.04 -0.03 0.03 0.00 -1.81 0.00 0.00 61.98 60.21 2dir s VAL 78 Cb -0.28 -3.53 0.09 0.00 0.56 0.00 0.00 36.38 33.22 2dir s VAL 78 CO 0.02 0.36 0.02 0.68 -0.31 0.00 0.00 175.10 175.87 2dir s VAL 79 N -1.29 2.16 0.33 1.32 -7.23 -0.55 -0.30 120.40 114.84 2dir s VAL 79 Ca 0.26 -2.15 -0.05 0.00 -1.81 0.00 0.00 61.98 58.23 2dir s VAL 79 Cb -0.13 -2.54 -0.05 0.00 0.56 0.00 0.00 36.38 34.22 2dir s VAL 79 CO 0.17 -0.50 0.60 -0.70 -0.31 0.00 0.00 175.10 174.36 2dir s GLU 80 N 0.98 3.63 -0.19 4.82 2.12 -0.22 -2.03 118.70 127.82 2dir s GLU 80 Ca 0.07 0.05 0.01 0.00 0.36 0.00 0.00 54.97 55.46 2dir s GLU 80 Cb -0.19 -2.59 0.02 0.00 0.26 0.00 0.00 34.13 31.63 2dir s GLU 80 CO -0.08 0.13 -0.19 0.42 -0.54 0.00 0.00 175.26 175.00 2dir s ILE 81 N -2.21 2.07 -0.34 -3.70 -1.09 -1.07 -0.69 121.20 114.17 2dir s ILE 81 Ca 0.45 -0.99 0.00 0.00 -2.23 0.00 0.00 60.65 57.88 2dir s ILE 81 Cb -0.10 -1.89 0.11 0.00 -1.58 0.00 0.00 42.46 38.99 2dir s ILE 81 CO 0.32 0.49 0.12 -0.63 -1.23 0.00 0.00 174.94 174.01 2dir s ILE 82 N 1.28 1.11 -0.33 2.92 1.09 -1.20 -4.60 121.20 121.46 2dir s ILE 82 Ca 0.04 -1.70 -0.01 0.00 -1.10 0.00 0.00 60.65 57.88 2dir s ILE 82 Cb -0.14 -1.83 0.00 0.00 -1.06 0.00 0.00 42.46 39.44 2dir s ILE 82 CO -0.12 -0.71 0.28 0.29 -0.10 0.00 0.00 174.94 174.58 2dir n LYS 83 N 4.56 -1.89 -3.45 2.79 4.76 -1.26 -3.76 118.16 119.91 2dir n LYS 83 Ca 0.01 0.22 -0.19 0.00 -2.87 0.00 0.00 58.31 55.47 2dir n LYS 83 Cb 0.41 -3.40 0.08 0.00 -1.84 0.00 0.00 35.03 30.28 2dir n LYS 83 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dir n ALA 84 N -2.30 -1.59 -2.21 7.82 0.00 -1.26 -5.01 120.51 115.95 2dir n ALA 84 Ca -0.05 0.16 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 2dir n ALA 84 Cb 0.53 -3.79 -0.10 0.00 0.00 0.00 0.00 19.45 16.10 2dir n ALA 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2dir s VAL 85 N -3.32 0.69 -0.20 0.00 0.11 -1.25 -5.15 120.40 111.28 2dir s VAL 85 Ca 0.27 -1.97 -0.07 0.00 -2.93 0.00 0.00 61.98 57.29 2dir s VAL 85 Cb -0.12 -1.95 -0.03 0.00 -1.53 0.00 0.00 36.38 32.74 2dir s VAL 85 CO 0.70 -0.63 0.05 0.00 -3.33 0.00 0.00 175.10 171.89 2dir s LEU 88 N 0.71 4.30 -0.14 0.00 1.02 -1.26 -1.05 118.68 122.27 2dir s LEU 88 Ca 0.14 1.45 -0.00 0.00 0.02 0.00 0.00 54.13 55.73 2dir s LEU 88 Cb -0.21 -3.40 0.03 0.00 0.02 0.00 0.00 46.19 42.62 2dir s LEU 88 CO -0.09 -0.29 -0.09 -0.44 0.02 0.00 0.00 176.35 175.46 2dir s SER 89 N 1.00 2.47 -0.21 2.29 0.01 0.58 -4.98 113.70 114.88 2dir s SER 89 Ca 0.46 -0.44 -0.15 0.00 1.31 0.00 0.00 55.95 57.13 2dir s SER 89 Cb -0.19 -0.95 -0.04 0.00 0.21 0.00 0.00 66.02 65.05 2dir s SER 89 CO 0.21 -0.12 0.37 -0.69 0.41 0.00 0.00 173.24 173.42 2dir s VAL 90 N 1.63 5.22 -0.22 3.43 1.01 -1.26 -1.48 120.40 128.73 2dir s VAL 90 Ca 0.04 0.63 -0.01 0.00 0.00 0.00 0.00 61.98 62.65 2dir s VAL 90 Cb -0.13 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.57 2dir s VAL 90 CO -0.09 0.26 -0.12 -0.69 0.00 0.00 0.00 175.10 174.47 2dir s VAL 91 N 1.30 2.57 -0.46 2.92 1.01 0.11 -4.95 120.40 122.91 2dir s VAL 91 Ca 0.17 -0.95 -0.24 0.00 0.00 0.00 0.00 61.98 60.97 2dir s VAL 91 Cb -0.15 -2.22 0.03 0.00 0.00 0.00 0.00 36.38 34.05 2dir s VAL 91 CO 0.08 0.36 0.82 -0.75 0.00 0.00 0.00 175.10 175.61 2dir s LYS 92 N 1.32 3.43 -0.09 2.72 2.20 -1.26 -1.24 119.74 126.81 2dir s LYS 92 Ca 0.02 -0.05 0.04 0.00 -0.36 0.00 0.00 55.97 55.62 2dir s LYS 92 Cb -0.15 -3.94 -0.00 0.00 -1.51 0.00 0.00 37.83 32.23 2dir s LYS 92 CO -0.08 -1.16 -0.24 0.45 -0.36 0.00 0.00 175.35 173.96 2dir s SER 93 N 2.20 3.05 0.00 1.43 0.15 -1.14 -4.93 113.70 114.46 2dir s SER 93 Ca 0.32 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.42 2dir s SER 93 Cb -0.12 -1.29 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 2dir s SER 93 CO 0.23 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.46 2dir n GLY 94 N 3.43 0.46 3.67 9.45 0.00 -1.26 -4.65 105.19 116.29 2dir n GLY 94 Ca -0.19 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2dir n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dir s PRO 95 N -0.44 4.22 -0.23 1.61 0.04 -1.26 -4.91 135.00 134.03 2dir s PRO 95 Ca 0.00 2.02 -0.08 0.00 0.04 0.00 0.00 61.00 62.98 2dir s PRO 95 Cb 0.00 -3.82 -0.18 0.00 0.04 0.00 0.00 34.50 30.54 2dir s PRO 95 CO 0.00 -0.75 -0.07 0.43 0.04 0.00 0.00 177.00 176.65 2dir n SER 96 N 6.54 1.99 -4.68 6.66 7.64 -1.26 -4.90 113.62 125.61 2dir n SER 96 Ca 0.15 0.15 -0.41 0.00 1.01 0.00 0.00 58.87 59.77 2dir n SER 96 Cb 0.43 -0.70 -0.04 0.00 -1.01 0.00 0.00 64.21 62.89 2dir n SER 96 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dir s SER 97 N -6.95 7.01 0.00 6.43 0.15 -1.26 -5.35 113.70 113.73 2dir s SER 97 Ca -0.32 1.23 0.14 0.00 0.70 0.00 0.00 55.95 57.70 2dir s SER 97 Cb 0.10 -2.46 0.11 0.00 -1.71 0.00 0.00 66.02 62.06 2dir s SER 97 CO 0.61 -0.34 0.96 0.61 1.20 0.00 0.00 173.24 176.27