#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 1.81 -4.67 1.61 2.88 -1.26 -5.00 113.62 108.99 2dir n SER 2 Ca 0.00 0.11 -0.43 0.00 -1.33 0.00 0.00 58.87 57.22 2dir n SER 2 Cb 0.00 -0.44 -0.01 0.00 -0.75 0.00 0.00 64.21 63.00 2dir n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dir n SER 3 N -3.53 2.42 -2.69 -3.46 2.88 -1.26 -4.93 113.62 103.06 2dir n SER 3 Ca -0.34 1.20 -0.06 0.00 -1.33 0.00 0.00 58.87 58.33 2dir n SER 3 Cb 0.79 -1.43 0.11 0.00 -0.75 0.00 0.00 64.21 62.92 2dir n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dir n GLY 4 N 0.98 1.17 3.67 0.46 0.00 -1.26 -5.13 105.19 105.08 2dir n GLY 4 Ca 0.06 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 2dir n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dir s SER 5 N -1.09 5.23 1.02 1.61 0.01 -1.26 -5.09 113.70 114.13 2dir s SER 5 Ca 0.19 0.13 -0.16 0.00 1.31 0.00 0.00 55.95 57.43 2dir s SER 5 Cb 0.37 -1.51 0.05 0.00 0.21 0.00 0.00 66.02 65.14 2dir s SER 5 CO -0.08 0.36 0.16 -0.24 0.41 0.00 0.00 173.24 173.85 2dir n SER 6 N 2.26 -2.37 0.00 2.44 2.88 -1.26 -4.99 113.62 112.58 2dir n SER 6 Ca -0.18 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 2dir n SER 6 Cb 0.54 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 2dir n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dir n GLY 7 N 1.82 0.69 2.93 0.46 0.00 -1.26 -5.12 105.19 104.71 2dir n GLY 7 Ca 0.04 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 0.74 1.64 0.32 1.61 2.20 -1.26 -5.00 119.74 119.99 2dir s LYS 8 Ca 0.00 -0.73 0.13 0.00 -0.36 0.00 0.00 55.97 55.01 2dir s LYS 8 Cb 0.00 -2.28 1.03 0.00 -1.51 0.00 0.00 37.83 35.07 2dir s LYS 8 CO 0.00 -0.48 1.43 0.00 -0.36 0.00 0.00 175.35 175.94 2dir n ALA 9 N 4.77 0.76 -0.13 3.13 0.00 -1.26 0.15 120.51 127.94 2dir n ALA 9 Ca -0.13 0.94 -0.08 0.00 0.00 0.00 0.00 53.44 54.17 2dir n ALA 9 Cb 0.46 -0.85 -0.00 0.00 0.00 0.00 0.00 19.45 19.07 2dir n ALA 9 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2dir h PHE 10 N 0.00 0.52 0.08 0.00 3.04 -2.00 -2.54 116.94 116.04 2dir h PHE 10 Ca 0.69 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.64 2dir h PHE 10 Cb 1.71 -0.17 0.00 0.00 2.56 0.00 0.00 35.95 40.05 2dir h PHE 10 CO -0.17 0.36 -0.04 -0.07 -2.02 0.00 0.00 178.31 176.37 2dir h LEU 11 N 0.52 -0.09 -0.77 0.59 3.38 0.98 -3.15 115.31 116.77 2dir h LEU 11 Ca 0.14 -0.04 0.24 0.00 0.09 0.00 0.00 57.88 58.32 2dir h LEU 11 Cb -0.01 0.02 -0.14 0.00 0.09 0.00 0.00 40.66 40.62 2dir h LEU 11 CO -0.03 0.41 0.13 -1.84 0.09 0.00 0.00 178.44 177.20 2dir n GLU 12 N -4.85 -0.06 0.22 1.13 0.28 0.20 0.69 120.64 118.26 2dir n GLU 12 Ca -0.02 1.13 -0.14 0.00 -0.16 0.00 0.00 57.16 57.97 2dir n GLU 12 Cb 0.06 -1.86 -0.08 0.00 1.43 0.00 0.00 31.44 30.99 2dir n GLU 12 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 2dir h ASP 13 N 0.00 -0.47 -0.67 -1.84 1.82 -1.57 -3.19 116.42 110.51 2dir h ASP 13 Ca 0.52 -0.09 0.12 0.00 -0.39 0.00 0.00 57.03 57.19 2dir h ASP 13 Cb 1.18 0.12 -0.12 0.00 0.68 0.00 0.00 39.33 41.18 2dir h ASP 13 CO -0.69 -0.17 -0.31 -0.03 -1.61 0.00 0.00 179.24 176.43 2dir h MET 14 N -0.77 -0.11 -0.58 0.28 4.05 0.31 -1.77 114.93 116.35 2dir h MET 14 Ca -0.06 0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.43 2dir h MET 14 Cb 0.53 0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 31.28 2dir h MET 14 CO 0.09 -0.07 -0.41 0.87 0.23 0.00 0.00 176.91 177.63 2dir h LYS 15 N -0.11 -0.08 -0.23 0.39 1.57 -1.29 0.71 116.57 117.52 2dir h LYS 15 Ca 0.27 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.09 2dir h LYS 15 Cb 0.55 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 2dir h LYS 15 CO -0.73 -0.05 -0.44 0.87 -0.57 0.00 0.00 179.45 178.52 2dir h LYS 16 N -0.08 -0.37 0.03 3.15 6.56 -1.33 0.69 116.57 125.21 2dir h LYS 16 Ca 0.09 0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.71 2dir h LYS 16 Cb 0.33 0.08 -0.00 0.00 -0.57 0.00 0.00 32.23 32.07 2dir h LYS 16 CO -0.59 -0.25 -0.03 -0.92 -2.06 0.00 0.00 179.45 175.60 2dir h TYR 17 N -0.38 -0.10 -1.44 -1.35 3.20 -0.89 -0.93 116.97 115.08 2dir h TYR 17 Ca 0.04 0.00 0.46 0.00 3.14 0.00 0.00 58.73 62.38 2dir h TYR 17 Cb 0.51 0.04 -0.11 0.00 1.54 0.00 0.00 36.73 38.71 2dir h TYR 17 CO -0.64 -0.04 0.97 0.00 -1.64 0.00 0.00 178.16 176.80 2dir n ALA 18 N -2.34 1.41 -0.12 1.82 0.00 0.24 0.74 120.51 122.26 2dir n ALA 18 Ca -0.01 0.73 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2dir n ALA 18 Cb 0.03 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 -4.27 0.00 0.04 0.00 2.13 0.23 -0.52 120.64 118.25 2dir n GLU 19 Ca 0.38 0.44 0.02 0.00 0.66 0.00 0.00 57.16 58.66 2dir n GLU 19 Cb 1.57 -1.15 0.13 0.00 0.27 0.00 0.00 31.44 32.26 2dir n GLU 19 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 2dir n THR 20 N -1.82 1.59 -0.04 6.31 5.66 -0.42 0.77 114.28 126.34 2dir n THR 20 Ca 0.00 0.56 -0.19 0.00 -3.05 0.00 0.00 64.05 61.37 2dir n THR 20 Cb 0.00 -1.56 -0.13 0.00 -1.55 0.00 0.00 70.33 67.09 2dir n THR 20 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 2dir n PHE 21 N -1.64 0.80 0.62 1.09 7.35 0.23 -4.23 117.46 121.67 2dir n PHE 21 Ca -0.00 0.18 0.12 0.00 -0.76 0.00 0.00 57.45 56.99 2dir n PHE 21 Cb 0.06 -1.11 0.22 0.00 0.35 0.00 0.00 39.48 39.00 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 3.08 0.02 -2.13 4.77 0.33 -4.51 117.00 115.22 2dir n LEU 22 Ca -0.35 -1.25 -0.13 0.00 -0.03 0.00 0.00 56.01 54.25 2dir n LEU 22 Cb 1.04 -0.17 -0.07 0.00 -2.33 0.00 0.00 43.42 41.89 2dir n LEU 22 CO 0.38 0.63 0.57 -0.33 -1.33 0.00 0.00 177.39 177.31 2dir h GLU 23 N 4.20 -0.52 0.00 3.23 5.08 0.18 1.47 114.58 128.22 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 0.92 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.28 2dir h GLU 23 CO 0.00 -0.35 0.00 -0.35 -1.00 0.00 0.00 179.01 177.31 2dir n PRO 24 N -5.44 0.14 -0.02 2.33 -0.04 -1.26 0.31 135.00 131.03 2dir n PRO 24 Ca -0.05 0.18 0.06 0.00 -0.04 0.00 0.00 63.50 63.65 2dir n PRO 24 Cb 0.37 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.21 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 0.31 -4.61 117.44 120.33 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 -0.41 0.00 0.00 -2.01 0.00 0.00 31.31 29.02 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 -2.12 0.00 -2.56 -5.99 3.72 0.48 -4.50 117.46 106.50 2dir n PHE 26 Ca -0.06 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.94 2dir n PHE 26 Cb 0.49 0.07 -0.05 0.00 -0.94 0.00 0.00 39.48 39.05 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 -1.78 4.70 0.87 -1.08 2.20 0.94 -3.90 119.74 121.69 2dir s LYS 27 Ca 0.00 1.71 -0.17 0.00 -0.36 0.00 0.00 55.97 57.15 2dir s LYS 27 Cb 0.00 -3.22 -0.11 0.00 -1.51 0.00 0.00 37.83 32.98 2dir s LYS 27 CO 0.00 0.29 -0.39 0.00 -0.36 0.00 0.00 175.35 174.90 2dir n ALA 28 N 1.35 -4.27 0.83 3.13 0.00 -1.26 -2.16 120.51 118.13 2dir n ALA 28 Ca -0.01 -0.51 0.08 0.00 0.00 0.00 0.00 53.44 53.00 2dir n ALA 28 Cb 0.45 -1.35 0.42 0.00 0.00 0.00 0.00 19.45 18.97 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 1.44 0.34 -2.74 0.00 -0.04 -1.26 -4.82 135.00 127.93 2dir n PRO 29 Ca 0.02 0.08 -0.33 0.00 -0.04 0.00 0.00 63.50 63.23 2dir n PRO 29 Cb 0.53 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.29 6.77 -0.13 3.54 0.01 -0.92 -5.06 114.94 116.86 2dir s ASN 30 Ca 0.19 1.75 -0.33 0.00 -0.71 0.00 0.00 52.86 53.75 2dir s ASN 30 Cb 0.10 -2.54 0.13 0.00 0.41 0.00 0.00 41.25 39.35 2dir s ASN 30 CO 0.20 -0.48 1.17 -1.59 -1.51 0.00 0.00 177.10 174.90 2dir s LYS 31 N -3.22 0.41 0.00 -0.60 -2.85 -1.25 -3.91 119.74 108.31 2dir s LYS 31 Ca 0.63 -0.17 0.00 0.00 -1.00 0.00 0.00 55.97 55.44 2dir s LYS 31 Cb -0.11 0.18 0.00 0.00 -2.06 0.00 0.00 37.83 35.84 2dir s LYS 31 CO 0.15 -0.18 0.00 0.41 0.10 0.00 0.00 175.35 175.83 2dir n GLY 32 N -0.17 0.16 3.84 0.59 0.00 -1.26 -5.00 105.19 103.35 2dir n GLY 32 Ca -0.02 -1.29 -0.21 0.00 0.00 0.00 0.00 46.02 44.49 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 -3.64 3.00 0.29 2.61 -4.23 -1.26 -1.38 115.64 111.03 2dir s THR 33 Ca 0.00 -1.42 -0.20 0.00 -1.18 0.00 0.00 61.69 58.89 2dir s THR 33 Cb 0.00 -3.06 0.04 0.00 1.34 0.00 0.00 72.50 70.82 2dir s THR 33 CO 0.00 -0.09 0.81 0.72 -0.54 0.00 0.00 174.62 175.52 2dir s PHE 34 N -2.41 -0.05 -0.17 3.99 -0.71 -1.24 -1.84 117.98 115.55 2dir s PHE 34 Ca 0.44 -0.45 -0.04 0.00 -1.04 0.00 0.00 56.93 55.83 2dir s PHE 34 Cb -0.04 0.74 0.07 0.00 -1.21 0.00 0.00 43.02 42.59 2dir s PHE 34 CO 0.26 -1.26 0.14 1.14 -1.34 0.00 0.00 175.22 174.16 2dir s GLN 35 N -3.11 0.09 0.22 1.99 -2.07 -0.79 0.88 119.66 116.86 2dir s GLN 35 Ca 0.14 0.09 -0.22 0.00 -1.82 0.00 0.00 55.36 53.55 2dir s GLN 35 Cb -0.05 -1.42 -0.08 0.00 -1.09 0.00 0.00 33.01 30.37 2dir s GLN 35 CO 0.08 -0.61 0.77 0.42 -1.32 0.00 0.00 175.29 174.62 2dir s ILE 36 N 2.22 4.46 -0.08 3.63 1.01 -1.26 -2.17 121.20 129.01 2dir s ILE 36 Ca 0.04 1.48 -0.04 0.00 0.00 0.00 0.00 60.65 62.13 2dir s ILE 36 Cb -0.15 -3.96 0.04 0.00 0.01 0.00 0.00 42.46 38.40 2dir s ILE 36 CO -0.09 0.29 0.19 -0.69 0.00 0.00 0.00 174.94 174.63 2dir s VAL 37 N -1.43 -0.10 -0.61 2.92 1.01 -1.05 -4.99 120.40 116.15 2dir s VAL 37 Ca 0.42 0.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.38 2dir s VAL 37 Cb -0.19 -0.30 0.07 0.00 0.00 0.00 0.00 36.38 35.96 2dir s VAL 37 CO 0.23 0.08 0.87 -0.47 0.00 0.00 0.00 175.10 175.82 2dir s TYR 38 N 1.45 2.79 -0.15 5.22 5.04 -1.26 -1.36 117.35 129.09 2dir s TYR 38 Ca -0.07 -0.53 -0.09 0.00 -2.44 0.00 0.00 57.07 53.95 2dir s TYR 38 Cb -0.11 -4.12 -0.04 0.00 0.35 0.00 0.00 41.96 38.04 2dir s TYR 38 CO -0.07 -1.46 0.15 0.15 -1.34 0.00 0.00 175.55 172.98 2dir s LYS 39 N 3.63 3.78 -0.21 4.97 1.02 -0.77 -5.00 119.74 127.15 2dir s LYS 39 Ca 0.21 -0.14 -0.02 0.00 0.02 0.00 0.00 55.97 56.04 2dir s LYS 39 Cb -0.18 -3.29 0.06 0.00 -0.52 0.00 0.00 37.83 33.91 2dir s LYS 39 CO 0.11 0.57 0.03 -1.54 -0.92 0.00 0.00 175.35 173.60 2dir s SER 40 N -0.43 3.19 -0.09 2.83 1.04 -1.26 -2.80 113.70 116.17 2dir s SER 40 Ca 0.13 -0.97 -0.18 0.00 0.48 0.00 0.00 55.95 55.40 2dir s SER 40 Cb -0.12 -0.72 -0.28 0.00 0.10 0.00 0.00 66.02 65.00 2dir s SER 40 CO 0.02 -0.31 0.66 0.03 0.98 0.00 0.00 173.24 174.62 2dir h ARG 41 N 8.18 0.25 0.03 4.02 3.08 -1.98 -3.41 114.38 124.54 2dir h ARG 41 Ca -0.16 -0.42 -0.00 0.00 0.07 0.00 0.00 59.98 59.47 2dir h ARG 41 Cb 1.10 0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.31 2dir h ARG 41 CO 0.36 1.20 -0.01 -0.91 -1.07 0.00 0.00 179.97 179.54 2dir h ASN 42 N -0.37 -0.03 -5.24 7.04 4.21 -1.95 -3.50 115.58 115.73 2dir h ASN 42 Ca -0.25 0.00 0.17 0.00 1.21 0.00 0.00 56.30 57.44 2dir h ASN 42 Cb 1.69 0.01 -0.09 0.00 -1.12 0.00 0.00 38.32 38.80 2dir h ASN 42 CO 0.08 0.32 0.50 0.54 -1.29 0.00 0.00 177.43 177.57 2dir s ASN 43 N -4.75 -0.20 -0.77 5.81 4.22 -1.26 -5.11 114.94 112.88 2dir s ASN 43 Ca -0.01 -0.33 -0.03 0.00 -2.14 0.00 0.00 52.86 50.35 2dir s ASN 43 Cb 0.00 0.46 0.19 0.00 1.28 0.00 0.00 41.25 43.18 2dir s ASN 43 CO 0.02 -0.84 0.62 -0.44 -2.04 0.00 0.00 177.10 174.42 2dir s SER 44 N -2.87 5.70 -0.02 3.54 0.01 -1.26 -4.83 113.70 113.97 2dir s SER 44 Ca 0.11 -3.25 -0.01 0.00 1.31 0.00 0.00 55.95 54.12 2dir s SER 44 Cb -0.01 -1.91 -0.00 0.00 0.21 0.00 0.00 66.02 64.31 2dir s SER 44 CO 0.00 -0.30 -0.01 -0.74 0.41 0.00 0.00 173.24 172.60 2dir h HIS 45 N 6.61 0.00 -4.13 2.43 6.17 -2.02 -3.47 115.15 120.74 2dir h HIS 45 Ca 0.08 0.00 -0.53 0.00 0.71 0.00 0.00 60.37 60.63 2dir h HIS 45 Cb 0.90 0.00 0.13 0.00 2.52 0.00 0.00 27.41 30.95 2dir h HIS 45 CO 0.75 0.00 0.44 0.54 0.71 0.00 0.00 177.93 180.37 2dir s VAL 46 N -1.13 2.58 -0.23 5.26 0.11 -1.26 -4.91 120.40 120.81 2dir s VAL 46 Ca -0.01 0.33 -0.29 0.00 -2.93 0.00 0.00 61.98 59.08 2dir s VAL 46 Cb 0.00 -3.03 -0.03 0.00 -1.53 0.00 0.00 36.38 31.80 2dir s VAL 46 CO 0.02 -0.11 1.67 0.20 -3.33 0.00 0.00 175.10 173.55 2dir s ASN 47 N -1.80 6.27 0.10 3.54 -0.87 -1.26 -4.90 114.94 116.01 2dir s ASN 47 Ca 0.76 1.59 -0.26 0.00 -1.57 0.00 0.00 52.86 53.38 2dir s ASN 47 Cb -0.29 -2.53 -0.12 0.00 -0.02 0.00 0.00 41.25 38.29 2dir s ASN 47 CO 0.37 -1.35 1.68 0.08 -2.57 0.00 0.00 177.10 175.31 2dir h ARG 48 N 11.21 -0.34 -0.94 -0.60 0.11 -1.96 -2.68 114.38 119.18 2dir h ARG 48 Ca -0.34 0.02 0.22 0.00 0.10 0.00 0.00 59.98 59.98 2dir h ARG 48 Cb 1.16 0.08 -0.18 0.00 1.11 0.00 0.00 29.97 32.14 2dir h ARG 48 CO 1.00 -0.23 -0.13 0.39 0.10 0.00 0.00 179.97 181.10 2dir n GLU 49 N -5.29 -0.08 0.38 0.08 1.02 -1.26 -0.44 120.64 115.06 2dir n GLU 49 Ca -0.08 1.44 -0.19 0.00 -0.02 0.00 0.00 57.16 58.32 2dir n GLU 49 Cb 0.20 -2.21 -0.09 0.00 -0.02 0.00 0.00 31.44 29.32 2dir n GLU 49 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2dir h GLU 50 N 0.00 -1.04 0.01 3.49 5.08 -1.89 0.34 114.58 120.57 2dir h GLU 50 Ca 0.50 0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.96 2dir h GLU 50 Cb 0.88 0.24 -0.06 0.00 0.50 0.00 0.00 28.75 30.32 2dir h GLU 50 CO -0.93 -0.69 -0.47 0.28 -1.00 0.00 0.00 179.01 176.19 2dir h VAL 51 N -1.08 0.08 0.02 3.13 2.07 -0.62 0.90 116.25 120.75 2dir h VAL 51 Ca -0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2dir h VAL 51 Cb 0.88 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2dir h VAL 51 CO 0.08 0.00 -0.01 0.40 0.02 0.00 0.00 177.57 178.05 2dir h ILE 52 N -0.63 0.00 -0.89 4.57 2.04 -0.89 0.18 117.51 121.90 2dir h ILE 52 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.99 2dir h ILE 52 Cb 0.69 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.66 2dir h ILE 52 CO -0.33 0.00 -0.48 0.54 0.00 0.00 0.00 178.15 177.88 2dir n ARG 53 N -2.20 -0.34 0.28 2.37 5.12 0.12 -1.20 116.66 120.80 2dir n ARG 53 Ca -0.00 1.35 -0.16 0.00 -1.93 0.00 0.00 57.85 57.11 2dir n ARG 53 Cb 0.01 -1.99 -0.08 0.00 -1.16 0.00 0.00 32.46 29.24 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 -0.86 -0.79 5.56 4.22 -0.80 -2.31 114.58 119.60 2dir h GLU 54 Ca 0.19 0.06 0.27 0.00 0.08 0.00 0.00 59.36 59.96 2dir h GLU 54 Cb 0.41 0.20 -0.14 0.00 0.50 0.00 0.00 28.75 29.71 2dir h GLU 54 CO -0.85 -0.57 0.22 1.28 -2.18 0.00 0.00 179.01 176.90 2dir n LEU 55 N -5.02 0.09 -0.14 1.64 4.77 0.63 0.23 117.00 119.21 2dir n LEU 55 Ca -0.11 1.33 -0.11 0.00 -0.03 0.00 0.00 56.01 57.09 2dir n LEU 55 Cb 0.40 -0.56 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 2dir n LEU 55 CO 0.24 -1.41 0.77 0.00 -1.33 0.00 0.00 177.39 175.66 2dir h ALA 56 N 1.58 0.54 -0.26 -1.18 0.00 -0.75 -2.76 119.26 116.43 2dir h ALA 56 Ca 0.57 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.29 2dir h ALA 56 Cb 1.37 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2dir h ALA 56 CO -0.68 0.34 0.22 0.78 0.00 0.00 0.00 179.25 179.92 2dir h GLY 57 N 0.54 0.00 0.13 0.00 0.00 0.34 -2.78 103.07 101.31 2dir h GLY 57 Ca 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 2dir h GLY 57 CO 0.02 0.00 -0.04 -2.22 0.00 0.00 0.00 176.54 174.30 2dir h ILE 58 N 0.00 0.59 -1.60 2.60 2.04 -1.13 -3.23 117.51 116.79 2dir h ILE 58 Ca 0.12 -1.27 0.50 0.00 1.00 0.00 0.00 64.86 65.21 2dir h ILE 58 Cb 0.57 1.07 -0.10 0.00 -0.74 0.00 0.00 36.82 37.61 2dir h ILE 58 CO -0.00 0.18 1.10 0.52 0.00 0.00 0.00 178.15 179.95 2dir n VAL 59 N -4.82 -0.12 -0.03 1.67 0.31 -1.06 0.12 118.33 114.40 2dir n VAL 59 Ca -0.05 1.56 -0.14 0.00 -0.01 0.00 0.00 64.34 65.71 2dir n VAL 59 Cb 0.19 -2.58 -0.10 0.00 -0.91 0.00 0.00 33.84 30.44 2dir n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dir h THR 61 N -0.50 0.38 0.08 0.00 1.03 0.95 -2.30 112.91 112.56 2dir h THR 61 Ca -0.00 -0.04 -0.00 0.00 -0.01 0.00 0.00 66.41 66.35 2dir h THR 61 Cb 0.68 0.24 0.00 0.00 -1.07 0.00 0.00 68.15 68.00 2dir h THR 61 CO 0.01 0.02 -0.04 -0.07 -0.01 0.00 0.00 175.52 175.44 2dir h LEU 62 N 0.13 -0.10 -7.94 0.00 3.38 -1.47 -3.45 115.31 105.86 2dir h LEU 62 Ca 0.63 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 58.06 2dir h LEU 62 Cb 2.19 0.02 -0.35 0.00 0.09 0.00 0.00 40.66 42.62 2dir h LEU 62 CO -0.14 -0.04 -0.82 0.21 0.09 0.00 0.00 178.44 177.73 2dir s ASN 63 N -2.66 2.15 0.54 -0.43 3.84 -0.86 -4.67 114.94 112.86 2dir s ASN 63 Ca -0.02 -0.36 0.22 0.00 0.21 0.00 0.00 52.86 52.91 2dir s ASN 63 Cb 0.00 -0.95 1.45 0.00 -0.55 0.00 0.00 41.25 41.20 2dir s ASN 63 CO 0.05 -0.00 2.13 0.28 -2.79 0.00 0.00 177.10 176.77 2dir h SER 64 N 7.40 0.00 0.75 -4.21 0.02 -1.88 0.11 113.55 115.74 2dir h SER 64 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2dir h SER 64 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2dir h SER 64 CO 0.47 0.00 0.00 -0.33 -1.14 0.00 0.00 176.83 175.83 2dir h GLU 65 N 0.00 0.00 -6.51 3.45 4.39 -1.95 -3.43 114.58 110.53 2dir h GLU 65 Ca 0.06 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.23 2dir h GLU 65 Cb 0.25 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2dir h GLU 65 CO -0.00 0.00 0.75 -0.80 -1.16 0.00 0.00 179.01 177.80 2dir s ASN 66 N -5.00 6.83 -0.23 1.42 0.01 0.39 -4.24 114.94 114.11 2dir s ASN 66 Ca 0.01 2.28 -0.03 0.00 -0.71 0.00 0.00 52.86 54.41 2dir s ASN 66 Cb 0.09 -2.58 0.10 0.00 0.41 0.00 0.00 41.25 39.27 2dir s ASN 66 CO 0.45 -0.67 0.22 -0.54 -1.51 0.00 0.00 177.10 175.06 2dir s LYS 67 N 1.41 0.21 -0.03 -0.60 3.01 -0.48 -4.75 119.74 118.52 2dir s LYS 67 Ca 0.65 0.05 -0.30 0.00 -1.01 0.00 0.00 55.97 55.36 2dir s LYS 67 Cb -0.36 -1.12 -0.08 0.00 -1.01 0.00 0.00 37.83 35.26 2dir s LYS 67 CO 0.30 -0.77 2.02 1.55 0.51 0.00 0.00 175.35 178.96 2dir n VAL 68 N 5.31 0.67 -4.68 3.17 3.14 -1.26 -3.63 118.33 121.05 2dir n VAL 68 Ca -0.05 -0.20 -0.30 0.00 -2.96 0.00 0.00 64.34 60.83 2dir n VAL 68 Cb 0.48 -2.33 -0.14 0.00 -1.06 0.00 0.00 33.84 30.80 2dir n VAL 68 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2dir s ASP 69 N 5.26 3.29 0.00 6.55 2.15 0.25 -4.80 116.67 129.37 2dir s ASP 69 Ca 0.92 -0.64 0.09 0.00 0.43 0.00 0.00 52.55 53.35 2dir s ASP 69 Cb -0.44 -0.29 0.13 0.00 -0.30 0.00 0.00 42.92 42.02 2dir s ASP 69 CO 0.42 0.23 0.94 0.18 -0.17 0.00 0.00 175.17 176.76 2dir n LEU 70 N 1.40 2.10 -0.04 -1.34 4.77 -1.26 -3.62 117.00 119.01 2dir n LEU 70 Ca -0.17 -1.38 -0.08 0.00 -0.03 0.00 0.00 56.01 54.35 2dir n LEU 70 Cb 0.52 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2dir n LEU 70 CO 0.23 0.47 -0.54 0.41 -1.33 0.00 0.00 177.39 176.63 2dir n THR 71 N 0.42 1.24 -2.68 -5.08 -1.04 -1.26 -4.82 114.28 101.06 2dir n THR 71 Ca 0.07 0.14 -0.26 0.00 -2.04 0.00 0.00 64.05 61.95 2dir n THR 71 Cb 0.28 -1.93 -0.02 0.00 -1.82 0.00 0.00 70.33 66.85 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 -3.94 4.47 -4.75 8.00 3.02 -1.26 -4.98 115.26 115.82 2dir n ASN 72 Ca -0.13 -3.67 -0.41 0.00 -0.03 0.00 0.00 54.58 50.34 2dir n ASN 72 Cb 0.39 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 39.03 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 -3.48 4.41 -0.10 3.52 0.04 -1.26 -4.74 135.00 133.39 2dir s PRO 73 Ca 0.48 2.05 -0.03 0.00 0.04 0.00 0.00 61.00 63.54 2dir s PRO 73 Cb 0.35 -3.17 -0.26 0.00 0.04 0.00 0.00 34.50 31.46 2dir s PRO 73 CO -0.16 -0.18 0.42 1.04 0.04 0.00 0.00 177.00 178.16 2dir n GLN 74 N 2.14 0.74 -4.10 4.56 1.13 -0.99 -3.10 117.38 117.75 2dir n GLN 74 Ca 0.04 0.27 -0.30 0.00 -1.94 0.00 0.00 57.00 55.07 2dir n GLN 74 Cb 0.43 -1.73 -0.17 0.00 0.11 0.00 0.00 30.24 28.89 2dir n GLN 74 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2dir s TYR 75 N -2.57 2.11 -0.39 1.08 2.02 -0.77 -2.84 117.35 115.99 2dir s TYR 75 Ca -0.19 -1.14 -0.17 0.00 -0.37 0.00 0.00 57.07 55.20 2dir s TYR 75 Cb 0.07 -1.55 0.01 0.00 -0.40 0.00 0.00 41.96 40.09 2dir s TYR 75 CO 0.78 -0.63 0.43 0.99 -1.57 0.00 0.00 175.55 175.55 2dir s THR 76 N 1.40 5.10 -0.52 -0.71 2.01 -0.36 -1.89 115.64 120.67 2dir s THR 76 Ca 0.03 -0.11 -0.15 0.00 0.31 0.00 0.00 61.69 61.77 2dir s THR 76 Cb -0.13 -3.96 0.12 0.00 0.01 0.00 0.00 72.50 68.54 2dir s THR 76 CO -0.09 -0.29 0.45 0.68 -0.69 0.00 0.00 174.62 174.68 2dir s VAL 77 N 2.15 5.02 -0.18 3.82 -7.23 -0.92 -1.36 120.40 121.71 2dir s VAL 77 Ca 0.13 -1.48 -0.11 0.00 -1.81 0.00 0.00 61.98 58.72 2dir s VAL 77 Cb -0.17 -4.19 -0.05 0.00 0.56 0.00 0.00 36.38 32.53 2dir s VAL 77 CO 0.13 -0.80 0.17 0.68 -0.31 0.00 0.00 175.10 174.97 2dir s VAL 78 N 1.56 5.39 -0.44 1.32 -7.23 -0.47 -2.53 120.40 118.00 2dir s VAL 78 Ca 0.04 0.29 -0.09 0.00 -1.81 0.00 0.00 61.98 60.41 2dir s VAL 78 Cb -0.28 -3.51 0.10 0.00 0.56 0.00 0.00 36.38 33.25 2dir s VAL 78 CO 0.03 0.45 0.30 0.68 -0.31 0.00 0.00 175.10 176.25 2dir s VAL 79 N 0.20 4.16 0.20 1.32 -7.23 -0.46 -0.24 120.40 118.35 2dir s VAL 79 Ca 0.11 -1.62 -0.06 0.00 -1.81 0.00 0.00 61.98 58.60 2dir s VAL 79 Cb -0.12 -3.66 -0.06 0.00 0.56 0.00 0.00 36.38 33.11 2dir s VAL 79 CO 0.00 -0.64 0.47 -0.70 -0.31 0.00 0.00 175.10 173.92 2dir s GLU 80 N 1.38 3.67 -0.48 4.82 2.56 0.13 -1.86 118.70 128.92 2dir s GLU 80 Ca 0.05 0.03 -0.12 0.00 0.00 0.00 0.00 54.97 54.93 2dir s GLU 80 Cb -0.25 -2.74 0.11 0.00 2.00 0.00 0.00 34.13 33.25 2dir s GLU 80 CO 0.00 0.36 0.38 0.42 -0.56 0.00 0.00 175.26 175.87 2dir s ILE 81 N -1.81 4.62 -0.02 -3.70 -1.09 -1.12 -0.88 121.20 117.19 2dir s ILE 81 Ca 0.43 -1.56 0.06 0.00 -2.23 0.00 0.00 60.65 57.35 2dir s ILE 81 Cb -0.11 -3.95 -0.01 0.00 -1.58 0.00 0.00 42.46 36.80 2dir s ILE 81 CO 0.25 -0.74 -0.19 -0.63 -1.23 0.00 0.00 174.94 172.40 2dir s ILE 82 N 1.47 1.53 -1.18 2.92 1.09 -1.05 -4.43 121.20 121.55 2dir s ILE 82 Ca 0.04 -0.83 -0.09 0.00 -1.10 0.00 0.00 60.65 58.67 2dir s ILE 82 Cb -0.27 -1.27 0.08 0.00 -1.06 0.00 0.00 42.46 39.94 2dir s ILE 82 CO 0.02 0.43 0.41 0.29 -0.10 0.00 0.00 174.94 175.99 2dir n LYS 83 N 2.62 -2.93 -2.91 2.79 5.02 -1.26 0.74 118.16 122.23 2dir n LYS 83 Ca -0.15 0.38 -0.22 0.00 -2.02 0.00 0.00 58.31 56.30 2dir n LYS 83 Cb 0.53 -5.03 0.02 0.00 -0.02 0.00 0.00 35.03 30.53 2dir n LYS 83 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dir n ALA 84 N -3.39 -0.91 -2.84 7.82 0.00 -1.26 -4.98 120.51 114.95 2dir n ALA 84 Ca -0.00 0.25 -0.17 0.00 0.00 0.00 0.00 53.44 53.52 2dir n ALA 84 Cb 0.53 -3.46 -0.15 0.00 0.00 0.00 0.00 19.45 16.37 2dir n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2dir s VAL 85 N -3.13 0.51 -0.04 0.00 1.01 0.23 -5.11 120.40 113.86 2dir s VAL 85 Ca 0.24 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 2dir s VAL 85 Cb -0.11 -0.44 -0.06 0.00 0.00 0.00 0.00 36.38 35.77 2dir s VAL 85 CO 0.30 0.15 1.65 0.00 0.00 0.00 0.00 175.10 177.20 2dir s LEU 88 N 1.14 4.23 -0.14 0.00 1.02 -1.26 0.17 118.68 123.84 2dir s LEU 88 Ca -0.04 0.59 0.01 0.00 0.02 0.00 0.00 54.13 54.71 2dir s LEU 88 Cb -0.20 -2.50 0.02 0.00 0.02 0.00 0.00 46.19 43.53 2dir s LEU 88 CO -0.04 0.02 -0.14 -0.44 0.02 0.00 0.00 176.35 175.77 2dir s SER 89 N 0.68 2.61 -0.03 2.29 0.01 0.66 -4.97 113.70 114.96 2dir s SER 89 Ca 0.20 -0.47 -0.14 0.00 1.31 0.00 0.00 55.95 56.85 2dir s SER 89 Cb -0.14 -1.15 -0.05 0.00 0.21 0.00 0.00 66.02 64.89 2dir s SER 89 CO 0.07 -0.03 0.39 -0.69 0.41 0.00 0.00 173.24 173.38 2dir s VAL 90 N 1.33 5.09 -0.11 3.43 1.01 -1.26 -1.37 120.40 128.52 2dir s VAL 90 Ca 0.01 0.79 -0.03 0.00 0.00 0.00 0.00 61.98 62.75 2dir s VAL 90 Cb -0.13 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.59 2dir s VAL 90 CO -0.08 0.55 0.04 -0.69 0.00 0.00 0.00 175.10 174.93 2dir s VAL 91 N -0.87 0.19 -0.41 2.92 1.01 -0.46 -4.96 120.40 117.82 2dir s VAL 91 Ca 0.23 -0.00 -0.24 0.00 0.00 0.00 0.00 61.98 61.97 2dir s VAL 91 Cb -0.16 -0.55 0.02 0.00 0.00 0.00 0.00 36.38 35.69 2dir s VAL 91 CO 0.12 0.03 0.83 -0.75 0.00 0.00 0.00 175.10 175.33 2dir s LYS 92 N 2.03 3.61 0.14 2.72 2.20 -1.26 -1.22 119.74 127.95 2dir s LYS 92 Ca 0.03 0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.82 2dir s LYS 92 Cb -0.14 -3.88 0.00 0.00 -1.51 0.00 0.00 37.83 32.30 2dir s LYS 92 CO -0.06 -1.03 0.00 0.45 -0.36 0.00 0.00 175.35 174.35 2dir n SER 93 N 6.73 0.63 -1.43 1.43 2.88 -1.13 -5.05 113.62 117.68 2dir n SER 93 Ca 0.04 0.22 0.17 0.00 -1.33 0.00 0.00 58.87 57.97 2dir n SER 93 Cb 0.48 -0.10 -0.09 0.00 -0.75 0.00 0.00 64.21 63.76 2dir n SER 93 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dir n GLY 94 N 2.86 -3.02 3.60 0.46 0.00 -1.18 -4.91 105.19 103.00 2dir n GLY 94 Ca 0.00 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 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 -4.07 -1.11 -0.06 1.61 0.04 -1.26 -5.01 135.00 125.14 2dir s PRO 95 Ca 0.00 -0.03 -0.00 0.00 0.04 0.00 0.00 61.00 61.01 2dir s PRO 95 Cb 0.00 -1.61 0.03 0.00 0.04 0.00 0.00 34.50 32.96 2dir s PRO 95 CO 0.00 -3.65 -0.02 -1.12 0.04 0.00 0.00 177.00 172.25 2dir s SER 96 N -3.86 1.37 0.43 6.66 0.01 -1.26 -5.15 113.70 111.90 2dir s SER 96 Ca 0.71 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.85 2dir s SER 96 Cb -0.10 -0.47 -0.01 0.00 0.21 0.00 0.00 66.02 65.65 2dir s SER 96 CO 0.56 -0.14 0.65 -0.94 0.41 0.00 0.00 173.24 173.79 2dir s SER 97 N 1.55 5.95 0.00 2.44 1.04 -1.26 -5.30 113.70 118.13 2dir s SER 97 Ca -0.01 0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.77 2dir s SER 97 Cb -0.13 -1.67 0.00 0.00 0.10 0.00 0.00 66.02 64.32 2dir s SER 97 CO -0.04 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.18