#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f3l s SER 8 N 0.00 -0.62 -0.05 0.00 0.15 -1.26 -2.13 113.70 109.78 2f3l s SER 8 Ca 0.00 1.12 0.03 0.00 0.70 0.00 0.00 55.95 57.80 2f3l s SER 8 Cb 0.00 1.16 0.01 0.00 -1.71 0.00 0.00 66.02 65.47 2f3l s SER 8 CO 0.00 -0.21 -0.14 -0.31 1.20 0.00 0.00 173.24 173.77 2f3l s TYR 9 N 1.82 1.56 -0.02 3.44 1.51 0.92 -4.96 117.35 121.61 2f3l s TYR 9 Ca -0.08 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.47 2f3l s TYR 9 Cb -0.09 -1.09 0.02 0.00 -0.11 0.00 0.00 41.96 40.69 2f3l s TYR 9 CO -0.15 -0.22 0.01 -1.21 -1.11 0.00 0.00 175.55 172.86 2f3l s GLU 10 N 0.36 0.10 -1.60 -0.62 2.02 -1.26 -0.76 118.70 116.95 2f3l s GLU 10 Ca -0.10 0.08 0.00 0.00 0.02 0.00 0.00 54.97 54.98 2f3l s GLU 10 Cb -0.14 -0.27 0.00 0.00 0.10 0.00 0.00 34.13 33.83 2f3l s GLU 10 CO 0.03 -0.10 0.00 -0.25 0.02 0.00 0.00 175.26 174.96 2f3l n ASP 11 N 3.82 -4.72 -4.97 -0.19 8.00 -0.70 -4.96 116.55 112.83 2f3l n ASP 11 Ca -0.23 0.24 -0.21 0.00 0.71 0.00 0.00 54.79 55.30 2f3l n ASP 11 Cb 0.53 -4.09 0.00 0.00 -0.02 0.00 0.00 41.12 37.54 2f3l n ASP 11 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2f3l s VAL 12 N -2.65 4.10 -0.31 2.53 -7.23 -1.25 -4.96 120.40 110.64 2f3l s VAL 12 Ca 0.00 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 59.43 2f3l s VAL 12 Cb 0.00 -3.46 0.09 0.00 0.56 0.00 0.00 36.38 33.56 2f3l s VAL 12 CO 0.00 -0.25 0.01 -0.54 -0.31 0.00 0.00 175.10 174.01 2f3l s LYS 13 N -4.34 1.59 -0.79 4.82 1.02 -1.26 -1.28 119.74 119.50 2f3l s LYS 13 Ca 0.46 -1.61 0.03 0.00 0.02 0.00 0.00 55.97 54.87 2f3l s LYS 13 Cb -0.10 -2.97 0.27 0.00 -0.52 0.00 0.00 37.83 34.52 2f3l s LYS 13 CO 0.34 -0.83 1.02 1.28 -0.92 0.00 0.00 175.35 176.24 2f3l n LEU 14 N 4.38 4.75 -4.71 3.17 4.77 0.41 -4.99 117.00 124.79 2f3l n LEU 14 Ca -0.02 -5.38 -0.40 0.00 -0.03 0.00 0.00 56.01 50.18 2f3l n LEU 14 Cb 0.42 -0.87 -0.05 0.00 -2.33 0.00 0.00 43.42 40.59 2f3l n LEU 14 CO 0.20 1.96 0.41 -0.63 -1.33 0.00 0.00 177.39 178.00 2f3l s ILE 15 N -2.72 5.03 -1.82 -0.08 1.09 -1.26 -4.01 121.20 117.43 2f3l s ILE 15 Ca 0.37 1.41 0.00 0.00 -1.10 0.00 0.00 60.65 61.34 2f3l s ILE 15 Cb 0.12 -4.03 0.00 0.00 -1.06 0.00 0.00 42.46 37.50 2f3l s ILE 15 CO 0.02 0.21 0.00 0.61 -0.10 0.00 0.00 174.94 175.68 2f3l n GLY 16 N 3.23 0.58 3.85 6.18 0.00 -0.27 -4.91 105.19 113.85 2f3l n GLY 16 Ca -0.01 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2f3l n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2f3l s GLU 17 N -4.38 3.98 -0.40 1.61 2.56 -1.26 -4.83 118.70 115.98 2f3l s GLU 17 Ca 0.00 0.75 -0.08 0.00 0.00 0.00 0.00 54.97 55.64 2f3l s GLU 17 Cb 0.00 -2.32 0.07 0.00 2.00 0.00 0.00 34.13 33.88 2f3l s GLU 17 CO 0.00 0.00 0.23 0.34 -0.56 0.00 0.00 175.26 175.27 2f3l s ASP 18 N -2.61 5.57 -0.19 -1.70 2.15 -1.26 -0.51 116.67 118.12 2f3l s ASP 18 Ca 0.56 -1.45 0.16 0.00 0.43 0.00 0.00 52.55 52.25 2f3l s ASP 18 Cb -0.10 -1.96 0.46 0.00 -0.30 0.00 0.00 42.92 41.02 2f3l s ASP 18 CO 0.22 -0.50 1.35 0.49 -0.17 0.00 0.00 175.17 176.57 2f3l n PHE 19 N 4.89 0.68 -1.97 -5.34 3.01 0.13 -4.98 117.46 113.88 2f3l n PHE 19 Ca -0.10 -1.05 -0.41 0.00 1.01 0.00 0.00 57.45 56.90 2f3l n PHE 19 Cb 0.43 -0.30 -0.02 0.00 -0.01 0.00 0.00 39.48 39.58 2f3l n PHE 19 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2f3l s SER 20 N -2.33 6.60 0.00 4.37 1.04 -0.85 -2.53 113.70 119.99 2f3l s SER 20 Ca 0.40 2.73 0.00 0.00 0.48 0.00 0.00 55.95 59.56 2f3l s SER 20 Cb 0.34 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.83 2f3l s SER 20 CO 0.05 -0.74 0.00 0.61 0.98 0.00 0.00 173.24 174.15 2f3l n GLY 21 N 2.06 0.53 3.84 7.32 0.00 -0.59 -4.91 105.19 113.45 2f3l n GLY 21 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 2f3l n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f3l s LYS 22 N -0.49 4.07 -0.48 1.61 1.02 -1.05 -4.78 119.74 119.64 2f3l s LYS 22 Ca 0.00 0.83 -0.25 0.00 0.02 0.00 0.00 55.97 56.57 2f3l s LYS 22 Cb 0.00 -2.33 0.03 0.00 -0.52 0.00 0.00 37.83 35.01 2f3l s LYS 22 CO 0.00 0.07 0.91 0.45 -0.92 0.00 0.00 175.35 175.86 2f3l s SER 23 N -2.31 6.45 -0.28 2.83 0.15 -1.26 -1.41 113.70 117.87 2f3l s SER 23 Ca 0.57 -0.03 0.10 0.00 0.70 0.00 0.00 55.95 57.29 2f3l s SER 23 Cb -0.10 -2.44 0.47 0.00 -1.71 0.00 0.00 66.02 62.24 2f3l s SER 23 CO 0.17 -1.08 1.18 0.18 1.20 0.00 0.00 173.24 174.89 2f3l n LEU 24 N 7.18 4.20 -4.65 3.45 7.99 0.55 -4.97 117.00 130.75 2f3l n LEU 24 Ca 0.05 -4.38 -0.47 0.00 -0.01 0.00 0.00 56.01 51.20 2f3l n LEU 24 Cb 0.48 -0.21 -0.04 0.00 -0.11 0.00 0.00 43.42 43.54 2f3l n LEU 24 CO 0.63 1.87 1.07 0.41 -1.51 0.00 0.00 177.39 179.87 2f3l n THR 25 N -0.70 0.32 -1.22 -5.08 -1.04 -1.12 -1.63 114.28 103.81 2f3l n THR 25 Ca 0.36 -0.08 -0.09 0.00 -2.04 0.00 0.00 64.05 62.20 2f3l n THR 25 Cb 0.93 -1.38 -0.04 0.00 -1.82 0.00 0.00 70.33 68.02 2f3l n THR 25 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2f3l n TYR 26 N 2.75 -0.02 -1.71 -1.42 0.53 -0.71 -4.58 117.16 111.99 2f3l n TYR 26 Ca 0.15 0.00 -0.38 0.00 -1.02 0.00 0.00 57.90 56.65 2f3l n TYR 26 Cb 0.28 -2.54 0.05 0.00 -1.03 0.00 0.00 39.34 36.10 2f3l n TYR 26 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2f3l n ALA 27 N 1.08 1.19 -3.51 -0.72 0.00 -0.65 -4.68 120.51 113.21 2f3l n ALA 27 Ca -0.09 0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2f3l n ALA 27 Cb 0.55 -2.30 -0.17 0.00 0.00 0.00 0.00 19.45 17.54 2f3l n ALA 27 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2f3l s GLN 28 N -2.95 2.37 -0.27 0.00 -0.21 -0.90 -0.52 119.66 117.17 2f3l s GLN 28 Ca 0.75 -0.63 0.02 0.00 0.02 0.00 0.00 55.36 55.52 2f3l s GLN 28 Cb -0.41 -1.93 0.07 0.00 1.00 0.00 0.00 33.01 31.74 2f3l s GLN 28 CO 0.47 0.02 -0.02 -0.06 -2.12 0.00 0.00 175.29 173.57 2f3l s PHE 29 N 0.74 2.80 -0.20 0.91 0.40 0.47 -0.06 117.98 123.05 2f3l s PHE 29 Ca -0.11 -2.16 -0.03 0.00 -0.60 0.00 0.00 56.93 54.03 2f3l s PHE 29 Cb -0.16 -1.98 -0.01 0.00 0.51 0.00 0.00 43.02 41.39 2f3l s PHE 29 CO 0.02 -0.85 -0.07 0.99 0.70 0.00 0.00 175.22 176.01 2f3l s THR 30 N 1.25 3.24 -1.39 0.64 2.01 0.07 -0.84 115.64 120.62 2f3l s THR 30 Ca -0.01 -0.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.43 2f3l s THR 30 Cb -0.19 -2.45 0.01 0.00 0.01 0.00 0.00 72.50 69.88 2f3l s THR 30 CO -0.09 0.45 0.56 -3.20 -0.69 0.00 0.00 174.62 171.65 2f3l n ASN 31 N 4.54 -0.93 -4.48 3.53 4.05 0.28 -1.72 115.26 120.53 2f3l n ASN 31 Ca -0.18 -0.93 -0.33 0.00 0.45 0.00 0.00 54.58 53.59 2f3l n ASN 31 Cb 0.51 -3.44 -0.13 0.00 1.23 0.00 0.00 39.78 37.95 2f3l n ASN 31 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2f3l s ALA 32 N -3.80 2.68 -0.38 5.20 0.00 -1.26 -2.25 121.76 121.95 2f3l s ALA 32 Ca 0.06 -1.00 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 2f3l s ALA 32 Cb -0.03 -0.96 0.01 0.00 0.00 0.00 0.00 23.12 22.13 2f3l s ALA 32 CO 0.86 0.56 0.44 0.34 0.00 0.00 0.00 175.76 177.96 2f3l s ASP 33 N -0.82 6.22 -0.21 0.00 -1.08 -0.41 -1.92 116.67 118.45 2f3l s ASP 33 Ca 0.12 -0.39 0.14 0.00 -0.52 0.00 0.00 52.55 51.90 2f3l s ASP 33 Cb -0.11 -2.23 0.50 0.00 -1.46 0.00 0.00 42.92 39.63 2f3l s ASP 33 CO 0.01 -0.50 1.41 0.18 0.52 0.00 0.00 175.17 176.80 2f3l n LEU 34 N 5.60 3.84 -4.56 -1.34 4.77 0.14 -0.44 117.00 125.00 2f3l n LEU 34 Ca -0.07 -3.27 -0.52 0.00 -0.03 0.00 0.00 56.01 52.12 2f3l n LEU 34 Cb 0.48 -0.57 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 2f3l n LEU 34 CO 0.44 0.86 0.71 0.41 -1.33 0.00 0.00 177.39 178.49 2f3l n THR 35 N -0.80 0.47 -1.45 -5.08 -1.04 -1.21 -1.49 114.28 103.68 2f3l n THR 35 Ca 0.25 -0.12 -0.16 0.00 -2.04 0.00 0.00 64.05 61.98 2f3l n THR 35 Cb 0.92 -0.62 -0.07 0.00 -1.82 0.00 0.00 70.33 68.74 2f3l n THR 35 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2f3l n ASP 36 N 2.10 -4.56 -4.84 8.00 10.43 -0.02 -1.11 116.55 126.55 2f3l n ASP 36 Ca 0.17 0.40 -0.31 0.00 2.57 0.00 0.00 54.79 57.62 2f3l n ASP 36 Cb 0.19 -4.01 0.01 0.00 1.84 0.00 0.00 41.12 39.15 2f3l n ASP 36 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 2f3l s SER 37 N -2.40 6.06 -0.29 -2.24 0.01 -0.55 -3.40 113.70 110.89 2f3l s SER 37 Ca 0.00 1.55 -0.03 0.00 1.31 0.00 0.00 55.95 58.78 2f3l s SER 37 Cb 0.00 -2.49 0.03 0.00 0.21 0.00 0.00 66.02 63.77 2f3l s SER 37 CO 0.00 -0.98 0.01 0.21 0.41 0.00 0.00 173.24 172.89 2f3l s ASN 38 N -3.67 4.82 -0.15 2.44 3.84 0.33 -0.77 114.94 121.78 2f3l s ASN 38 Ca 0.58 -1.05 0.18 0.00 0.21 0.00 0.00 52.86 52.77 2f3l s ASN 38 Cb -0.12 -1.75 0.32 0.00 -0.55 0.00 0.00 41.25 39.15 2f3l s ASN 38 CO 0.47 -0.22 1.17 0.49 -2.79 0.00 0.00 177.10 176.22 2f3l n PHE 39 N 4.70 0.02 -1.78 0.43 3.72 0.18 0.18 117.46 124.92 2f3l n PHE 39 Ca -0.14 -1.08 -0.42 0.00 -0.05 0.00 0.00 57.45 55.76 2f3l n PHE 39 Cb 0.45 -0.17 -0.02 0.00 -0.94 0.00 0.00 39.48 38.80 2f3l n PHE 39 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2f3l s SER 40 N -2.92 6.38 -1.23 4.37 1.04 -0.92 -1.78 113.70 118.64 2f3l s SER 40 Ca 0.33 2.93 0.00 0.00 0.48 0.00 0.00 55.95 59.69 2f3l s SER 40 Cb 0.30 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.79 2f3l s SER 40 CO 0.01 -0.92 0.00 -0.62 0.98 0.00 0.00 173.24 172.69 2f3l n GLU 41 N 2.52 -1.36 -2.86 4.02 -0.58 -0.41 -1.55 120.64 120.43 2f3l n GLU 41 Ca 0.10 0.88 -0.32 0.00 -0.42 0.00 0.00 57.16 57.39 2f3l n GLU 41 Cb 0.37 -5.12 -0.05 0.00 -0.57 0.00 0.00 31.44 26.07 2f3l n GLU 41 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2f3l s ALA 42 N -2.15 3.22 -0.63 0.62 0.00 -0.74 -3.68 121.76 118.40 2f3l s ALA 42 Ca 0.00 0.08 -0.17 0.00 0.00 0.00 0.00 51.96 51.87 2f3l s ALA 42 Cb 0.00 -2.89 0.14 0.00 0.00 0.00 0.00 23.12 20.36 2f3l s ALA 42 CO 0.00 0.10 0.66 0.34 0.00 0.00 0.00 175.76 176.86 2f3l s ASP 43 N -2.63 6.31 -0.31 0.00 -1.08 -0.50 -1.92 116.67 116.55 2f3l s ASP 43 Ca 0.56 -1.83 0.09 0.00 -0.52 0.00 0.00 52.55 50.85 2f3l s ASP 43 Cb -0.10 -2.26 0.57 0.00 -1.46 0.00 0.00 42.92 39.68 2f3l s ASP 43 CO 0.23 -0.92 1.59 0.18 0.52 0.00 0.00 175.17 176.76 2f3l n LEU 44 N 5.52 4.83 -4.68 -1.34 4.77 -0.46 -0.33 117.00 125.31 2f3l n LEU 44 Ca -0.05 -3.54 -0.45 0.00 -0.03 0.00 0.00 56.01 51.93 2f3l n LEU 44 Cb 0.43 -0.67 -0.04 0.00 -2.33 0.00 0.00 43.42 40.80 2f3l n LEU 44 CO 0.52 1.06 1.29 0.54 -1.33 0.00 0.00 177.39 179.47 2f3l n ARG 45 N -0.91 2.35 -1.00 3.23 1.74 -0.86 -1.22 116.66 120.00 2f3l n ARG 45 Ca 0.37 0.85 -0.00 0.00 -0.77 0.00 0.00 57.85 58.30 2f3l n ARG 45 Cb 1.18 -2.66 -0.00 0.00 -1.02 0.00 0.00 32.46 29.96 2f3l n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f3l n GLY 46 N 3.71 0.28 3.77 -0.13 0.00 -0.42 -1.75 105.19 110.66 2f3l n GLY 46 Ca 0.17 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2f3l n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3l s ALA 47 N -1.55 2.52 -0.11 4.61 0.00 -0.35 -4.12 121.76 122.75 2f3l s ALA 47 Ca 0.00 0.57 0.02 0.00 0.00 0.00 0.00 51.96 52.55 2f3l s ALA 47 Cb 0.00 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.82 2f3l s ALA 47 CO 0.00 -1.17 -0.17 0.08 0.00 0.00 0.00 175.76 174.50 2f3l s VAL 48 N -2.27 1.61 -0.23 0.00 1.01 0.32 -1.14 120.40 119.69 2f3l s VAL 48 Ca 0.67 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 2f3l s VAL 48 Cb -0.21 -1.46 0.02 0.00 0.00 0.00 0.00 36.38 34.74 2f3l s VAL 48 CO 0.39 0.46 -0.09 -0.36 0.00 0.00 0.00 175.10 175.51 2f3l s PHE 49 N 0.91 3.02 -0.13 5.22 0.40 0.33 -0.39 117.98 127.33 2f3l s PHE 49 Ca -0.08 -1.57 0.00 0.00 -0.60 0.00 0.00 56.93 54.69 2f3l s PHE 49 Cb -0.15 -2.03 0.02 0.00 0.51 0.00 0.00 43.02 41.37 2f3l s PHE 49 CO -0.01 -0.74 -0.12 1.21 0.70 0.00 0.00 175.22 176.27 2f3l s ASN 50 N 1.32 2.49 -1.55 1.36 3.04 -0.02 -0.89 114.94 120.68 2f3l s ASN 50 Ca 0.01 -0.41 -0.03 0.00 0.04 0.00 0.00 52.86 52.47 2f3l s ASN 50 Cb -0.16 -1.05 0.01 0.00 -1.54 0.00 0.00 41.25 38.52 2f3l s ASN 50 CO -0.06 -0.08 0.31 0.61 -3.04 0.00 0.00 177.10 174.84 2f3l n GLY 51 N 4.84 -0.51 3.78 1.21 0.00 -0.10 -0.55 105.19 113.86 2f3l n GLY 51 Ca -0.15 0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 2f3l n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2f3l s SER 52 N -2.39 5.16 -0.19 1.61 0.01 -1.24 -3.33 113.70 113.33 2f3l s SER 52 Ca 0.17 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2f3l s SER 52 Cb -0.08 -1.11 0.05 0.00 0.21 0.00 0.00 66.02 65.08 2f3l s SER 52 CO 0.21 -0.13 -0.06 0.00 0.41 0.00 0.00 173.24 173.67 2f3l s ALA 53 N -2.25 1.71 -0.77 1.44 0.00 -0.81 -1.81 121.76 119.28 2f3l s ALA 53 Ca 0.35 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 51.26 2f3l s ALA 53 Cb -0.06 -1.24 0.36 0.00 0.00 0.00 0.00 23.12 22.17 2f3l s ALA 53 CO 0.24 -0.91 1.67 1.28 0.00 0.00 0.00 175.76 178.04 2f3l n LEU 54 N 4.78 6.55 -4.65 0.00 4.32 -0.09 -0.69 117.00 127.22 2f3l n LEU 54 Ca -0.13 -5.13 -0.42 0.00 -0.02 0.00 0.00 56.01 50.31 2f3l n LEU 54 Cb 0.46 -0.90 -0.03 0.00 -1.62 0.00 0.00 43.42 41.34 2f3l n LEU 54 CO 0.18 1.99 1.51 -0.63 -1.22 0.00 0.00 177.39 179.22 2f3l s ILE 55 N -4.96 3.31 -1.41 -0.08 -1.09 -1.26 -2.30 121.20 113.42 2f3l s ILE 55 Ca 0.48 0.37 0.00 0.00 -2.23 0.00 0.00 60.65 59.27 2f3l s ILE 55 Cb 0.36 -3.26 0.00 0.00 -1.58 0.00 0.00 42.46 37.98 2f3l s ILE 55 CO -0.28 -0.06 0.00 0.61 -1.23 0.00 0.00 174.94 173.99 2f3l n GLY 56 N 4.50 1.35 3.79 6.18 0.00 -0.69 -0.84 105.19 119.48 2f3l n GLY 56 Ca 0.20 -0.21 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2f3l n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3l s ALA 57 N -2.35 2.91 -0.35 4.61 0.00 -0.97 -4.05 121.76 121.56 2f3l s ALA 57 Ca 0.00 0.71 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 2f3l s ALA 57 Cb 0.00 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 2f3l s ALA 57 CO 0.00 -0.41 0.23 0.34 0.00 0.00 0.00 175.76 175.91 2f3l s ASP 58 N -1.76 5.92 -0.16 0.00 -1.08 0.05 -1.01 116.67 118.63 2f3l s ASP 58 Ca 0.65 -0.57 0.14 0.00 -0.52 0.00 0.00 52.55 52.26 2f3l s ASP 58 Cb -0.21 -2.10 0.36 0.00 -1.46 0.00 0.00 42.92 39.51 2f3l s ASP 58 CO 0.25 -0.27 1.18 0.18 0.52 0.00 0.00 175.17 177.03 2f3l n LEU 59 N 5.08 2.42 -4.69 -1.34 4.32 0.52 0.50 117.00 123.80 2f3l n LEU 59 Ca -0.13 -3.43 -0.51 0.00 -0.02 0.00 0.00 56.01 51.93 2f3l n LEU 59 Cb 0.49 -0.45 -0.06 0.00 -1.62 0.00 0.00 43.42 41.78 2f3l n LEU 59 CO 0.37 1.06 1.41 1.57 -1.22 0.00 0.00 177.39 180.58 2f3l n HIS 60 N -1.15 2.22 -0.95 -1.77 -0.00 -0.95 -1.12 115.22 111.49 2f3l n HIS 60 Ca 0.17 0.19 0.00 0.00 0.46 0.00 0.00 57.72 58.54 2f3l n HIS 60 Cb 0.69 -2.59 0.00 0.00 -0.12 0.00 0.00 29.99 27.97 2f3l n HIS 60 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2f3l n GLY 61 N 4.25 0.34 3.78 1.57 0.00 -0.67 -1.28 105.19 113.18 2f3l n GLY 61 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 2f3l n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3l s ALA 62 N -1.79 2.70 -0.38 4.61 0.00 -0.28 -4.03 121.76 122.59 2f3l s ALA 62 Ca 0.00 0.67 -0.07 0.00 0.00 0.00 0.00 51.96 52.56 2f3l s ALA 62 Cb 0.00 -3.31 0.07 0.00 0.00 0.00 0.00 23.12 19.87 2f3l s ALA 62 CO 0.00 -0.77 0.19 0.34 0.00 0.00 0.00 175.76 175.52 2f3l s ASP 63 N -2.09 5.44 -0.29 0.00 -1.08 -0.81 -1.08 116.67 116.76 2f3l s ASP 63 Ca 0.69 -1.43 0.10 0.00 -0.52 0.00 0.00 52.55 51.39 2f3l s ASP 63 Cb -0.21 -1.91 0.54 0.00 -1.46 0.00 0.00 42.92 39.88 2f3l s ASP 63 CO 0.29 -0.45 1.53 0.18 0.52 0.00 0.00 175.17 177.24 2f3l n LEU 64 N 4.82 4.49 -4.65 -1.34 4.77 0.13 -1.35 117.00 123.87 2f3l n LEU 64 Ca -0.10 -3.60 -0.45 0.00 -0.03 0.00 0.00 56.01 51.83 2f3l n LEU 64 Cb 0.43 -0.65 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 2f3l n LEU 64 CO 0.35 1.11 0.91 0.41 -1.33 0.00 0.00 177.39 178.84 2f3l n THR 65 N -0.99 1.18 -1.48 -5.08 -1.04 -1.16 -1.05 114.28 104.66 2f3l n THR 65 Ca 0.35 -0.30 -0.17 0.00 -2.04 0.00 0.00 64.05 61.90 2f3l n THR 65 Cb 1.11 -1.34 -0.07 0.00 -1.82 0.00 0.00 70.33 68.21 2f3l n THR 65 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2f3l n ASN 66 N 1.86 -5.46 -4.79 8.00 5.03 -0.33 -1.30 115.26 118.27 2f3l n ASN 66 Ca 0.11 0.41 -0.29 0.00 0.87 0.00 0.00 54.58 55.68 2f3l n ASN 66 Cb 0.31 -4.43 0.11 0.00 -1.02 0.00 0.00 39.78 34.76 2f3l n ASN 66 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2f3l s GLY 67 N -2.67 1.60 -0.03 7.41 0.00 -0.21 -4.05 107.32 109.37 2f3l s GLY 67 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 44.72 44.38 2f3l s GLY 67 CO 0.00 0.16 0.06 1.08 0.00 0.00 0.00 173.10 174.39 2f3l s LEU 68 N -5.92 1.14 -0.01 0.66 1.43 -0.29 -1.65 118.68 114.04 2f3l s LEU 68 Ca 0.62 0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.84 2f3l s LEU 68 Cb -0.15 0.06 -0.00 0.00 0.03 0.00 0.00 46.19 46.13 2f3l s LEU 68 CO 0.54 -0.11 -0.06 0.00 0.23 0.00 0.00 176.35 176.95 2f3l s ALA 69 N 0.91 0.51 -0.06 4.21 0.00 -0.66 -0.51 121.76 126.16 2f3l s ALA 69 Ca -0.07 -0.22 -0.03 0.00 0.00 0.00 0.00 51.96 51.64 2f3l s ALA 69 Cb -0.10 -0.17 0.04 0.00 0.00 0.00 0.00 23.12 22.88 2f3l s ALA 69 CO -0.03 0.10 0.13 -0.47 0.00 0.00 0.00 175.76 175.49 2f3l s TYR 70 N 0.03 -0.14 -1.45 0.00 5.04 -0.07 -4.78 117.35 115.98 2f3l s TYR 70 Ca 0.00 0.43 -0.06 0.00 -2.44 0.00 0.00 57.07 55.00 2f3l s TYR 70 Cb -0.04 -0.09 0.04 0.00 0.35 0.00 0.00 41.96 42.22 2f3l s TYR 70 CO -0.00 -0.15 0.70 1.28 -1.34 0.00 0.00 175.55 176.04 2f3l n LEU 71 N 4.13 -2.52 -4.46 6.97 4.77 -0.87 -0.92 117.00 124.09 2f3l n LEU 71 Ca -0.26 -0.89 -0.25 0.00 -0.03 0.00 0.00 56.01 54.58 2f3l n LEU 71 Cb 0.52 -2.43 -0.11 0.00 -2.33 0.00 0.00 43.42 39.07 2f3l n LEU 71 CO 0.19 0.42 -0.50 -0.89 -1.33 0.00 0.00 177.39 175.28 2f3l s THR 72 N -3.61 2.47 -0.08 -5.08 2.01 -1.15 -2.87 115.64 107.33 2f3l s THR 72 Ca 0.28 -2.22 0.02 0.00 0.31 0.00 0.00 61.69 60.08 2f3l s THR 72 Cb -0.14 -2.25 0.01 0.00 0.01 0.00 0.00 72.50 70.13 2f3l s THR 72 CO 0.85 -0.27 -0.15 -0.55 -0.69 0.00 0.00 174.62 173.81 2f3l s SER 73 N -3.15 2.17 -0.29 3.53 0.15 -0.75 -1.92 113.70 113.45 2f3l s SER 73 Ca 0.26 -0.37 0.09 0.00 0.70 0.00 0.00 55.95 56.63 2f3l s SER 73 Cb -0.06 -0.99 0.52 0.00 -1.71 0.00 0.00 66.02 63.78 2f3l s SER 73 CO 0.13 0.04 1.50 0.49 1.20 0.00 0.00 173.24 176.60 2f3l n PHE 74 N 3.91 1.23 -1.73 3.44 3.01 0.93 -0.92 117.46 127.33 2f3l n PHE 74 Ca -0.21 -1.54 -0.42 0.00 1.01 0.00 0.00 57.45 56.29 2f3l n PHE 74 Cb 0.52 -0.51 -0.03 0.00 -0.01 0.00 0.00 39.48 39.45 2f3l n PHE 74 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2f3l s LYS 75 N -3.21 4.14 0.00 -1.08 1.02 -1.25 -1.91 119.74 117.45 2f3l s LYS 75 Ca 0.45 2.58 0.00 0.00 0.02 0.00 0.00 55.97 59.03 2f3l s LYS 75 Cb 0.41 -3.52 0.00 0.00 -0.52 0.00 0.00 37.83 34.20 2f3l s LYS 75 CO 0.02 -0.82 0.00 0.41 -0.92 0.00 0.00 175.35 174.03 2f3l n GLY 76 N 4.18 0.65 3.78 -3.33 0.00 -0.65 -1.70 105.19 108.12 2f3l n GLY 76 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2f3l n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3l s ALA 77 N -2.87 2.60 -0.45 4.61 0.00 -0.80 -4.01 121.76 120.84 2f3l s ALA 77 Ca 0.00 0.60 -0.13 0.00 0.00 0.00 0.00 51.96 52.43 2f3l s ALA 77 Cb 0.00 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.88 2f3l s ALA 77 CO 0.00 -1.01 0.34 0.34 0.00 0.00 0.00 175.76 175.43 2f3l s ASP 78 N -2.36 5.95 -0.13 0.00 -1.08 -0.18 -1.27 116.67 117.60 2f3l s ASP 78 Ca 0.68 -1.41 0.15 0.00 -0.52 0.00 0.00 52.55 51.45 2f3l s ASP 78 Cb -0.20 -2.11 0.50 0.00 -1.46 0.00 0.00 42.92 39.65 2f3l s ASP 78 CO 0.36 -0.61 1.42 0.18 0.52 0.00 0.00 175.17 177.03 2f3l n LEU 79 N 5.09 3.82 -4.73 -1.34 4.77 0.63 -0.36 117.00 124.88 2f3l n LEU 79 Ca -0.12 -2.68 -0.42 0.00 -0.03 0.00 0.00 56.01 52.76 2f3l n LEU 79 Cb 0.43 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2f3l n LEU 79 CO 0.44 0.70 1.20 0.35 -1.33 0.00 0.00 177.39 178.75 2f3l n THR 80 N -0.00 0.99 -0.82 -5.08 -2.24 -0.92 -1.60 114.28 104.61 2f3l n THR 80 Ca 0.19 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2f3l n THR 80 Cb 0.78 -1.86 0.00 0.00 -2.10 0.00 0.00 70.33 67.15 2f3l n THR 80 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2f3l n ASN 81 N 2.19 -3.26 -4.80 3.42 3.02 -0.56 -1.66 115.26 113.60 2f3l n ASN 81 Ca 0.09 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.31 2f3l n ASN 81 Cb 0.36 -2.72 0.00 0.00 -0.61 0.00 0.00 39.78 36.81 2f3l n ASN 81 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2f3l s ALA 82 N -1.24 2.76 -0.26 5.41 0.00 -0.62 -3.99 121.76 123.82 2f3l s ALA 82 Ca 0.00 0.44 -0.04 0.00 0.00 0.00 0.00 51.96 52.36 2f3l s ALA 82 Cb 0.00 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.89 2f3l s ALA 82 CO 0.00 -0.73 -0.01 0.08 0.00 0.00 0.00 175.76 175.10 2f3l s VAL 83 N -2.36 3.34 -0.23 0.00 1.01 -0.24 -1.46 120.40 120.46 2f3l s VAL 83 Ca 0.64 -0.79 0.10 0.00 0.00 0.00 0.00 61.98 61.93 2f3l s VAL 83 Cb -0.16 -2.67 0.43 0.00 0.00 0.00 0.00 36.38 33.98 2f3l s VAL 83 CO 0.34 0.21 1.24 0.18 0.00 0.00 0.00 175.10 177.07 2f3l n LEU 84 N 4.76 3.10 -4.63 3.92 4.32 0.10 0.20 117.00 128.77 2f3l n LEU 84 Ca -0.16 -4.00 -0.55 0.00 -0.02 0.00 0.00 56.01 51.28 2f3l n LEU 84 Cb 0.48 -0.52 -0.07 0.00 -1.62 0.00 0.00 43.42 41.70 2f3l n LEU 84 CO 0.29 1.48 1.01 0.41 -1.22 0.00 0.00 177.39 179.36 2f3l n THR 85 N -1.07 0.09 -1.60 -5.08 -1.04 -1.22 -1.20 114.28 103.17 2f3l n THR 85 Ca 0.23 -0.02 -0.17 0.00 -2.04 0.00 0.00 64.05 62.05 2f3l n THR 85 Cb 0.75 -0.86 -0.07 0.00 -1.82 0.00 0.00 70.33 68.33 2f3l n THR 85 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2f3l n GLU 86 N 3.37 -1.44 -2.50 -2.82 1.02 0.34 -1.19 120.64 117.43 2f3l n GLU 86 Ca 0.22 1.01 -0.41 0.00 -0.02 0.00 0.00 57.16 57.96 2f3l n GLU 86 Cb 0.15 -5.37 -0.04 0.00 -0.02 0.00 0.00 31.44 26.16 2f3l n GLU 86 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2f3l s ALA 87 N -2.52 3.39 0.21 0.62 0.00 -0.34 -4.33 121.76 118.79 2f3l s ALA 87 Ca 0.00 0.85 0.07 0.00 0.00 0.00 0.00 51.96 52.88 2f3l s ALA 87 Cb 0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2f3l s ALA 87 CO 0.00 -0.17 0.11 0.42 0.00 0.00 0.00 175.76 176.12 2f3l s ILE 88 N -0.77 4.18 -1.54 0.00 1.01 -0.66 -0.83 121.20 122.59 2f3l s ILE 88 Ca 0.46 -1.38 -0.20 0.00 0.00 0.00 0.00 60.65 59.54 2f3l s ILE 88 Cb -0.31 -3.18 0.20 0.00 0.01 0.00 0.00 42.46 39.17 2f3l s ILE 88 CO 0.38 -0.23 0.49 0.54 0.00 0.00 0.00 174.94 176.12 2f3l n ARG 91 N -0.67 -0.80 -4.74 2.79 5.12 -1.26 -1.66 116.66 115.44 2f3l n ARG 91 Ca -0.08 0.11 -0.27 0.00 -1.93 0.00 0.00 57.85 55.69 2f3l n ARG 91 Cb 0.56 -3.93 -0.17 0.00 -1.16 0.00 0.00 32.46 27.77 2f3l n ARG 91 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2f3l s THR 92 N -2.85 1.38 -0.00 0.55 2.01 -1.26 -2.06 115.64 113.41 2f3l s THR 92 Ca 0.69 -0.62 -0.09 0.00 0.31 0.00 0.00 61.69 61.97 2f3l s THR 92 Cb -0.40 -1.24 -0.05 0.00 0.01 0.00 0.00 72.50 70.82 2f3l s THR 92 CO 0.84 0.41 0.31 -0.54 -0.69 0.00 0.00 174.62 174.95 2f3l s LYS 93 N 0.60 3.67 -0.12 4.92 1.02 -0.81 -4.81 119.74 124.23 2f3l s LYS 93 Ca -0.15 0.09 0.14 0.00 0.02 0.00 0.00 55.97 56.07 2f3l s LYS 93 Cb -0.16 -3.12 0.28 0.00 -0.52 0.00 0.00 37.83 34.30 2f3l s LYS 93 CO 0.05 0.67 1.14 1.19 -0.92 0.00 0.00 175.35 177.47 2f3l n PHE 94 N 1.41 0.00 -1.67 3.18 3.01 -1.26 -0.05 117.46 122.08 2f3l n PHE 94 Ca -0.13 -0.89 -0.48 0.00 1.01 0.00 0.00 57.45 56.95 2f3l n PHE 94 Cb 0.53 -0.15 -0.05 0.00 -0.01 0.00 0.00 39.48 39.80 2f3l n PHE 94 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2f3l n ASP 95 N -0.99 3.08 -0.07 4.37 9.92 -1.26 -1.48 116.55 130.12 2f3l n ASP 95 Ca 0.13 1.04 -0.01 0.00 -0.53 0.00 0.00 54.79 55.42 2f3l n ASP 95 Cb 0.69 -1.36 -0.00 0.00 -0.64 0.00 0.00 41.12 39.81 2f3l n ASP 95 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2f3l n ASP 96 N 4.85 -4.95 -4.77 -2.24 8.00 -1.26 -1.64 116.55 114.54 2f3l n ASP 96 Ca 0.20 0.02 -0.38 0.00 0.71 0.00 0.00 54.79 55.34 2f3l n ASP 96 Cb 0.27 -2.53 -0.05 0.00 -0.02 0.00 0.00 41.12 38.80 2f3l n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2f3l s ALA 97 N -1.42 3.22 -0.30 2.24 0.00 -0.55 -3.94 121.76 121.01 2f3l s ALA 97 Ca 0.00 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 52.46 2f3l s ALA 97 Cb 0.00 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.85 2f3l s ALA 97 CO 0.00 -0.11 0.74 0.15 0.00 0.00 0.00 175.76 176.54 2f3l s LYS 98 N -2.02 3.96 -0.01 0.00 1.02 -0.40 -4.93 119.74 117.36 2f3l s LYS 98 Ca 0.51 0.52 0.05 0.00 0.02 0.00 0.00 55.97 57.07 2f3l s LYS 98 Cb -0.25 -3.72 0.14 0.00 -0.52 0.00 0.00 37.83 33.48 2f3l s LYS 98 CO 0.31 -0.63 1.11 0.44 -0.92 0.00 0.00 175.35 175.66 2f3l n ILE 99 N 5.46 1.10 -1.69 2.17 -5.35 -1.26 -0.27 119.36 119.52 2f3l n ILE 99 Ca 0.02 -1.10 -0.51 0.00 -0.27 0.00 0.00 62.75 60.88 2f3l n ILE 99 Cb 0.48 0.43 -0.06 0.00 -1.74 0.00 0.00 39.64 38.76 2f3l n ILE 99 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 2f3l n THR 100 N -0.22 0.49 -0.28 7.28 -1.04 -1.26 -0.74 114.28 118.51 2f3l n THR 100 Ca 0.05 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 2f3l n THR 100 Cb 0.35 -1.65 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 2f3l n THR 100 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2f3l n GLY 101 N 4.34 1.57 3.76 3.41 0.00 -0.81 -1.50 105.19 115.96 2f3l n GLY 101 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 2f3l n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3l s ALA 102 N -2.97 2.63 -0.32 4.61 0.00 0.08 -3.27 121.76 122.53 2f3l s ALA 102 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 51.96 52.92 2f3l s ALA 102 Cb 0.00 -3.42 0.07 0.00 0.00 0.00 0.00 23.12 19.77 2f3l s ALA 102 CO 0.00 -1.00 0.02 0.34 0.00 0.00 0.00 175.76 175.12 2f3l s ASP 103 N -1.62 4.83 -0.33 0.00 -1.08 -0.54 -4.14 116.67 113.80 2f3l s ASP 103 Ca 0.75 -1.63 0.09 0.00 -0.52 0.00 0.00 52.55 51.24 2f3l s ASP 103 Cb -0.28 -1.68 0.75 0.00 -1.46 0.00 0.00 42.92 40.25 2f3l s ASP 103 CO 0.31 -0.32 1.82 0.49 0.52 0.00 0.00 175.17 178.00 2f3l n PHE 104 N 4.49 2.52 -1.70 -5.34 3.01 -1.26 -0.73 117.46 118.46 2f3l n PHE 104 Ca -0.08 -1.22 -0.54 0.00 1.01 0.00 0.00 57.45 56.62 2f3l n PHE 104 Cb 0.42 -0.71 -0.06 0.00 -0.01 0.00 0.00 39.48 39.12 2f3l n PHE 104 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2f3l n SER 105 N -0.16 2.68 -0.38 4.37 7.64 -1.25 -0.76 113.62 125.78 2f3l n SER 105 Ca 0.42 1.05 -0.05 0.00 1.01 0.00 0.00 58.87 61.30 2f3l n SER 105 Cb 1.41 -1.22 -0.02 0.00 -1.01 0.00 0.00 64.21 63.37 2f3l n SER 105 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2f3l n LEU 106 N 5.60 0.25 -4.78 -3.43 4.77 -1.26 -0.50 117.00 117.64 2f3l n LEU 106 Ca 0.25 0.12 -0.37 0.00 -0.03 0.00 0.00 56.01 55.98 2f3l n LEU 106 Cb 0.18 -2.27 -0.06 0.00 -2.33 0.00 0.00 43.42 38.94 2f3l n LEU 106 CO 0.78 -0.87 0.68 0.00 -1.33 0.00 0.00 177.39 176.65 2f3l s ALA 107 N -1.57 3.16 -0.30 -1.18 0.00 0.06 -4.09 121.76 117.85 2f3l s ALA 107 Ca 0.00 0.57 -0.07 0.00 0.00 0.00 0.00 51.96 52.46 2f3l s ALA 107 Cb 0.00 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.92 2f3l s ALA 107 CO 0.00 0.05 0.09 0.08 0.00 0.00 0.00 175.76 175.98 2f3l s VAL 108 N -1.67 4.02 0.35 0.00 1.01 -0.01 -4.93 120.40 119.17 2f3l s VAL 108 Ca 0.53 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.90 2f3l s VAL 108 Cb -0.19 -3.08 -0.07 0.00 0.00 0.00 0.00 36.38 33.04 2f3l s VAL 108 CO 0.24 0.07 -0.00 -0.76 0.00 0.00 0.00 175.10 174.65 2f3l s LEU 109 N 1.51 2.58 0.54 3.92 1.43 -1.26 -4.58 118.68 122.81 2f3l s LEU 109 Ca 0.03 -1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 51.61 2f3l s LEU 109 Cb -0.17 -0.71 -0.05 0.00 0.03 0.00 0.00 46.19 45.28 2f3l s LEU 109 CO 0.03 -0.44 1.18 -1.81 0.23 0.00 0.00 176.35 175.54 2f3l s ASP 110 N -3.58 5.64 0.28 2.29 -0.00 -1.26 -4.85 116.67 115.19 2f3l s ASP 110 Ca 0.34 2.33 0.00 0.00 -0.00 0.00 0.00 52.55 55.22 2f3l s ASP 110 Cb 0.07 -2.60 0.51 0.00 -0.00 0.00 0.00 42.92 40.91 2f3l s ASP 110 CO 0.16 -1.28 1.84 1.62 -0.00 0.00 0.00 175.17 177.51 2f3l h VAL 111 N 1.30 0.95 -0.46 -1.27 3.04 -2.00 -1.65 116.25 116.16 2f3l h VAL 111 Ca -0.50 -0.35 -0.04 0.00 -1.01 0.00 0.00 66.70 64.80 2f3l h VAL 111 Cb 1.27 -0.15 -0.02 0.00 -2.01 0.00 0.00 31.29 30.38 2f3l h VAL 111 CO 0.57 0.19 0.15 0.22 -1.01 0.00 0.00 177.57 177.69 2f3l h TYR 112 N 1.02 0.74 -0.35 3.17 3.20 -2.00 -2.53 116.97 120.21 2f3l h TYR 112 Ca 0.48 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 62.25 2f3l h TYR 112 Cb 0.42 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2f3l h TYR 112 CO -0.01 0.66 0.14 0.93 -1.64 0.00 0.00 178.16 178.24 2f3l h GLU 113 N 0.61 0.53 -0.58 1.82 4.39 -1.75 -1.92 114.58 117.68 2f3l h GLU 113 Ca 0.15 -0.10 0.07 0.00 0.34 0.00 0.00 59.36 59.82 2f3l h GLU 113 Cb 0.26 -0.09 -0.06 0.00 -0.10 0.00 0.00 28.75 28.77 2f3l h GLU 113 CO -0.01 0.52 0.27 0.28 -1.16 0.00 0.00 179.01 178.91 2f3l h VAL 114 N 0.42 0.88 -0.34 3.13 2.07 -1.24 0.82 116.25 122.00 2f3l h VAL 114 Ca 0.12 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 2f3l h VAL 114 Cb 0.19 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2f3l h VAL 114 CO -0.01 0.09 0.09 0.44 0.02 0.00 0.00 177.57 178.21 2f3l h ASP 115 N 0.50 0.50 -0.45 0.57 3.45 -1.29 -1.03 116.42 118.67 2f3l h ASP 115 Ca 0.27 -0.22 -0.07 0.00 0.43 0.00 0.00 57.03 57.45 2f3l h ASP 115 Cb 0.25 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 38.87 2f3l h ASP 115 CO -0.22 0.58 0.02 0.11 -1.57 0.00 0.00 179.24 178.16 2f3l h LYS 116 N 0.39 0.78 -0.24 3.56 1.79 -0.99 -3.00 116.57 118.86 2f3l h LYS 116 Ca 0.11 -0.24 -0.09 0.00 -2.18 0.00 0.00 60.65 58.24 2f3l h LYS 116 Cb 0.27 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 2f3l h LYS 116 CO -0.00 0.84 -0.26 -0.07 -1.08 0.00 0.00 179.45 178.88 2f3l h LEU 117 N 0.63 0.45 -1.88 2.94 3.38 -0.80 -2.56 115.31 117.48 2f3l h LEU 117 Ca 0.13 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2f3l h LEU 117 Cb 0.47 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2f3l h LEU 117 CO 0.02 0.70 -0.05 0.00 0.09 0.00 0.00 178.44 179.20 2f3l h ASP 119 N 0.00 0.00 0.00 0.00 3.32 -1.32 -3.30 116.42 115.12 2f3l h ASP 119 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2f3l h ASP 119 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2f3l h ASP 119 CO 0.01 0.12 0.00 -2.11 -1.72 0.00 0.00 179.24 175.54 2f3l n ARG 120 N -3.27 -0.44 -1.70 3.56 1.85 -0.99 -5.08 116.66 110.60 2f3l n ARG 120 Ca 0.00 -0.33 -0.44 0.00 -1.00 0.00 0.00 57.85 56.09 2f3l n ARG 120 Cb 0.37 -0.79 -0.03 0.00 -1.05 0.00 0.00 32.46 30.97 2f3l n ARG 120 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2f3l n ALA 121 N -0.02 2.14 -3.83 2.89 0.00 0.13 -4.94 120.51 116.89 2f3l n ALA 121 Ca 0.00 0.41 -0.08 0.00 0.00 0.00 0.00 53.44 53.77 2f3l n ALA 121 Cb 0.12 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.14 2f3l n ALA 121 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2f3l s ASP 122 N 0.91 -0.11 0.00 0.00 1.47 -1.26 -4.65 116.67 113.03 2f3l s ASP 122 Ca 0.74 -0.90 0.00 0.00 1.18 0.00 0.00 52.55 53.57 2f3l s ASP 122 Cb -0.58 0.80 0.00 0.00 -0.34 0.00 0.00 42.92 42.80 2f3l s ASP 122 CO 0.38 -1.54 0.00 0.61 0.68 0.00 0.00 175.17 175.30 2f3l n GLY 123 N -0.50 -1.05 3.02 2.12 0.00 -1.26 -1.93 105.19 105.59 2f3l n GLY 123 Ca -0.06 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.09 2f3l n GLY 123 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f3l s VAL 124 N -1.78 0.94 -0.09 1.61 1.01 -1.26 -2.27 120.40 118.57 2f3l s VAL 124 Ca 0.00 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 2f3l s VAL 124 Cb 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2f3l s VAL 124 CO 0.00 0.29 1.47 0.21 0.00 0.00 0.00 175.10 177.07 2f3l s ASN 125 N 0.30 6.80 0.54 3.32 3.84 -0.42 -4.66 114.94 124.65 2f3l s ASN 125 Ca -0.06 2.01 0.26 0.00 0.21 0.00 0.00 52.86 55.28 2f3l s ASN 125 Cb -0.11 -2.54 1.51 0.00 -0.55 0.00 0.00 41.25 39.57 2f3l s ASN 125 CO 0.01 -0.84 2.13 -0.65 -2.79 0.00 0.00 177.10 174.97 2f3l h PRO 126 N 8.80 0.00 0.00 0.43 0.11 -1.90 0.29 132.00 139.73 2f3l h PRO 126 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2f3l h PRO 126 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2f3l h PRO 126 CO 0.95 0.08 -1.23 1.63 -0.21 0.00 0.00 178.00 179.22 2f3l n LYS 127 N -3.86 0.39 0.00 1.05 5.02 -1.26 -4.48 118.16 115.02 2f3l n LYS 127 Ca -0.02 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2f3l n LYS 127 Cb 0.17 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 2f3l n LYS 127 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2f3l n THR 128 N -2.09 0.00 -0.95 -0.18 -2.24 -1.16 -5.01 114.28 102.66 2f3l n THR 128 Ca 0.01 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2f3l n THR 128 Cb 0.47 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 2f3l n THR 128 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f3l n GLY 129 N 1.63 0.45 3.83 3.38 0.00 0.10 -5.00 105.19 109.59 2f3l n GLY 129 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2f3l n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f3l s VAL 130 N -2.11 4.92 0.10 1.61 1.01 -1.25 -4.79 120.40 119.89 2f3l s VAL 130 Ca 0.00 0.91 -0.30 0.00 0.00 0.00 0.00 61.98 62.59 2f3l s VAL 130 Cb 0.00 -3.76 -0.06 0.00 0.00 0.00 0.00 36.38 32.56 2f3l s VAL 130 CO 0.00 0.48 1.09 -0.55 0.00 0.00 0.00 175.10 176.12 2f3l s SER 131 N -1.27 7.27 0.16 3.32 0.15 -1.26 -1.30 113.70 120.76 2f3l s SER 131 Ca 0.29 1.95 -0.16 0.00 0.70 0.00 0.00 55.95 58.73 2f3l s SER 131 Cb -0.17 -2.59 0.04 0.00 -1.71 0.00 0.00 66.02 61.59 2f3l s SER 131 CO 0.16 -0.27 1.80 0.74 1.20 0.00 0.00 173.24 176.87 2f3l h THR 132 N 4.18 1.05 -0.67 6.45 2.02 -1.61 0.01 112.91 124.34 2f3l h THR 132 Ca -0.43 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.59 2f3l h THR 132 Cb 1.21 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 2f3l h THR 132 CO 0.75 0.09 0.42 -0.09 0.37 0.00 0.00 175.52 177.06 2f3l h ARG 133 N 0.49 0.90 -0.18 6.66 2.43 -1.82 -2.50 114.38 120.36 2f3l h ARG 133 Ca 0.16 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 59.11 2f3l h ARG 133 Cb -0.00 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 2f3l h ARG 133 CO -0.07 0.63 -0.50 0.93 -1.51 0.00 0.00 179.97 179.45 2f3l h GLU 134 N 0.91 0.50 0.00 0.20 5.08 -1.86 -2.54 114.58 116.87 2f3l h GLU 134 Ca 0.24 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2f3l h GLU 134 Cb -0.06 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 2f3l h GLU 134 CO -0.05 0.89 -0.09 0.66 -1.00 0.00 0.00 179.01 179.42 2f3l h SER 135 N 0.39 0.00 0.38 1.42 4.64 -0.65 -0.44 113.55 119.29 2f3l h SER 135 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2f3l h SER 135 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2f3l h SER 135 CO 0.09 0.09 -0.64 0.18 -0.87 0.00 0.00 176.83 175.68 2f3l n LEU 136 N -3.57 0.63 -3.37 5.97 4.77 -0.97 -3.82 117.00 116.64 2f3l n LEU 136 Ca -0.02 -0.12 -0.19 0.00 -0.03 0.00 0.00 56.01 55.66 2f3l n LEU 136 Cb 0.22 -0.18 0.08 0.00 -2.33 0.00 0.00 43.42 41.21 2f3l n LEU 136 CO 0.29 0.15 0.15 0.54 -1.33 0.00 0.00 177.39 177.19 2f3l n ARG 137 N -1.53 -6.79 0.00 3.23 1.74 -0.18 -5.08 116.66 108.06 2f3l n ARG 137 Ca 0.05 0.80 0.10 0.00 -0.77 0.00 0.00 57.85 58.04 2f3l n ARG 137 Cb 0.34 -5.72 0.61 0.00 -1.02 0.00 0.00 32.46 26.66 2f3l n ARG 137 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11