#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e5l s ARG 3 N 0.00 3.60 -0.03 0.54 0.52 -1.26 -5.10 118.95 117.21 2e5l s ARG 3 Ca 0.00 0.25 -0.27 0.00 -0.52 0.00 0.00 55.73 55.19 2e5l s ARG 3 Cb 0.00 -2.39 0.06 0.00 0.52 0.00 0.00 34.95 33.14 2e5l s ARG 3 CO 0.00 -0.15 0.60 -1.54 0.02 0.00 0.00 175.30 174.23 2e5l s SER 4 N -3.86 -0.55 -0.53 0.23 1.04 -1.26 -5.06 113.70 103.72 2e5l s SER 4 Ca 0.48 0.55 0.07 0.00 0.48 0.00 0.00 55.95 57.53 2e5l s SER 4 Cb -0.10 0.49 0.34 0.00 0.10 0.00 0.00 66.02 66.85 2e5l s SER 4 CO 0.41 -0.59 0.88 0.18 0.98 0.00 0.00 173.24 175.10 2e5l n LEU 5 N 0.93 3.47 0.00 2.42 4.77 -1.26 -5.10 117.00 122.23 2e5l n LEU 5 Ca -0.19 -5.49 0.00 0.00 -0.03 0.00 0.00 56.01 50.30 2e5l n LEU 5 Cb 0.57 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2e5l n LEU 5 CO 0.23 2.32 0.00 2.29 -1.33 0.00 0.00 177.39 180.91 2e5l n LYS 6 N -0.04 0.00 -3.51 3.23 -0.00 -1.26 -3.94 118.16 112.64 2e5l n LYS 6 Ca 0.29 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.31 2e5l n LYS 6 Cb 0.46 0.00 -0.13 0.00 -0.00 0.00 0.00 35.03 35.36 2e5l n LYS 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2e5l s LYS 7 N 0.00 0.52 0.00 -1.58 3.01 -1.26 -5.00 119.74 115.43 2e5l s LYS 7 Ca 0.00 -1.17 0.00 0.00 -1.01 0.00 0.00 55.97 53.79 2e5l s LYS 7 Cb 0.00 -1.37 0.00 0.00 -1.01 0.00 0.00 37.83 35.45 2e5l s LYS 7 CO 0.00 -1.15 0.00 0.41 0.51 0.00 0.00 175.35 175.12 2e5l n GLY 8 N 4.33 -0.05 3.52 -3.33 0.00 -1.25 -5.11 105.19 103.30 2e5l n GLY 8 Ca 0.07 -0.18 -0.56 0.00 0.00 0.00 0.00 46.02 45.35 2e5l n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2e5l n VAL 9 N 0.00 0.13 -3.56 1.61 0.31 -1.26 -4.94 118.33 110.62 2e5l n VAL 9 Ca 0.00 -0.03 -0.36 0.00 -0.01 0.00 0.00 64.34 63.93 2e5l n VAL 9 Cb 0.00 -0.27 -0.07 0.00 -0.91 0.00 0.00 33.84 32.58 2e5l n VAL 9 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2e5l s PHE 10 N 0.08 3.43 -0.06 3.52 5.36 -1.26 -5.03 117.98 124.03 2e5l s PHE 10 Ca 0.87 0.53 -0.04 0.00 -0.96 0.00 0.00 56.93 57.33 2e5l s PHE 10 Cb -1.15 -2.33 0.02 0.00 -0.34 0.00 0.00 43.02 39.23 2e5l s PHE 10 CO 0.54 0.20 0.14 0.08 -1.46 0.00 0.00 175.22 174.72 2e5l s VAL 11 N 0.59 -0.02 -0.07 3.12 1.01 -1.26 -0.74 120.40 123.02 2e5l s VAL 11 Ca 0.15 0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 2e5l s VAL 11 Cb -0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 2e5l s VAL 11 CO 0.03 0.03 1.23 -1.81 0.00 0.00 0.00 175.10 174.58 2e5l s ASP 12 N 0.55 7.01 0.17 3.32 -0.00 -1.26 -4.86 116.67 121.60 2e5l s ASP 12 Ca -0.04 1.81 0.08 0.00 -0.00 0.00 0.00 52.55 54.40 2e5l s ASP 12 Cb -0.06 -2.55 0.46 0.00 -0.00 0.00 0.00 42.92 40.77 2e5l s ASP 12 CO -0.03 -0.63 1.17 -0.90 -0.00 0.00 0.00 175.17 174.78 2e5l n ASP 13 N 5.51 0.22 0.27 0.27 5.75 -1.26 -1.65 116.55 125.65 2e5l n ASP 13 Ca 0.12 0.51 -0.16 0.00 -0.01 0.00 0.00 54.79 55.25 2e5l n ASP 13 Cb 0.46 -0.51 -0.08 0.00 -1.03 0.00 0.00 41.12 39.96 2e5l n ASP 13 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 2e5l h HIS 14 N 0.00 -0.58 0.00 2.11 3.86 -2.00 -3.28 115.15 115.26 2e5l h HIS 14 Ca 0.00 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2e5l h HIS 14 Cb 0.32 0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 2e5l h HIS 14 CO 0.00 -0.36 -1.91 1.47 0.86 0.00 0.00 177.93 178.00 2e5l n LEU 15 N -5.36 0.11 0.00 2.43 -0.00 -0.93 -3.77 117.00 109.48 2e5l n LEU 15 Ca -0.12 0.04 0.00 0.00 -0.00 0.00 0.00 56.01 55.94 2e5l n LEU 15 Cb 0.26 0.03 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 2e5l n LEU 15 CO 0.37 0.02 0.44 -0.11 -0.00 0.00 0.00 177.39 178.10 2e5l n LEU 16 N -2.35 0.00 0.00 1.47 7.94 -0.66 0.26 117.00 123.67 2e5l n LEU 16 Ca -0.06 0.87 0.03 0.00 -1.11 0.00 0.00 56.01 55.75 2e5l n LEU 16 Cb 0.61 -0.37 0.17 0.00 0.53 0.00 0.00 43.42 44.36 2e5l n LEU 16 CO 0.45 -0.37 0.58 -1.84 -1.11 0.00 0.00 177.39 175.10 2e5l n GLU 17 N -1.98 0.05 -0.01 1.96 0.28 -1.24 -0.37 120.64 119.34 2e5l n GLU 17 Ca 0.00 0.30 -0.08 0.00 -0.16 0.00 0.00 57.16 57.22 2e5l n GLU 17 Cb 0.00 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.23 2e5l n GLU 17 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 2e5l h LYS 18 N 0.00 0.00 0.07 3.44 3.64 -1.10 -3.32 116.57 119.30 2e5l h LYS 18 Ca 0.00 -0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.11 2e5l h LYS 18 Cb 0.09 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2e5l h LYS 18 CO 0.00 0.58 -1.38 -0.24 -2.27 0.00 0.00 179.45 176.15 2e5l h VAL 19 N 0.00 1.31 0.00 2.00 3.04 0.66 -3.28 116.25 119.98 2e5l h VAL 19 Ca -0.24 -2.99 -0.03 0.00 -1.01 0.00 0.00 66.70 62.43 2e5l h VAL 19 Cb 1.97 2.76 -0.00 0.00 -2.01 0.00 0.00 31.29 34.01 2e5l h VAL 19 CO 0.09 0.82 -0.15 0.17 -1.01 0.00 0.00 177.57 177.49 2e5l h LEU 20 N 0.04 0.00 0.00 3.16 8.10 -1.41 -0.10 115.31 125.10 2e5l h LEU 20 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.82 2e5l h LEU 20 Cb 1.94 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.16 2e5l h LEU 20 CO 0.15 0.15 0.00 -0.62 -4.11 0.00 0.00 178.44 174.01 2e5l n GLU 21 N -3.47 0.89 0.00 0.17 1.02 -1.24 -2.43 120.64 115.58 2e5l n GLU 21 Ca -0.01 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.23 2e5l n GLU 21 Cb 0.32 -1.48 -0.10 0.00 -0.02 0.00 0.00 31.44 30.16 2e5l n GLU 21 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2e5l n LEU 22 N -0.98 1.13 0.03 -4.62 4.77 -0.05 -4.20 117.00 113.08 2e5l n LEU 22 Ca 0.20 -0.54 0.04 0.00 -0.03 0.00 0.00 56.01 55.69 2e5l n LEU 22 Cb 0.09 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.09 2e5l n LEU 22 CO 0.15 0.26 -0.41 0.59 -1.33 0.00 0.00 177.39 176.65 2e5l n ASN 23 N -1.26 0.57 -0.24 -1.43 3.02 -1.02 -2.46 115.26 112.44 2e5l n ASN 23 Ca 0.05 0.24 -0.07 0.00 -0.03 0.00 0.00 54.58 54.77 2e5l n ASN 23 Cb 0.34 0.74 0.07 0.00 -0.61 0.00 0.00 39.78 40.32 2e5l n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2e5l h ALA 24 N 1.66 0.98 0.00 5.41 0.00 -1.73 -3.04 119.26 122.55 2e5l h ALA 24 Ca -0.13 -0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.30 2e5l h ALA 24 Cb 1.37 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 2e5l h ALA 24 CO 0.02 0.66 -1.32 -0.22 0.00 0.00 0.00 179.25 178.39 2e5l h LYS 25 N 1.05 0.00 0.00 0.00 3.64 -1.76 -3.50 116.57 116.00 2e5l h LYS 25 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2e5l h LYS 25 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2e5l h LYS 25 CO 0.00 0.66 0.00 0.41 -2.27 0.00 0.00 179.45 178.25 2e5l n GLY 26 N 1.44 1.00 3.58 5.01 0.00 -1.03 -5.07 105.19 110.12 2e5l n GLY 26 Ca -0.08 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 45.09 2e5l n GLY 26 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2e5l s GLU 27 N 0.00 1.88 0.00 1.61 0.41 -1.25 -4.08 118.70 117.28 2e5l s GLU 27 Ca 0.00 -2.06 0.00 0.00 -0.41 0.00 0.00 54.97 52.50 2e5l s GLU 27 Cb 0.00 -1.47 0.00 0.00 -1.78 0.00 0.00 34.13 30.88 2e5l s GLU 27 CO 0.00 -0.07 0.00 1.17 -0.49 0.00 0.00 175.26 175.87 2e5l n LYS 28 N -0.90 2.51 0.08 1.61 4.81 -1.26 -5.01 118.16 120.00 2e5l n LYS 28 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 2e5l n LYS 28 Cb 0.67 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.72 2e5l n LYS 28 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2e5l n ARG 29 N 0.00 0.00 -4.25 1.64 1.74 -1.26 -4.91 116.66 109.61 2e5l n ARG 29 Ca 0.00 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 2e5l n ARG 29 Cb 0.00 -0.35 -0.15 0.00 -1.02 0.00 0.00 32.46 30.93 2e5l n ARG 29 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2e5l s LEU 30 N -7.00 1.71 0.08 0.55 1.43 -1.26 -4.40 118.68 109.80 2e5l s LEU 30 Ca 0.00 -0.14 0.10 0.00 -1.03 0.00 0.00 54.13 53.06 2e5l s LEU 30 Cb 0.00 -0.43 -0.03 0.00 0.03 0.00 0.00 46.19 45.75 2e5l s LEU 30 CO 0.00 0.03 -0.25 -0.63 0.23 0.00 0.00 176.35 175.73 2e5l s ILE 31 N 0.31 2.09 -0.13 -0.59 -1.09 -1.11 -5.00 121.20 115.68 2e5l s ILE 31 Ca -0.04 -1.52 -0.04 0.00 -2.23 0.00 0.00 60.65 56.82 2e5l s ILE 31 Cb -0.08 -1.82 0.05 0.00 -1.58 0.00 0.00 42.46 39.03 2e5l s ILE 31 CO 0.00 0.20 0.10 -1.59 -1.23 0.00 0.00 174.94 172.42 2e5l s LYS 32 N -1.60 0.03 -0.23 2.79 -2.85 -1.26 0.69 119.74 117.29 2e5l s LYS 32 Ca 0.12 0.14 -0.13 0.00 -1.00 0.00 0.00 55.97 55.09 2e5l s LYS 32 Cb -0.10 -1.25 0.07 0.00 -2.06 0.00 0.00 37.83 34.50 2e5l s LYS 32 CO 0.04 -0.54 0.57 0.99 0.10 0.00 0.00 175.35 176.51 2e5l s THR 33 N 2.18 -0.05 0.25 3.79 2.01 -1.16 -5.02 115.64 117.63 2e5l s THR 33 Ca 0.03 0.04 -0.06 0.00 0.31 0.00 0.00 61.69 62.01 2e5l s THR 33 Cb -0.14 -0.84 0.24 0.00 0.01 0.00 0.00 72.50 71.77 2e5l s THR 33 CO -0.07 0.02 1.92 -0.50 -0.69 0.00 0.00 174.62 175.29 2e5l h TRP 34 N 7.10 1.21 -0.56 4.92 6.55 -1.97 -3.39 115.95 129.82 2e5l h TRP 34 Ca -0.32 0.03 -0.66 0.00 0.95 0.00 0.00 58.89 58.89 2e5l h TRP 34 Cb 1.21 -0.41 -0.04 0.00 -0.86 0.00 0.00 29.16 29.06 2e5l h TRP 34 CO 0.14 0.75 1.46 -1.13 -1.05 0.00 0.00 178.44 178.61 2e5l n SER 35 N -4.42 1.34 -0.12 -3.49 3.41 -1.26 -4.65 113.62 104.44 2e5l n SER 35 Ca 0.12 0.39 0.03 0.00 -0.26 0.00 0.00 58.87 59.14 2e5l n SER 35 Cb 0.03 -1.10 -0.00 0.00 -0.26 0.00 0.00 64.21 62.87 2e5l n SER 35 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2e5l n ARG 36 N 8.08 2.43 -0.07 4.33 1.85 -1.26 -4.63 116.66 127.39 2e5l n ARG 36 Ca 0.50 -0.43 0.18 0.00 -1.00 0.00 0.00 57.85 57.10 2e5l n ARG 36 Cb 0.13 -0.93 0.62 0.00 -1.05 0.00 0.00 32.46 31.23 2e5l n ARG 36 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2e5l h ARG 37 N 0.57 0.16 -7.01 2.89 2.47 -1.98 -3.24 114.38 108.23 2e5l h ARG 37 Ca 0.00 -0.01 -0.49 0.00 -1.26 0.00 0.00 59.98 58.22 2e5l h ARG 37 Cb 0.17 -0.04 0.04 0.00 -1.65 0.00 0.00 29.97 28.50 2e5l h ARG 37 CO 0.00 0.11 0.44 -1.54 0.56 0.00 0.00 179.97 179.53 2e5l s SER 38 N -6.11 6.32 0.31 7.04 1.04 -1.26 -4.93 113.70 116.10 2e5l s SER 38 Ca -0.06 2.14 -0.10 0.00 0.48 0.00 0.00 55.95 58.41 2e5l s SER 38 Cb 0.20 -2.59 -0.07 0.00 0.10 0.00 0.00 66.02 63.67 2e5l s SER 38 CO 0.75 -0.80 0.64 -0.89 0.98 0.00 0.00 173.24 173.91 2e5l s THR 39 N -1.68 4.88 -0.16 2.02 2.01 0.08 -3.22 115.64 119.56 2e5l s THR 39 Ca 0.64 0.48 -0.24 0.00 0.31 0.00 0.00 61.69 62.88 2e5l s THR 39 Cb -0.24 -3.67 -0.02 0.00 0.01 0.00 0.00 72.50 68.58 2e5l s THR 39 CO 0.29 -0.27 0.76 -0.63 -0.69 0.00 0.00 174.62 174.08 2e5l s ILE 40 N -2.06 4.94 0.14 1.82 1.01 -0.19 -4.72 121.20 122.14 2e5l s ILE 40 Ca 0.49 1.50 -0.04 0.00 0.00 0.00 0.00 60.65 62.60 2e5l s ILE 40 Cb -0.11 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 2e5l s ILE 40 CO 0.25 0.08 0.36 0.68 0.00 0.00 0.00 174.94 176.31 2e5l s VAL 41 N 1.86 5.20 0.54 2.92 -7.23 -1.26 -4.61 120.40 117.82 2e5l s VAL 41 Ca 0.36 -0.05 0.23 0.00 -1.81 0.00 0.00 61.98 60.72 2e5l s VAL 41 Cb -0.17 -3.63 0.36 0.00 0.56 0.00 0.00 36.38 33.50 2e5l s VAL 41 CO 0.13 0.04 2.06 -0.65 -0.31 0.00 0.00 175.10 176.36 2e5l h PRO 42 N 2.80 0.00 0.00 4.82 0.11 -1.97 0.11 132.00 137.88 2e5l h PRO 42 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2e5l h PRO 42 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2e5l h PRO 42 CO 0.73 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.67 2e5l n GLU 43 N -4.33 0.20 -0.03 1.05 0.00 -1.26 -2.57 120.64 113.70 2e5l n GLU 43 Ca 0.05 0.15 0.06 0.00 0.00 0.00 0.00 57.16 57.42 2e5l n GLU 43 Cb 0.42 -1.50 -0.16 0.00 0.00 0.00 0.00 31.44 30.20 2e5l n GLU 43 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2e5l n MET 44 N -1.31 0.69 -1.11 3.44 2.81 0.03 -4.97 117.12 116.70 2e5l n MET 44 Ca 0.07 -0.14 -0.37 0.00 -1.81 0.00 0.00 57.70 55.45 2e5l n MET 44 Cb 0.13 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.15 2e5l n MET 44 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2e5l n VAL 45 N -2.32 0.91 0.00 2.03 0.31 -1.06 -1.87 118.33 116.33 2e5l n VAL 45 Ca -0.10 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 2e5l n VAL 45 Cb 0.66 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.59 2e5l n VAL 45 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2e5l n GLY 46 N 1.85 3.02 3.82 2.92 0.00 -0.45 -5.01 105.19 111.34 2e5l n GLY 46 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2e5l n GLY 46 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2e5l s HIS 47 N -1.12 3.11 -0.72 1.61 3.76 -0.78 -4.74 115.29 116.41 2e5l s HIS 47 Ca 0.00 1.39 -0.01 0.00 -0.15 0.00 0.00 55.06 56.29 2e5l s HIS 47 Cb 0.00 -2.90 0.18 0.00 1.11 0.00 0.00 32.58 30.97 2e5l s HIS 47 CO 0.00 -1.26 0.55 0.99 -0.85 0.00 0.00 174.74 174.17 2e5l s THR 48 N -3.06 3.73 0.02 1.30 2.01 -1.26 -2.67 115.64 115.71 2e5l s THR 48 Ca 0.58 -3.49 -0.22 0.00 0.31 0.00 0.00 61.69 58.87 2e5l s THR 48 Cb -0.14 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 2e5l s THR 48 CO 0.55 -0.96 0.66 -0.63 -0.69 0.00 0.00 174.62 173.55 2e5l s ILE 49 N -0.72 4.82 -0.31 1.82 1.01 -0.93 -2.75 121.20 124.14 2e5l s ILE 49 Ca 0.22 1.40 -0.11 0.00 0.00 0.00 0.00 60.65 62.16 2e5l s ILE 49 Cb -0.14 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.30 2e5l s ILE 49 CO -0.08 0.40 0.19 0.00 0.00 0.00 0.00 174.94 175.46 2e5l s ALA 50 N -0.18 3.43 0.01 9.38 0.00 0.22 0.20 121.76 134.81 2e5l s ALA 50 Ca 0.34 -1.30 -0.00 0.00 0.00 0.00 0.00 51.96 51.00 2e5l s ALA 50 Cb -0.19 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.38 2e5l s ALA 50 CO 0.20 -0.82 0.11 0.08 0.00 0.00 0.00 175.76 175.32 2e5l s VAL 51 N 1.70 4.87 0.16 0.00 1.01 -0.39 -2.97 120.40 124.78 2e5l s VAL 51 Ca 0.06 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2e5l s VAL 51 Cb -0.17 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 2e5l s VAL 51 CO 0.09 0.30 0.93 -0.47 0.00 0.00 0.00 175.10 175.95 2e5l s TYR 52 N -1.26 3.89 0.00 5.22 5.04 -1.26 -0.63 117.35 128.34 2e5l s TYR 52 Ca 0.25 1.82 0.00 0.00 -2.44 0.00 0.00 57.07 56.70 2e5l s TYR 52 Cb -0.12 -2.99 0.00 0.00 0.35 0.00 0.00 41.96 39.20 2e5l s TYR 52 CO 0.17 0.34 0.00 0.09 -1.34 0.00 0.00 175.55 174.80 2e5l n ASN 53 N 2.17 0.00 0.03 4.32 3.02 0.10 -4.92 115.26 119.98 2e5l n ASN 53 Ca -0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 2e5l n ASN 53 Cb 0.48 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.57 2e5l n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2e5l n GLY 54 N 5.00 -1.18 0.00 7.41 0.00 -1.26 -4.72 105.19 110.44 2e5l n GLY 54 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2e5l n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2e5l n LYS 55 N -2.89 0.02 -2.35 1.61 4.81 -1.26 -5.13 118.16 112.97 2e5l n LYS 55 Ca -0.10 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.08 2e5l n LYS 55 Cb 0.85 -0.51 0.15 0.00 0.02 0.00 0.00 35.03 35.55 2e5l n LYS 55 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2e5l n GLN 56 N -1.18 -0.57 -3.36 1.64 1.13 -1.26 -5.08 117.38 108.70 2e5l n GLN 56 Ca 0.00 -2.52 -0.26 0.00 -1.94 0.00 0.00 57.00 52.28 2e5l n GLN 56 Cb 0.01 -0.94 -0.08 0.00 0.11 0.00 0.00 30.24 29.33 2e5l n GLN 56 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2e5l n HIS 57 N -3.25 0.90 -1.86 1.08 8.25 -1.26 0.01 115.22 119.09 2e5l n HIS 57 Ca 0.17 -3.74 -0.42 0.00 -0.26 0.00 0.00 57.72 53.47 2e5l n HIS 57 Cb 0.60 -0.31 -0.03 0.00 1.12 0.00 0.00 29.99 31.37 2e5l n HIS 57 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2e5l s VAL 58 N -1.29 3.28 0.33 1.59 -7.23 0.20 -4.55 120.40 112.72 2e5l s VAL 58 Ca 0.35 0.39 -0.28 0.00 -1.81 0.00 0.00 61.98 60.64 2e5l s VAL 58 Cb 0.12 -3.25 -0.09 0.00 0.56 0.00 0.00 36.38 33.71 2e5l s VAL 58 CO -0.11 -0.03 1.13 -2.16 -0.31 0.00 0.00 175.10 173.62 2e5l s PRO 59 N 4.05 4.41 -0.17 4.82 0.04 -1.26 -1.26 135.00 145.63 2e5l s PRO 59 Ca 0.80 1.81 -0.00 0.00 0.04 0.00 0.00 61.00 63.65 2e5l s PRO 59 Cb -0.38 -2.96 0.04 0.00 0.04 0.00 0.00 34.50 31.23 2e5l s PRO 59 CO 0.35 -0.00 -0.07 0.08 0.04 0.00 0.00 177.00 177.39 2e5l s VAL 60 N -1.29 1.25 -0.02 -0.36 1.01 0.53 -4.90 120.40 116.61 2e5l s VAL 60 Ca 0.50 -0.67 -0.28 0.00 0.00 0.00 0.00 61.98 61.53 2e5l s VAL 60 Cb -0.31 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2e5l s VAL 60 CO 0.40 0.19 0.88 -0.47 0.00 0.00 0.00 175.10 176.09 2e5l s TYR 61 N 1.58 3.63 -0.17 5.22 5.04 -1.26 -2.19 117.35 129.21 2e5l s TYR 61 Ca 0.01 1.53 -0.08 0.00 -2.44 0.00 0.00 57.07 56.09 2e5l s TYR 61 Cb -0.15 -3.00 -0.04 0.00 0.35 0.00 0.00 41.96 39.11 2e5l s TYR 61 CO -0.08 0.03 0.11 -1.50 -1.34 0.00 0.00 175.55 172.77 2e5l s ILE 62 N 0.93 5.26 0.30 3.14 1.10 -1.09 -5.03 121.20 125.81 2e5l s ILE 62 Ca 0.47 0.13 0.11 0.00 -0.51 0.00 0.00 60.65 60.84 2e5l s ILE 62 Cb -0.20 -3.35 -0.05 0.00 0.15 0.00 0.00 42.46 39.01 2e5l s ILE 62 CO 0.24 0.51 -0.14 -0.89 -2.11 0.00 0.00 174.94 172.56 2e5l s THR 63 N -0.13 2.53 0.26 4.00 2.01 -1.26 -1.35 115.64 121.70 2e5l s THR 63 Ca 0.09 -2.27 -0.02 0.00 0.31 0.00 0.00 61.69 59.80 2e5l s THR 63 Cb -0.12 -2.49 0.23 0.00 0.01 0.00 0.00 72.50 70.14 2e5l s THR 63 CO 0.00 -0.33 1.79 -0.08 -0.69 0.00 0.00 174.62 175.32 2e5l h GLU 64 N 2.13 0.73 0.00 4.92 4.57 -1.99 -2.21 114.58 122.73 2e5l h GLU 64 Ca -0.41 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2e5l h GLU 64 Cb 1.26 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 2e5l h GLU 64 CO 0.63 0.48 0.00 0.27 -1.18 0.00 0.00 179.01 179.21 2e5l n ASN 65 N -4.78 0.65 -2.22 1.04 6.94 -1.26 -3.60 115.26 112.03 2e5l n ASN 65 Ca 0.16 0.58 -0.29 0.00 -0.02 0.00 0.00 54.58 55.01 2e5l n ASN 65 Cb 0.35 -0.75 0.04 0.00 -2.36 0.00 0.00 39.78 37.06 2e5l n ASN 65 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 2e5l n MET 66 N -2.13 3.24 -0.05 -3.83 0.00 -0.83 -4.63 117.12 108.89 2e5l n MET 66 Ca 0.05 -3.87 -0.10 0.00 0.00 0.00 0.00 57.70 53.78 2e5l n MET 66 Cb 0.36 -2.28 -0.15 0.00 0.00 0.00 0.00 33.22 31.16 2e5l n MET 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2e5l n VAL 67 N -0.75 1.54 0.43 3.17 0.31 -1.24 -4.12 118.33 117.69 2e5l n VAL 67 Ca 0.51 -0.81 0.04 0.00 -0.01 0.00 0.00 64.34 64.07 2e5l n VAL 67 Cb 0.79 -0.89 0.22 0.00 -0.91 0.00 0.00 33.84 33.05 2e5l n VAL 67 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2e5l n GLY 68 N 1.65 -0.43 3.30 2.92 0.00 -1.26 -4.09 105.19 107.28 2e5l n GLY 68 Ca -0.23 -0.04 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 2e5l n GLY 68 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2e5l n HIS 69 N -1.17 -1.11 -4.09 1.61 8.25 -1.26 -4.89 115.22 112.56 2e5l n HIS 69 Ca 0.05 -1.96 -0.22 0.00 -0.26 0.00 0.00 57.72 55.32 2e5l n HIS 69 Cb 0.05 -0.41 -0.05 0.00 1.12 0.00 0.00 29.99 30.70 2e5l n HIS 69 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2e5l s LYS 70 N -4.02 2.62 0.13 -0.41 1.02 -1.26 -1.02 119.74 116.80 2e5l s LYS 70 Ca 0.33 -1.29 -0.16 0.00 0.02 0.00 0.00 55.97 54.87 2e5l s LYS 70 Cb -0.03 -2.37 -0.02 0.00 -0.52 0.00 0.00 37.83 34.89 2e5l s LYS 70 CO 0.21 0.27 1.67 -0.07 -0.92 0.00 0.00 175.35 176.51 2e5l h LEU 71 N 1.55 0.52 -1.46 3.17 3.38 -1.67 -2.56 115.31 118.22 2e5l h LEU 71 Ca -0.46 -0.17 0.20 0.00 0.09 0.00 0.00 57.88 57.54 2e5l h LEU 71 Cb 1.25 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 2e5l h LEU 71 CO 0.61 0.55 0.59 1.23 0.09 0.00 0.00 178.44 181.51 2e5l h GLY 72 N 0.45 0.95 2.00 0.83 0.00 -1.85 0.31 103.07 105.75 2e5l h GLY 72 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2e5l h GLY 72 CO -0.01 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.71 2e5l n GLU 73 N -4.53 0.06 0.00 4.80 1.02 -0.97 -1.01 120.64 120.01 2e5l n GLU 73 Ca 0.19 0.54 0.06 0.00 -0.02 0.00 0.00 57.16 57.94 2e5l n GLU 73 Cb 0.67 -1.68 0.01 0.00 -0.02 0.00 0.00 31.44 30.42 2e5l n GLU 73 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2e5l n PHE 74 N -1.80 0.00 -3.77 -0.32 0.99 0.11 -4.87 117.46 107.80 2e5l n PHE 74 Ca -0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.45 57.07 2e5l n PHE 74 Cb 0.02 0.00 -0.12 0.00 -1.00 0.00 0.00 39.48 38.38 2e5l n PHE 74 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2e5l s ALA 75 N -1.37 3.04 0.13 4.37 0.00 -0.18 -5.02 121.76 122.73 2e5l s ALA 75 Ca 0.11 -1.89 -0.30 0.00 0.00 0.00 0.00 51.96 49.88 2e5l s ALA 75 Cb 0.10 -2.27 -0.06 0.00 0.00 0.00 0.00 23.12 20.88 2e5l s ALA 75 CO 0.25 -1.42 0.99 -1.25 0.00 0.00 0.00 175.76 174.34 2e5l s PRO 76 N 1.35 4.68 -0.23 0.00 0.04 -1.26 -4.92 135.00 134.65 2e5l s PRO 76 Ca -0.01 1.51 0.06 0.00 0.04 0.00 0.00 61.00 62.61 2e5l s PRO 76 Cb -0.20 -3.35 -0.18 0.00 0.04 0.00 0.00 34.50 30.80 2e5l s PRO 76 CO 0.01 0.18 -0.13 2.41 0.04 0.00 0.00 177.00 179.51 2e5l n THR 77 N 2.70 1.36 -2.88 1.26 -1.04 -1.26 -4.82 114.28 109.60 2e5l n THR 77 Ca 0.02 -0.61 -0.42 0.00 -2.04 0.00 0.00 64.05 61.01 2e5l n THR 77 Cb 0.48 -1.11 -0.04 0.00 -1.82 0.00 0.00 70.33 67.85 2e5l n THR 77 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2e5l s ARG 78 N -2.48 4.26 -0.28 -2.82 0.52 -1.26 -4.78 118.95 112.11 2e5l s ARG 78 Ca -0.26 1.02 -0.24 0.00 -0.52 0.00 0.00 55.73 55.73 2e5l s ARG 78 Cb 0.08 -3.60 -0.00 0.00 0.52 0.00 0.00 34.95 31.95 2e5l s ARG 78 CO 0.62 -0.40 0.79 0.99 0.02 0.00 0.00 175.30 177.33 2e5l s THR 79 N 2.40 4.82 0.09 0.02 2.01 -1.26 -5.06 115.64 118.65 2e5l s THR 79 Ca 0.38 1.32 0.03 0.00 0.31 0.00 0.00 61.69 63.73 2e5l s THR 79 Cb -0.16 -4.12 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 2e5l s THR 79 CO 0.11 -0.17 -0.09 -0.47 -0.69 0.00 0.00 174.62 173.30 2e5l s TYR 80 N 2.89 0.97 0.00 4.92 5.04 -1.26 -5.30 117.35 124.62 2e5l s TYR 80 Ca 0.33 -0.67 0.00 0.00 -2.44 0.00 0.00 57.07 54.29 2e5l s TYR 80 Cb -0.15 -0.54 0.00 0.00 0.35 0.00 0.00 41.96 41.62 2e5l s TYR 80 CO 0.10 -0.04 0.00 -2.13 -1.34 0.00 0.00 175.55 172.15