#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jm8 n ASP 2 N 0.00 1.81 -3.88 6.12 5.75 -1.23 -4.70 116.55 120.42 2jm8 n ASP 2 Ca 0.00 0.26 -0.09 0.00 -0.01 0.00 0.00 54.79 54.95 2jm8 n ASP 2 Cb 0.00 -0.70 -0.07 0.00 -1.03 0.00 0.00 41.12 39.33 2jm8 n ASP 2 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2jm8 s GLU 3 N -2.46 1.03 0.00 0.11 2.12 -1.26 -4.87 118.70 113.38 2jm8 s GLU 3 Ca -0.35 -1.03 0.00 0.00 0.36 0.00 0.00 54.97 53.96 2jm8 s GLU 3 Cb 0.13 0.38 0.00 0.00 0.26 0.00 0.00 34.13 34.90 2jm8 s GLU 3 CO 0.45 -0.37 0.00 2.41 -0.54 0.00 0.00 175.26 177.21 2jm8 n THR 4 N -0.16 0.00 -3.65 -1.70 -1.04 -1.26 -4.78 114.28 101.69 2jm8 n THR 4 Ca -0.11 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.82 2jm8 n THR 4 Cb 0.63 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 69.06 2jm8 n THR 4 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2jm8 s GLY 5 N -0.53 -0.59 0.00 3.41 0.00 -1.26 -5.03 107.32 103.33 2jm8 s GLY 5 Ca 0.00 2.27 0.00 0.00 0.00 0.00 0.00 44.72 46.99 2jm8 s GLY 5 CO 0.00 2.28 0.00 0.58 0.00 0.00 0.00 173.10 175.96 2jm8 n LYS 6 N 4.29 0.00 -0.02 2.90 2.85 -1.26 0.59 118.16 127.51 2jm8 n LYS 6 Ca -0.20 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 56.96 2jm8 n LYS 6 Cb 0.58 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.94 2jm8 n LYS 6 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2jm8 h GLU 7 N 0.00 -0.29 -4.14 -1.58 3.07 -1.91 -3.47 114.58 106.26 2jm8 h GLU 7 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2jm8 h GLU 7 Cb 0.00 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 2jm8 h GLU 7 CO 0.00 -0.20 -0.97 1.28 -1.40 0.00 0.00 179.01 177.72 2jm8 n LEU 8 N -5.39 -5.89 -4.38 1.33 4.77 -1.26 -3.19 117.00 102.99 2jm8 n LEU 8 Ca -0.02 3.31 -0.32 0.00 -0.03 0.00 0.00 56.01 58.95 2jm8 n LEU 8 Cb 0.30 -3.21 -0.15 0.00 -2.33 0.00 0.00 43.42 38.03 2jm8 n LEU 8 CO 0.15 -0.48 -0.51 0.68 -1.33 0.00 0.00 177.39 175.90 2jm8 s VAL 9 N -2.25 2.53 -0.27 4.08 -7.23 -0.55 -1.74 120.40 114.97 2jm8 s VAL 9 Ca 0.00 -0.92 -0.14 0.00 -1.81 0.00 0.00 61.98 59.11 2jm8 s VAL 9 Cb 0.00 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2jm8 s VAL 9 CO 0.00 0.58 0.34 -0.22 -0.31 0.00 0.00 175.10 175.49 2jm8 s LEU 10 N -0.58 4.04 -0.03 1.32 2.96 0.47 -0.40 118.68 126.46 2jm8 s LEU 10 Ca 0.09 0.24 -0.30 0.00 -0.22 0.00 0.00 54.13 53.94 2jm8 s LEU 10 Cb -0.11 -2.37 -0.06 0.00 0.50 0.00 0.00 46.19 44.15 2jm8 s LEU 10 CO 0.00 -0.15 1.63 0.00 -1.32 0.00 0.00 176.35 176.51 2jm8 s ALA 11 N 1.98 3.63 -0.09 5.97 0.00 -0.67 -0.60 121.76 131.97 2jm8 s ALA 11 Ca 0.14 0.98 -0.04 0.00 0.00 0.00 0.00 51.96 53.03 2jm8 s ALA 11 Cb -0.16 -3.72 -0.26 0.00 0.00 0.00 0.00 23.12 18.97 2jm8 s ALA 11 CO 0.10 -1.31 0.48 -0.07 0.00 0.00 0.00 175.76 174.96 2jm8 h LEU 12 N 9.80 0.38 -8.47 0.00 3.38 -1.47 0.11 115.31 119.04 2jm8 h LEU 12 Ca -0.40 -0.79 -0.47 0.00 0.09 0.00 0.00 57.88 56.32 2jm8 h LEU 12 Cb 1.18 -0.12 -0.23 0.00 0.09 0.00 0.00 40.66 41.58 2jm8 h LEU 12 CO 0.95 1.70 -0.80 -0.31 0.09 0.00 0.00 178.44 180.06 2jm8 s TYR 13 N -2.57 1.41 0.11 1.13 2.02 -1.23 -4.70 117.35 113.53 2jm8 s TYR 13 Ca -0.18 -0.41 -0.31 0.00 -0.37 0.00 0.00 57.07 55.79 2jm8 s TYR 13 Cb 0.07 -0.80 -0.09 0.00 -0.40 0.00 0.00 41.96 40.73 2jm8 s TYR 13 CO 0.79 0.09 1.62 0.34 -1.57 0.00 0.00 175.55 176.82 2jm8 s ASP 14 N -1.58 6.59 -0.12 2.29 2.15 -1.26 -3.93 116.67 120.81 2jm8 s ASP 14 Ca 0.02 2.55 0.01 0.00 0.43 0.00 0.00 52.55 55.55 2jm8 s ASP 14 Cb -0.09 -2.58 0.02 0.00 -0.30 0.00 0.00 42.92 39.97 2jm8 s ASP 14 CO 0.02 -0.86 -0.13 -0.47 -0.17 0.00 0.00 175.17 173.57 2jm8 s TYR 15 N 2.00 1.89 -0.35 -5.34 5.04 0.17 -4.97 117.35 115.78 2jm8 s TYR 15 Ca 0.72 -0.96 -0.11 0.00 -2.44 0.00 0.00 57.07 54.28 2jm8 s TYR 15 Cb -0.42 -1.42 0.01 0.00 0.35 0.00 0.00 41.96 40.49 2jm8 s TYR 15 CO 0.32 -0.55 0.20 -1.14 -1.34 0.00 0.00 175.55 173.05 2jm8 s GLN 16 N 1.33 3.09 0.20 4.97 2.00 -1.26 -1.50 119.66 128.49 2jm8 s GLN 16 Ca 0.00 -0.90 -0.32 0.00 -2.00 0.00 0.00 55.36 52.14 2jm8 s GLN 16 Cb -0.14 -3.72 -0.14 0.00 0.80 0.00 0.00 33.01 29.81 2jm8 s GLN 16 CO -0.06 -0.58 1.37 -0.85 -0.50 0.00 0.00 175.29 174.67 2jm8 n GLU 17 N 5.03 1.79 0.03 1.67 0.28 -1.26 -4.89 120.64 123.28 2jm8 n GLU 17 Ca -0.12 0.64 0.11 0.00 -0.16 0.00 0.00 57.16 57.63 2jm8 n GLU 17 Cb 0.48 -2.28 0.02 0.00 1.43 0.00 0.00 31.44 31.09 2jm8 n GLU 17 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 2jm8 n LYS 18 N 2.23 0.32 -3.93 3.44 2.85 -1.26 -4.95 118.16 116.86 2jm8 n LYS 18 Ca 0.14 -0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.30 2jm8 n LYS 18 Cb 0.29 -1.61 -0.10 0.00 -0.65 0.00 0.00 35.03 32.96 2jm8 n LYS 18 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2jm8 s SER 19 N -4.03 0.16 0.00 -5.58 1.04 -1.26 -5.02 113.70 99.00 2jm8 s SER 19 Ca 0.03 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 56.06 2jm8 s SER 19 Cb 0.14 0.19 0.29 0.00 0.10 0.00 0.00 66.02 66.74 2jm8 s SER 19 CO 0.80 -0.42 0.66 -0.81 0.98 0.00 0.00 173.24 174.45 2jm8 n PRO 20 N 1.13 0.32 0.03 4.02 -0.04 -1.26 -0.39 135.00 138.81 2jm8 n PRO 20 Ca -0.21 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.36 2jm8 n PRO 20 Cb 0.57 -1.23 -0.02 0.00 -0.04 0.00 0.00 33.50 32.77 2jm8 n PRO 20 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jm8 n ALA 21 N -0.73 3.22 -2.00 0.55 0.00 -1.26 -4.92 120.51 115.37 2jm8 n ALA 21 Ca 0.04 -0.40 -0.21 0.00 0.00 0.00 0.00 53.44 52.86 2jm8 n ALA 21 Cb 0.02 -0.95 0.06 0.00 0.00 0.00 0.00 19.45 18.58 2jm8 n ALA 21 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2jm8 s GLU 22 N -3.27 2.25 0.04 0.00 2.02 0.47 -0.66 118.70 119.55 2jm8 s GLU 22 Ca 0.01 -1.12 0.03 0.00 0.02 0.00 0.00 54.97 53.91 2jm8 s GLU 22 Cb 0.14 -2.50 -0.02 0.00 0.10 0.00 0.00 34.13 31.84 2jm8 s GLU 22 CO 0.82 -0.93 -0.10 0.14 0.02 0.00 0.00 175.26 175.22 2jm8 s VAL 23 N -2.81 0.74 0.03 2.63 -7.23 -1.05 -4.60 120.40 108.10 2jm8 s VAL 23 Ca 0.61 -0.93 -0.29 0.00 -1.81 0.00 0.00 61.98 59.56 2jm8 s VAL 23 Cb -0.08 -0.72 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 2jm8 s VAL 23 CO 0.40 -0.17 0.91 -0.89 -0.31 0.00 0.00 175.10 175.04 2jm8 s THR 24 N -1.00 4.77 0.01 5.32 2.01 -1.26 -4.03 115.64 121.45 2jm8 s THR 24 Ca -0.04 1.93 -0.03 0.00 0.31 0.00 0.00 61.69 63.86 2jm8 s THR 24 Cb -0.08 -4.26 -0.01 0.00 0.01 0.00 0.00 72.50 68.16 2jm8 s THR 24 CO 0.01 0.24 0.05 0.00 -0.69 0.00 0.00 174.62 174.22 2jm8 s MET 25 N 0.56 0.36 -0.09 4.92 0.23 -0.56 -4.94 119.30 119.78 2jm8 s MET 25 Ca 0.47 -0.46 -0.01 0.00 -1.03 0.00 0.00 55.69 54.66 2jm8 s MET 25 Cb -0.21 0.14 -0.03 0.00 -1.53 0.00 0.00 34.83 33.20 2jm8 s MET 25 CO 0.27 -0.07 -0.05 0.15 -2.03 0.00 0.00 175.02 173.29 2jm8 s LYS 26 N -1.29 2.98 0.49 3.16 -0.14 -1.26 -0.66 119.74 123.02 2jm8 s LYS 26 Ca -0.14 -0.51 -0.23 0.00 -1.36 0.00 0.00 55.97 53.73 2jm8 s LYS 26 Cb -0.08 -2.70 -0.08 0.00 -1.68 0.00 0.00 37.83 33.30 2jm8 s LYS 26 CO 0.00 0.59 1.21 0.36 -0.76 0.00 0.00 175.35 176.75 2jm8 n LYS 27 N 2.47 1.61 0.00 1.68 0.00 -1.25 -2.26 118.16 120.41 2jm8 n LYS 27 Ca -0.18 0.59 0.00 0.00 -0.00 0.00 0.00 58.31 58.72 2jm8 n LYS 27 Cb 0.53 -2.36 0.00 0.00 -0.00 0.00 0.00 35.03 33.20 2jm8 n LYS 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2jm8 n GLY 28 N 0.93 1.78 3.83 2.58 0.00 0.40 -4.97 105.19 109.74 2jm8 n GLY 28 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 2jm8 n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jm8 s ASP 29 N -2.22 6.91 -0.36 1.61 1.01 -0.96 -4.89 116.67 117.78 2jm8 s ASP 29 Ca 0.00 1.21 -0.13 0.00 0.71 0.00 0.00 52.55 54.35 2jm8 s ASP 29 Cb 0.00 -2.34 0.00 0.00 1.01 0.00 0.00 42.92 41.59 2jm8 s ASP 29 CO 0.00 0.06 0.24 -0.63 0.21 0.00 0.00 175.17 175.05 2jm8 s ILE 30 N -1.51 5.02 0.26 0.77 -1.09 -1.26 -1.67 121.20 121.72 2jm8 s ILE 30 Ca 0.40 -0.51 0.04 0.00 -2.23 0.00 0.00 60.65 58.35 2jm8 s ILE 30 Cb -0.15 -3.68 -0.03 0.00 -1.58 0.00 0.00 42.46 37.01 2jm8 s ILE 30 CO 0.20 -0.13 0.40 -0.76 -1.23 0.00 0.00 174.94 173.42 2jm8 s LEU 31 N 1.66 4.25 -0.11 2.97 1.43 0.46 -4.93 118.68 124.42 2jm8 s LEU 31 Ca 0.05 0.16 -0.23 0.00 -1.03 0.00 0.00 54.13 53.08 2jm8 s LEU 31 Cb -0.18 -2.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.04 2jm8 s LEU 31 CO 0.09 -0.12 0.72 -0.89 0.23 0.00 0.00 176.35 176.38 2jm8 s THR 32 N -2.05 5.01 -0.04 5.49 2.01 -0.95 -1.48 115.64 123.63 2jm8 s THR 32 Ca 0.35 1.44 -0.27 0.00 0.31 0.00 0.00 61.69 63.53 2jm8 s THR 32 Cb -0.09 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.34 2jm8 s THR 32 CO 0.31 0.18 0.84 -0.22 -0.69 0.00 0.00 174.62 175.04 2jm8 s LEU 33 N 1.26 4.33 -0.12 4.42 0.20 -1.26 -0.92 118.68 126.58 2jm8 s LEU 33 Ca 0.36 1.41 0.00 0.00 0.69 0.00 0.00 54.13 56.59 2jm8 s LEU 33 Cb -0.17 -3.32 -0.08 0.00 -0.43 0.00 0.00 46.19 42.19 2jm8 s LEU 33 CO 0.16 -0.20 -0.11 0.18 -0.29 0.00 0.00 176.35 176.08 2jm8 n LEU 34 N 3.94 2.82 -3.79 -0.68 4.77 0.94 -4.87 117.00 120.12 2jm8 n LEU 34 Ca 0.03 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 2jm8 n LEU 34 Cb 0.51 -0.42 -0.14 0.00 -2.33 0.00 0.00 43.42 41.04 2jm8 n LEU 34 CO 0.49 0.67 -0.26 0.21 -1.33 0.00 0.00 177.39 177.17 2jm8 s ASN 35 N -5.26 -0.07 -0.00 -1.43 2.47 -0.85 -4.92 114.94 104.88 2jm8 s ASN 35 Ca -0.16 0.20 0.00 0.00 0.42 0.00 0.00 52.86 53.32 2jm8 s ASN 35 Cb 0.04 0.14 0.01 0.00 -1.45 0.00 0.00 41.25 39.99 2jm8 s ASN 35 CO 0.28 -0.10 0.66 -1.54 -3.72 0.00 0.00 177.10 172.67 2jm8 n SER 36 N 3.72 0.20 0.12 -4.21 3.41 -1.26 -2.47 113.62 113.13 2jm8 n SER 36 Ca -0.21 -1.33 0.12 0.00 -0.26 0.00 0.00 58.87 57.19 2jm8 n SER 36 Cb 0.55 -0.05 0.17 0.00 -0.26 0.00 0.00 64.21 64.62 2jm8 n SER 36 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jm8 h THR 37 N 3.54 0.00 -3.37 6.66 1.03 -1.94 -3.44 112.91 115.38 2jm8 h THR 37 Ca 0.00 -0.73 -0.56 0.00 -0.01 0.00 0.00 66.41 65.11 2jm8 h THR 37 Cb 1.05 1.46 -0.05 0.00 -1.07 0.00 0.00 68.15 69.54 2jm8 h THR 37 CO 0.00 0.00 0.08 0.21 -0.01 0.00 0.00 175.52 175.80 2jm8 s ASN 38 N -5.02 7.07 0.13 0.00 2.47 -1.26 -4.96 114.94 113.37 2jm8 s ASN 38 Ca 0.06 1.28 0.25 0.00 0.42 0.00 0.00 52.86 54.86 2jm8 s ASN 38 Cb 0.10 -2.42 0.95 0.00 -1.45 0.00 0.00 41.25 38.43 2jm8 s ASN 38 CO 0.70 -0.00 1.78 2.29 -3.72 0.00 0.00 177.10 178.15 2jm8 n LYS 39 N 3.10 0.15 -0.00 0.43 2.85 -1.26 -4.35 118.16 119.08 2jm8 n LYS 39 Ca -0.03 0.19 -0.02 0.00 -1.05 0.00 0.00 58.31 57.40 2jm8 n LYS 39 Cb 0.51 -1.69 -0.01 0.00 -0.65 0.00 0.00 35.03 33.19 2jm8 n LYS 39 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2jm8 n ASP 40 N -1.95 0.65 -4.55 -5.58 8.00 -1.26 -4.83 116.55 107.02 2jm8 n ASP 40 Ca 0.05 0.10 -0.34 0.00 0.71 0.00 0.00 54.79 55.31 2jm8 n ASP 40 Cb 0.35 -0.34 -0.11 0.00 -0.02 0.00 0.00 41.12 41.00 2jm8 n ASP 40 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2jm8 s TRP 41 N -1.61 3.12 0.29 1.24 0.52 -1.26 -1.09 118.94 120.15 2jm8 s TRP 41 Ca -0.05 -0.16 0.07 0.00 0.02 0.00 0.00 56.10 55.98 2jm8 s TRP 41 Cb 0.01 -2.03 -0.03 0.00 -1.15 0.00 0.00 33.47 30.26 2jm8 s TRP 41 CO 0.08 0.01 0.24 -1.58 0.02 0.00 0.00 176.95 175.72 2jm8 s TRP 42 N 0.48 3.03 -0.16 -1.98 0.52 0.61 -4.52 118.94 116.92 2jm8 s TRP 42 Ca -0.00 -0.19 -0.01 0.00 0.02 0.00 0.00 56.10 55.92 2jm8 s TRP 42 Cb -0.13 -1.57 -0.01 0.00 -1.15 0.00 0.00 33.47 30.61 2jm8 s TRP 42 CO 0.02 0.38 -0.11 0.21 0.02 0.00 0.00 176.95 177.47 2jm8 s LYS 43 N -3.91 3.36 0.14 4.98 2.20 -1.03 -0.50 119.74 124.98 2jm8 s LYS 43 Ca 0.36 -0.67 0.02 0.00 -0.36 0.00 0.00 55.97 55.31 2jm8 s LYS 43 Cb -0.07 -2.74 -0.04 0.00 -1.51 0.00 0.00 37.83 33.47 2jm8 s LYS 43 CO 0.26 0.07 -0.02 0.14 -0.36 0.00 0.00 175.35 175.44 2jm8 s VAL 44 N 0.72 0.63 -0.16 4.02 -7.23 0.45 -0.04 120.40 118.80 2jm8 s VAL 44 Ca -0.05 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.17 2jm8 s VAL 44 Cb -0.15 -1.93 0.01 0.00 0.56 0.00 0.00 36.38 34.86 2jm8 s VAL 44 CO 0.02 -0.64 -0.17 -0.70 -0.31 0.00 0.00 175.10 173.30 2jm8 s GLU 45 N -3.89 3.14 -0.01 4.82 2.12 -0.10 -1.37 118.70 123.40 2jm8 s GLU 45 Ca 0.19 -0.78 0.02 0.00 0.36 0.00 0.00 54.97 54.76 2jm8 s GLU 45 Cb 0.06 -2.61 0.00 0.00 0.26 0.00 0.00 34.13 31.84 2jm8 s GLU 45 CO 0.00 -0.06 -0.06 0.08 -0.54 0.00 0.00 175.26 174.68 2jm8 s VAL 46 N 0.98 0.51 0.00 3.70 1.01 -1.02 -2.23 120.40 123.35 2jm8 s VAL 46 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2jm8 s VAL 46 Cb -0.15 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.78 2jm8 s VAL 46 CO -0.04 0.16 0.00 -0.46 0.00 0.00 0.00 175.10 174.77 2jm8 n ASN 47 N 3.20 0.00 0.00 3.32 0.23 -1.26 -0.45 115.26 120.30 2jm8 n ASN 47 Ca -0.16 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.89 2jm8 n ASN 47 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 2jm8 n ASN 47 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2jm8 n ASP 48 N 0.75 0.00 -4.57 0.53 5.68 -1.26 -5.09 116.55 112.59 2jm8 n ASP 48 Ca 0.00 -0.79 -0.42 0.00 -0.50 0.00 0.00 54.79 53.09 2jm8 n ASP 48 Cb 0.00 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 39.91 2jm8 n ASP 48 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 2jm8 s ARG 49 N 0.00 3.70 -0.46 0.11 3.52 0.40 -5.01 118.95 121.22 2jm8 s ARG 49 Ca 0.00 0.08 -0.15 0.00 -0.13 0.00 0.00 55.73 55.52 2jm8 s ARG 49 Cb 0.00 -3.80 0.06 0.00 -1.56 0.00 0.00 34.95 29.65 2jm8 s ARG 49 CO 0.00 -0.72 0.38 -0.65 -0.81 0.00 0.00 175.30 173.50 2jm8 s GLN 50 N 2.70 2.98 0.00 5.12 -0.21 -1.26 -2.44 119.66 126.54 2jm8 s GLN 50 Ca 0.24 -1.24 0.00 0.00 0.02 0.00 0.00 55.36 54.38 2jm8 s GLN 50 Cb -0.15 -4.09 0.00 0.00 1.00 0.00 0.00 33.01 29.78 2jm8 s GLN 50 CO 0.14 -0.95 0.00 0.41 -2.12 0.00 0.00 175.29 172.77 2jm8 n GLY 51 N 5.19 4.05 3.83 3.09 0.00 -0.47 -4.95 105.19 115.94 2jm8 n GLY 51 Ca -0.12 -1.08 -0.29 0.00 0.00 0.00 0.00 46.02 44.52 2jm8 n GLY 51 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jm8 s PHE 52 N -2.08 3.29 0.09 1.61 0.08 0.17 -0.41 117.98 120.72 2jm8 s PHE 52 Ca 0.00 0.10 -0.02 0.00 0.12 0.00 0.00 56.93 57.14 2jm8 s PHE 52 Cb 0.00 -1.64 -0.04 0.00 -0.57 0.00 0.00 43.02 40.78 2jm8 s PHE 52 CO 0.00 0.54 0.02 0.14 -0.10 0.00 0.00 175.22 175.82 2jm8 s VAL 53 N -1.53 0.17 0.12 -0.44 -7.23 0.35 -2.54 120.40 109.30 2jm8 s VAL 53 Ca 0.32 -1.80 -0.30 0.00 -1.81 0.00 0.00 61.98 58.38 2jm8 s VAL 53 Cb -0.12 -1.72 -0.07 0.00 0.56 0.00 0.00 36.38 35.04 2jm8 s VAL 53 CO 0.24 -0.76 1.21 -2.84 -0.31 0.00 0.00 175.10 172.64 2jm8 s PRO 54 N -3.97 4.46 0.56 4.82 0.02 -1.26 -0.29 135.00 139.35 2jm8 s PRO 54 Ca 0.14 1.83 0.25 0.00 0.02 0.00 0.00 61.00 63.24 2jm8 s PRO 54 Cb 0.07 -3.29 1.54 0.00 0.02 0.00 0.00 34.50 32.84 2jm8 s PRO 54 CO -0.05 -0.18 2.11 0.00 -0.33 0.00 0.00 177.00 178.54 2jm8 h ALA 55 N 6.10 1.96 -0.01 -1.55 0.00 -1.43 0.06 119.26 124.38 2jm8 h ALA 55 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2jm8 h ALA 55 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2jm8 h ALA 55 CO 0.78 -0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.76 2jm8 n ALA 56 N -2.44 2.64 0.39 0.00 0.00 -1.26 -3.29 120.51 116.55 2jm8 n ALA 56 Ca 0.02 -0.23 0.06 0.00 0.00 0.00 0.00 53.44 53.29 2jm8 n ALA 56 Cb 0.30 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.28 2jm8 n ALA 56 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jm8 n TYR 57 N -0.73 0.00 -4.43 0.00 4.02 0.01 -4.98 117.16 111.05 2jm8 n TYR 57 Ca 0.20 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.83 2jm8 n TYR 57 Cb 0.14 -0.08 -0.11 0.00 -0.02 0.00 0.00 39.34 39.26 2jm8 n TYR 57 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2jm8 s VAL 58 N -2.35 2.35 0.08 -0.72 -7.23 -1.21 -1.13 120.40 110.19 2jm8 s VAL 58 Ca 0.02 -2.11 0.10 0.00 -1.81 0.00 0.00 61.98 58.18 2jm8 s VAL 58 Cb 0.09 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.84 2jm8 s VAL 58 CO 0.50 -0.19 -0.26 -0.75 -0.31 0.00 0.00 175.10 174.09 2jm8 s LYS 59 N -2.86 1.66 -0.05 4.82 2.20 0.23 -4.91 119.74 120.84 2jm8 s LYS 59 Ca 0.23 -1.20 -0.30 0.00 -0.36 0.00 0.00 55.97 54.34 2jm8 s LYS 59 Cb -0.07 -1.96 -0.04 0.00 -1.51 0.00 0.00 37.83 34.25 2jm8 s LYS 59 CO 0.11 0.49 1.28 0.15 -0.36 0.00 0.00 175.35 177.02 2jm8 s LYS 60 N -1.57 4.31 -0.11 4.03 -0.14 -1.26 -0.39 119.74 124.60 2jm8 s LYS 60 Ca 0.13 1.78 0.12 0.00 -1.36 0.00 0.00 55.97 56.64 2jm8 s LYS 60 Cb -0.10 -3.59 0.55 0.00 -1.68 0.00 0.00 37.83 33.01 2jm8 s LYS 60 CO 0.04 -0.52 1.39 1.28 -0.76 0.00 0.00 175.35 176.78 2jm8 n LEU 61 N 5.41 3.87 0.00 3.17 4.77 -0.71 -4.88 117.00 128.63 2jm8 n LEU 61 Ca 0.12 -1.96 0.00 0.00 -0.03 0.00 0.00 56.01 54.14 2jm8 n LEU 61 Cb 0.45 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2jm8 n LEU 61 CO 0.56 0.58 0.19 -0.67 -1.33 0.00 0.00 177.39 176.73