#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jma n ASP 2 N 0.00 4.68 0.24 7.83 8.00 -1.26 -4.86 116.55 131.19 2jma n ASP 2 Ca 0.00 -3.51 0.15 0.00 0.71 0.00 0.00 54.79 52.14 2jma n ASP 2 Cb 0.00 -0.79 0.81 0.00 -0.02 0.00 0.00 41.12 41.12 2jma n ASP 2 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2jma h GLU 3 N 4.15 0.00 -0.58 -1.24 3.07 -2.04 0.97 114.58 118.91 2jma h GLU 3 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2jma h GLU 3 Cb 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 2jma h GLU 3 CO 0.95 0.00 0.00 -2.37 -1.40 0.00 0.00 179.01 176.19 2jma n THR 4 N -2.59 2.02 -1.96 1.13 5.66 -1.26 -4.54 114.28 112.73 2jma n THR 4 Ca -0.02 -1.30 -0.38 0.00 -3.05 0.00 0.00 64.05 59.30 2jma n THR 4 Cb 0.11 0.04 0.02 0.00 -1.55 0.00 0.00 70.33 68.95 2jma n THR 4 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jma n GLY 5 N 0.83 5.39 0.00 1.09 0.00 0.33 -4.88 105.19 107.95 2jma n GLY 5 Ca 0.25 -2.37 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2jma n GLY 5 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jma n LYS 6 N -0.09 0.37 -1.91 1.61 5.02 -1.26 -5.09 118.16 116.81 2jma n LYS 6 Ca 0.52 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.39 2jma n LYS 6 Cb 0.30 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.28 2jma n LYS 6 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2jma s GLU 7 N 0.84 3.88 0.13 1.97 2.12 -1.26 -4.89 118.70 121.49 2jma s GLU 7 Ca 0.00 2.07 0.01 0.00 0.36 0.00 0.00 54.97 57.41 2jma s GLU 7 Cb 0.00 -4.10 -0.04 0.00 0.26 0.00 0.00 34.13 30.25 2jma s GLU 7 CO 0.00 -1.22 0.29 -0.51 -0.54 0.00 0.00 175.26 173.28 2jma s LEU 8 N 5.18 4.32 0.09 2.70 1.43 -1.26 0.77 118.68 131.90 2jma s LEU 8 Ca 0.80 0.27 0.02 0.00 -1.03 0.00 0.00 54.13 54.19 2jma s LEU 8 Cb -0.32 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 2jma s LEU 8 CO 0.33 0.06 -0.07 0.68 0.23 0.00 0.00 176.35 177.58 2jma s VAL 9 N -1.70 0.69 -0.12 -1.59 -7.23 0.62 -1.68 120.40 109.39 2jma s VAL 9 Ca 0.36 -1.79 -0.02 0.00 -1.81 0.00 0.00 61.98 58.72 2jma s VAL 9 Cb -0.12 -1.50 -0.03 0.00 0.56 0.00 0.00 36.38 35.30 2jma s VAL 9 CO 0.28 -0.78 -0.03 -0.22 -0.31 0.00 0.00 175.10 174.05 2jma s LEU 10 N -2.78 3.36 -0.43 1.32 2.96 0.44 -0.56 118.68 123.00 2jma s LEU 10 Ca 0.08 -0.01 -0.25 0.00 -0.22 0.00 0.00 54.13 53.73 2jma s LEU 10 Cb 0.02 -1.78 0.02 0.00 0.50 0.00 0.00 46.19 44.95 2jma s LEU 10 CO -0.04 0.27 0.87 0.00 -1.32 0.00 0.00 176.35 176.14 2jma s ALA 11 N -0.25 3.30 0.15 5.97 0.00 -0.68 -1.14 121.76 129.10 2jma s ALA 11 Ca 0.05 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.20 2jma s ALA 11 Cb -0.13 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.42 2jma s ALA 11 CO 0.02 -1.87 1.37 -0.07 0.00 0.00 0.00 175.76 175.20 2jma h LEU 12 N 10.27 0.54 -8.75 0.00 4.07 -1.06 -1.36 115.31 119.02 2jma h LEU 12 Ca -0.24 -0.39 -0.30 0.00 0.08 0.00 0.00 57.88 57.02 2jma h LEU 12 Cb 1.08 -0.16 -0.15 0.00 1.08 0.00 0.00 40.66 42.51 2jma h LEU 12 CO 0.99 1.16 -0.63 -0.31 -1.08 0.00 0.00 178.44 178.57 2jma s TYR 13 N -3.47 1.35 0.12 1.13 2.02 -1.25 -4.76 117.35 112.49 2jma s TYR 13 Ca -0.06 -1.21 -0.28 0.00 -0.37 0.00 0.00 57.07 55.16 2jma s TYR 13 Cb 0.10 -0.76 -0.06 0.00 -0.40 0.00 0.00 41.96 40.83 2jma s TYR 13 CO 0.86 -0.40 0.87 0.34 -1.57 0.00 0.00 175.55 175.65 2jma s ASP 14 N -3.24 7.42 0.01 2.29 -1.08 -1.26 -3.57 116.67 117.24 2jma s ASP 14 Ca 0.35 1.69 0.03 0.00 -0.52 0.00 0.00 52.55 54.09 2jma s ASP 14 Cb 0.07 -2.54 -0.01 0.00 -1.46 0.00 0.00 42.92 38.98 2jma s ASP 14 CO 0.11 0.03 -0.08 -0.47 0.52 0.00 0.00 175.17 175.28 2jma s TYR 15 N -0.35 0.72 -0.13 -5.34 5.04 -0.84 -4.96 117.35 111.49 2jma s TYR 15 Ca 0.42 -0.24 0.01 0.00 -2.44 0.00 0.00 57.07 54.82 2jma s TYR 15 Cb -0.23 -0.45 -0.01 0.00 0.35 0.00 0.00 41.96 41.63 2jma s TYR 15 CO 0.27 -0.02 -0.17 -0.65 -1.34 0.00 0.00 175.55 173.65 2jma s GLN 16 N -0.62 3.26 0.40 4.97 -1.52 -1.26 -1.95 119.66 122.94 2jma s GLN 16 Ca -0.00 -0.75 -0.27 0.00 -1.95 0.00 0.00 55.36 52.39 2jma s GLN 16 Cb -0.05 -2.54 -0.09 0.00 -0.22 0.00 0.00 33.01 30.11 2jma s GLN 16 CO 0.00 0.16 1.39 -1.83 -0.25 0.00 0.00 175.29 174.76 2jma s GLU 17 N 0.46 3.96 -0.16 2.91 -1.05 -1.26 -4.91 118.70 118.64 2jma s GLU 17 Ca -0.12 2.36 -0.03 0.00 -0.15 0.00 0.00 54.97 57.04 2jma s GLU 17 Cb -0.16 -2.82 -0.09 0.00 -0.44 0.00 0.00 34.13 30.61 2jma s GLU 17 CO 0.05 -0.57 -0.17 1.63 0.95 0.00 0.00 175.26 177.15 2jma n LYS 18 N 0.20 0.38 -4.09 -4.83 5.02 -1.26 -4.98 118.16 108.59 2jma n LYS 18 Ca 0.03 0.12 -0.24 0.00 -2.02 0.00 0.00 58.31 56.20 2jma n LYS 18 Cb 0.42 -1.23 -0.07 0.00 -0.02 0.00 0.00 35.03 34.13 2jma n LYS 18 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2jma s SER 19 N -5.91 4.54 0.00 4.39 1.04 -1.26 -5.00 113.70 111.50 2jma s SER 19 Ca -0.22 -0.94 0.06 0.00 0.48 0.00 0.00 55.95 55.33 2jma s SER 19 Cb 0.07 -0.57 0.32 0.00 0.10 0.00 0.00 66.02 65.94 2jma s SER 19 CO 0.34 -0.44 1.03 -2.65 0.98 0.00 0.00 173.24 172.49 2jma n PRO 20 N -1.21 0.10 -0.22 4.02 -0.02 -1.26 -1.17 135.00 135.24 2jma n PRO 20 Ca -0.02 0.20 0.10 0.00 -2.02 0.00 0.00 63.50 61.77 2jma n PRO 20 Cb 0.63 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.83 2jma n PRO 20 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jma n ALA 21 N -1.25 2.36 -2.58 3.55 0.00 -1.26 -4.96 120.51 116.37 2jma n ALA 21 Ca 0.03 -1.08 -0.26 0.00 0.00 0.00 0.00 53.44 52.13 2jma n ALA 21 Cb 0.05 -0.75 -0.09 0.00 0.00 0.00 0.00 19.45 18.65 2jma n ALA 21 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2jma s GLU 22 N -1.20 2.07 -0.01 0.00 2.02 -0.32 0.13 118.70 121.40 2jma s GLU 22 Ca 0.36 -1.34 0.05 0.00 0.02 0.00 0.00 54.97 54.06 2jma s GLU 22 Cb 0.20 -2.13 -0.01 0.00 0.10 0.00 0.00 34.13 32.29 2jma s GLU 22 CO 0.27 0.41 -0.15 0.14 0.02 0.00 0.00 175.26 175.95 2jma s VAL 23 N -1.89 1.19 -0.04 2.63 -7.23 -0.90 -4.65 120.40 109.51 2jma s VAL 23 Ca 0.27 -0.64 -0.29 0.00 -1.81 0.00 0.00 61.98 59.50 2jma s VAL 23 Cb -0.08 -0.99 -0.02 0.00 0.56 0.00 0.00 36.38 35.84 2jma s VAL 23 CO 0.16 0.34 0.96 -0.89 -0.31 0.00 0.00 175.10 175.36 2jma s THR 24 N -0.35 4.86 0.34 5.32 2.01 -1.26 -4.38 115.64 122.18 2jma s THR 24 Ca 0.06 1.98 0.06 0.00 0.31 0.00 0.00 61.69 64.10 2jma s THR 24 Cb -0.06 -4.29 -0.07 0.00 0.01 0.00 0.00 72.50 68.10 2jma s THR 24 CO -0.01 0.11 0.01 0.00 -0.69 0.00 0.00 174.62 174.05 2jma s MET 25 N 1.34 1.74 0.04 4.92 0.23 -0.82 -4.97 119.30 121.78 2jma s MET 25 Ca 0.49 -1.95 0.04 0.00 -1.03 0.00 0.00 55.69 53.23 2jma s MET 25 Cb -0.20 -1.21 -0.02 0.00 -1.53 0.00 0.00 34.83 31.87 2jma s MET 25 CO 0.23 -0.08 -0.11 0.15 -2.03 0.00 0.00 175.02 173.18 2jma s LYS 26 N -3.79 0.73 0.19 3.16 3.01 -1.26 -1.98 119.74 119.80 2jma s LYS 26 Ca 0.34 -0.71 -0.31 0.00 -1.01 0.00 0.00 55.97 54.28 2jma s LYS 26 Cb 0.08 -0.67 -0.10 0.00 -1.01 0.00 0.00 37.83 36.13 2jma s LYS 26 CO 0.16 0.16 1.57 0.21 0.51 0.00 0.00 175.35 177.96 2jma s LYS 27 N -1.22 4.20 0.00 1.68 2.47 -1.23 -2.09 119.74 123.55 2jma s LYS 27 Ca -0.02 2.40 0.00 0.00 -1.56 0.00 0.00 55.97 56.79 2jma s LYS 27 Cb -0.08 -3.13 0.00 0.00 -1.46 0.00 0.00 37.83 33.16 2jma s LYS 27 CO 0.01 -0.61 0.00 0.41 0.16 0.00 0.00 175.35 175.32 2jma n GLY 28 N 3.50 0.62 3.91 5.54 0.00 -0.51 -4.98 105.19 113.26 2jma n GLY 28 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2jma n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jma s ASP 29 N -2.84 6.43 -0.38 1.61 1.11 -0.89 -4.93 116.67 116.78 2jma s ASP 29 Ca 0.00 0.45 -0.14 0.00 0.18 0.00 0.00 52.55 53.04 2jma s ASP 29 Cb 0.00 -2.03 0.01 0.00 1.07 0.00 0.00 42.92 41.96 2jma s ASP 29 CO 0.00 0.11 0.26 -0.63 1.18 0.00 0.00 175.17 176.09 2jma s ILE 30 N -1.58 5.17 0.19 0.77 1.09 -1.26 -1.68 121.20 123.90 2jma s ILE 30 Ca 0.38 -0.51 -0.02 0.00 -1.10 0.00 0.00 60.65 59.41 2jma s ILE 30 Cb -0.13 -3.79 -0.04 0.00 -1.06 0.00 0.00 42.46 37.44 2jma s ILE 30 CO 0.26 -0.18 0.39 -0.76 -0.10 0.00 0.00 174.94 174.56 2jma s LEU 31 N 1.68 4.22 -0.22 2.97 2.01 0.28 -4.93 118.68 124.70 2jma s LEU 31 Ca 0.05 0.45 -0.07 0.00 0.01 0.00 0.00 54.13 54.56 2jma s LEU 31 Cb -0.18 -3.21 -0.04 0.00 0.01 0.00 0.00 46.19 42.77 2jma s LEU 31 CO 0.10 -0.03 0.07 -0.89 1.01 0.00 0.00 176.35 176.60 2jma s THR 32 N -1.84 4.55 0.12 5.49 2.01 -1.00 -0.28 115.64 124.69 2jma s THR 32 Ca 0.39 -0.10 -0.30 0.00 0.31 0.00 0.00 61.69 61.99 2jma s THR 32 Cb -0.11 -3.09 -0.06 0.00 0.01 0.00 0.00 72.50 69.25 2jma s THR 32 CO 0.28 0.39 1.03 -0.76 -0.69 0.00 0.00 174.62 174.88 2jma s LEU 33 N 1.00 4.47 -0.05 4.42 1.43 0.23 -0.44 118.68 129.74 2jma s LEU 33 Ca 0.04 1.90 0.01 0.00 -1.03 0.00 0.00 54.13 55.05 2jma s LEU 33 Cb -0.14 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 2jma s LEU 33 CO 0.03 -0.18 -0.04 0.18 0.23 0.00 0.00 176.35 176.57 2jma n LEU 34 N 2.88 2.61 -3.62 1.79 4.77 0.82 -4.40 117.00 121.85 2jma n LEU 34 Ca 0.03 -0.02 -0.04 0.00 -0.03 0.00 0.00 56.01 55.95 2jma n LEU 34 Cb 0.48 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.36 2jma n LEU 34 CO 0.53 0.53 0.16 0.21 -1.33 0.00 0.00 177.39 177.48 2jma s ASN 35 N -4.38 -0.80 -0.26 -1.43 3.84 -0.92 -4.99 114.94 106.00 2jma s ASN 35 Ca -0.06 1.30 0.11 0.00 0.21 0.00 0.00 52.86 54.41 2jma s ASN 35 Cb 0.02 1.92 0.46 0.00 -0.55 0.00 0.00 41.25 43.10 2jma s ASN 35 CO 0.13 -0.23 1.19 -1.54 -2.79 0.00 0.00 177.10 173.85 2jma n SER 36 N 5.43 3.73 0.02 -4.21 3.41 -1.26 -0.25 113.62 120.48 2jma n SER 36 Ca -0.10 -3.50 0.13 0.00 -0.26 0.00 0.00 58.87 55.14 2jma n SER 36 Cb 0.49 -0.39 0.53 0.00 -0.26 0.00 0.00 64.21 64.58 2jma n SER 36 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2jma n THR 37 N -0.73 0.28 -3.94 6.66 5.66 -1.26 -4.74 114.28 116.21 2jma n THR 37 Ca 0.33 0.01 -0.32 0.00 -3.05 0.00 0.00 64.05 61.02 2jma n THR 37 Cb 0.90 -0.62 -0.05 0.00 -1.55 0.00 0.00 70.33 69.01 2jma n THR 37 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2jma s ASN 38 N -3.24 6.25 0.03 1.09 3.84 -1.26 -5.02 114.94 116.63 2jma s ASN 38 Ca 0.12 0.27 0.16 0.00 0.21 0.00 0.00 52.86 53.62 2jma s ASN 38 Cb 0.16 -1.92 -0.16 0.00 -0.55 0.00 0.00 41.25 38.78 2jma s ASN 38 CO 0.49 0.22 0.77 0.29 -2.79 0.00 0.00 177.10 176.08 2jma n LYS 39 N 0.66 0.62 -0.04 0.43 5.02 -1.26 -4.31 118.16 119.29 2jma n LYS 39 Ca -0.08 0.24 0.04 0.00 -2.02 0.00 0.00 58.31 56.48 2jma n LYS 39 Cb 0.52 -1.80 -0.16 0.00 -0.02 0.00 0.00 35.03 33.57 2jma n LYS 39 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2jma n ASP 40 N -2.92 0.26 -3.96 4.39 8.00 -1.26 -4.65 116.55 116.40 2jma n ASP 40 Ca -0.12 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.18 2jma n ASP 40 Cb 0.90 1.62 -0.16 0.00 -0.02 0.00 0.00 41.12 43.46 2jma n ASP 40 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2jma s TRP 41 N -3.11 0.93 -0.07 1.24 0.52 -1.26 -0.94 118.94 116.25 2jma s TRP 41 Ca -0.08 -0.26 0.05 0.00 0.02 0.00 0.00 56.10 55.83 2jma s TRP 41 Cb 0.11 -0.71 -0.01 0.00 -1.15 0.00 0.00 33.47 31.71 2jma s TRP 41 CO 0.84 -0.15 -0.24 -1.58 0.02 0.00 0.00 176.95 175.83 2jma s TRP 42 N 0.51 2.46 -0.20 -1.98 0.52 0.70 -4.06 118.94 116.88 2jma s TRP 42 Ca -0.08 -0.83 -0.26 0.00 0.02 0.00 0.00 56.10 54.95 2jma s TRP 42 Cb -0.12 -1.62 -0.00 0.00 -1.15 0.00 0.00 33.47 30.58 2jma s TRP 42 CO 0.01 -0.28 0.91 0.21 0.02 0.00 0.00 176.95 177.81 2jma s LYS 43 N 0.01 4.26 0.34 4.98 2.20 0.65 -0.93 119.74 131.25 2jma s LYS 43 Ca -0.09 1.12 0.03 0.00 -0.36 0.00 0.00 55.97 56.68 2jma s LYS 43 Cb -0.15 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 2jma s LYS 43 CO 0.05 -0.47 0.12 0.14 -0.36 0.00 0.00 175.35 174.83 2jma s VAL 44 N 2.66 0.66 -0.07 4.02 -7.23 0.99 -0.13 120.40 121.29 2jma s VAL 44 Ca 0.40 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.58 2jma s VAL 44 Cb -0.16 -2.55 0.02 0.00 0.56 0.00 0.00 36.38 34.25 2jma s VAL 44 CO 0.09 0.00 -0.09 -0.70 -0.31 0.00 0.00 175.10 174.09 2jma s GLU 45 N -3.83 1.44 -0.22 4.82 2.12 0.41 -1.41 118.70 122.03 2jma s GLU 45 Ca 0.32 -0.30 0.02 0.00 0.36 0.00 0.00 54.97 55.38 2jma s GLU 45 Cb 0.06 -1.30 0.04 0.00 0.26 0.00 0.00 34.13 33.19 2jma s GLU 45 CO 0.16 -0.06 -0.14 0.14 -0.54 0.00 0.00 175.26 174.81 2jma s VAL 46 N 0.96 2.08 0.00 3.70 -7.23 0.47 -2.38 120.40 118.00 2jma s VAL 46 Ca -0.09 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 2jma s VAL 46 Cb -0.15 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.72 2jma s VAL 46 CO 0.00 0.21 0.00 -0.46 -0.31 0.00 0.00 175.10 174.54 2jma n ASN 47 N 4.52 0.00 0.00 4.85 0.23 -1.26 -0.01 115.26 123.59 2jma n ASN 47 Ca -0.17 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.88 2jma n ASN 47 Cb 0.45 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.15 2jma n ASN 47 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2jma n ASP 48 N 0.00 0.00 -4.68 0.53 2.03 -1.26 -5.04 116.55 108.13 2jma n ASP 48 Ca 0.00 -0.09 -0.36 0.00 0.52 0.00 0.00 54.79 54.85 2jma n ASP 48 Cb 0.00 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.31 2jma n ASP 48 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2jma s ARG 49 N 0.00 4.12 -0.09 -0.67 1.81 0.98 -5.08 118.95 120.03 2jma s ARG 49 Ca 0.00 -0.18 -0.02 0.00 -1.72 0.00 0.00 55.73 53.81 2jma s ARG 49 Cb 0.00 -3.51 -0.03 0.00 -0.45 0.00 0.00 34.95 30.96 2jma s ARG 49 CO 0.00 0.11 -0.01 -0.65 -0.68 0.00 0.00 175.30 174.07 2jma s GLN 50 N 0.92 3.01 0.00 3.54 -0.21 -1.26 -0.40 119.66 125.26 2jma s GLN 50 Ca 0.10 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 55.05 2jma s GLN 50 Cb -0.13 -2.78 0.00 0.00 1.00 0.00 0.00 33.01 31.10 2jma s GLN 50 CO 0.04 0.66 0.00 0.41 -2.12 0.00 0.00 175.29 174.28 2jma n GLY 51 N 2.26 -1.37 3.87 3.09 0.00 -0.50 -4.78 105.19 107.77 2jma n GLY 51 Ca -0.18 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 2jma n GLY 51 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jma s PHE 52 N -2.82 3.42 0.05 1.61 0.40 0.12 -0.01 117.98 120.74 2jma s PHE 52 Ca 0.00 0.21 -0.02 0.00 -0.60 0.00 0.00 56.93 56.52 2jma s PHE 52 Cb 0.00 -1.73 -0.03 0.00 0.51 0.00 0.00 43.02 41.77 2jma s PHE 52 CO 0.00 0.57 -0.00 0.14 0.70 0.00 0.00 175.22 176.63 2jma s VAL 53 N -1.44 0.20 0.15 -0.44 -7.23 -0.10 -2.11 120.40 109.43 2jma s VAL 53 Ca 0.32 -1.64 -0.31 0.00 -1.81 0.00 0.00 61.98 58.54 2jma s VAL 53 Cb -0.13 -1.38 -0.11 0.00 0.56 0.00 0.00 36.38 35.33 2jma s VAL 53 CO 0.25 -0.91 1.80 -2.84 -0.31 0.00 0.00 175.10 173.09 2jma s PRO 54 N -3.66 4.13 0.45 4.82 0.02 -1.26 -0.21 135.00 139.29 2jma s PRO 54 Ca 0.04 2.61 0.12 0.00 0.02 0.00 0.00 61.00 63.79 2jma s PRO 54 Cb 0.06 -3.41 1.03 0.00 0.02 0.00 0.00 34.50 32.20 2jma s PRO 54 CO -0.09 -0.81 2.06 0.00 -0.33 0.00 0.00 177.00 177.83 2jma h ALA 55 N 7.97 1.79 0.00 -1.55 0.00 -1.30 -0.10 119.26 126.06 2jma h ALA 55 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jma h ALA 55 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2jma h ALA 55 CO 0.95 0.17 0.00 0.00 0.00 0.00 0.00 179.25 180.37 2jma n ALA 56 N -2.51 1.95 0.73 0.00 0.00 -1.26 -2.07 120.51 117.34 2jma n ALA 56 Ca -0.01 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.46 2jma n ALA 56 Cb 0.13 -1.30 0.11 0.00 0.00 0.00 0.00 19.45 18.39 2jma n ALA 56 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jma n TYR 57 N -1.35 0.11 -4.07 0.00 4.02 -0.05 -4.92 117.16 110.90 2jma n TYR 57 Ca 0.07 -0.06 -0.13 0.00 -0.01 0.00 0.00 57.90 57.77 2jma n TYR 57 Cb 0.17 -0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.37 2jma n TYR 57 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2jma s VAL 58 N -1.66 0.55 -0.01 -0.72 1.01 -0.88 -0.42 120.40 118.27 2jma s VAL 58 Ca 0.27 -1.11 0.02 0.00 0.00 0.00 0.00 61.98 61.16 2jma s VAL 58 Cb 0.18 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.91 2jma s VAL 58 CO 0.27 -0.40 -0.07 -0.75 0.00 0.00 0.00 175.10 174.15 2jma s LYS 59 N -1.66 0.59 0.08 2.72 2.20 -0.30 -4.91 119.74 118.46 2jma s LYS 59 Ca -0.09 -0.23 -0.32 0.00 -0.36 0.00 0.00 55.97 54.97 2jma s LYS 59 Cb -0.09 -0.58 -0.11 0.00 -1.51 0.00 0.00 37.83 35.54 2jma s LYS 59 CO 0.00 0.12 1.84 1.63 -0.36 0.00 0.00 175.35 178.58 2jma n LYS 60 N 3.05 2.66 0.12 4.03 4.01 -1.26 -0.42 118.16 130.36 2jma n LYS 60 Ca -0.15 0.97 0.12 0.00 -0.51 0.00 0.00 58.31 58.74 2jma n LYS 60 Cb 0.57 -2.85 0.15 0.00 -0.51 0.00 0.00 35.03 32.38 2jma n LYS 60 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 2jma h LEU 61 N 8.71 0.00 -1.12 -0.35 3.38 -1.65 -3.46 115.31 120.82 2jma h LEU 61 Ca -0.47 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2jma h LEU 61 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2jma h LEU 61 CO 0.94 0.03 0.00 -0.67 0.09 0.00 0.00 178.44 178.83