#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 3.98 0.34 7.83 8.00 -1.26 -4.87 116.55 130.57 2jma n ASP 2 Ca 0.00 -3.52 0.20 0.00 0.71 0.00 0.00 54.79 52.18 2jma n ASP 2 Cb 0.00 -0.64 1.07 0.00 -0.02 0.00 0.00 41.12 41.53 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 3.84 0.00 -0.47 -1.24 3.07 -2.03 0.12 114.58 117.87 2jma h GLU 3 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2jma h GLU 3 Cb 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.53 2jma h GLU 3 CO 0.84 0.00 0.00 -2.37 -1.40 0.00 0.00 179.01 176.08 2jma n THR 4 N -3.04 2.33 -2.40 1.13 5.66 -1.26 -4.63 114.28 112.07 2jma n THR 4 Ca -0.03 -1.50 -0.40 0.00 -3.05 0.00 0.00 64.05 59.07 2jma n THR 4 Cb 0.19 -0.14 0.02 0.00 -1.55 0.00 0.00 70.33 68.84 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 0.35 5.87 0.00 1.09 0.00 0.40 -4.89 105.19 108.02 2jma n GLY 5 Ca 0.24 -2.48 0.00 0.00 0.00 0.00 0.00 46.02 43.78 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 0.08 0.00 -2.05 1.61 5.02 -1.26 -5.07 118.16 116.49 2jma n LYS 6 Ca 0.50 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.37 2jma n LYS 6 Cb 0.26 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.25 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 -0.37 3.96 0.27 1.97 2.12 -1.26 -4.86 118.70 120.52 2jma s GLU 7 Ca 0.00 1.93 -0.10 0.00 0.36 0.00 0.00 54.97 57.16 2jma s GLU 7 Cb 0.00 -4.02 -0.07 0.00 0.26 0.00 0.00 34.13 30.30 2jma s GLU 7 CO 0.00 -1.10 0.60 -0.51 -0.54 0.00 0.00 175.26 173.70 2jma s LEU 8 N 4.74 4.11 0.16 2.70 1.43 -1.26 0.22 118.68 130.78 2jma s LEU 8 Ca 0.73 0.96 0.05 0.00 -1.03 0.00 0.00 54.13 54.84 2jma s LEU 8 Cb -0.29 -3.75 -0.04 0.00 0.03 0.00 0.00 46.19 42.14 2jma s LEU 8 CO 0.29 -0.14 -0.10 0.68 0.23 0.00 0.00 176.35 177.32 2jma s VAL 9 N -1.93 1.19 -0.09 -1.59 -7.23 0.71 -1.02 120.40 110.45 2jma s VAL 9 Ca 0.48 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 2jma s VAL 9 Cb -0.11 -1.90 -0.02 0.00 0.56 0.00 0.00 36.38 34.91 2jma s VAL 9 CO 0.23 -0.71 -0.12 -0.22 -0.31 0.00 0.00 175.10 173.97 2jma s LEU 10 N -3.19 2.80 -0.48 1.32 2.96 0.21 -0.37 118.68 121.93 2jma s LEU 10 Ca 0.18 -0.23 -0.28 0.00 -0.22 0.00 0.00 54.13 53.59 2jma s LEU 10 Cb 0.03 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 45.14 2jma s LEU 10 CO 0.02 0.27 1.06 0.00 -1.32 0.00 0.00 176.35 176.37 2jma s ALA 11 N -0.25 3.18 0.17 5.97 0.00 0.15 -1.39 121.76 129.59 2jma s ALA 11 Ca 0.02 -0.62 -0.03 0.00 0.00 0.00 0.00 51.96 51.33 2jma s ALA 11 Cb -0.13 -3.80 0.04 0.00 0.00 0.00 0.00 23.12 19.23 2jma s ALA 11 CO 0.03 -2.20 1.42 -0.07 0.00 0.00 0.00 175.76 174.94 2jma h LEU 12 N 10.99 0.53 -8.66 0.00 4.07 -0.89 -1.76 115.31 119.60 2jma h LEU 12 Ca -0.23 -0.35 -0.27 0.00 0.08 0.00 0.00 57.88 57.11 2jma h LEU 12 Cb 1.07 -0.16 -0.15 0.00 1.08 0.00 0.00 40.66 42.50 2jma h LEU 12 CO 1.09 1.09 -0.63 -0.31 -1.08 0.00 0.00 178.44 178.60 2jma s TYR 13 N -3.64 1.22 0.16 1.13 2.02 -1.24 -4.76 117.35 112.24 2jma s TYR 13 Ca -0.06 -1.23 -0.30 0.00 -0.37 0.00 0.00 57.07 55.11 2jma s TYR 13 Cb 0.10 -0.67 -0.07 0.00 -0.40 0.00 0.00 41.96 40.92 2jma s TYR 13 CO 0.85 -0.45 1.01 0.34 -1.57 0.00 0.00 175.55 175.73 2jma s ASP 14 N -3.19 7.43 0.01 2.29 2.15 -1.26 -3.80 116.67 120.30 2jma s ASP 14 Ca 0.33 1.95 0.00 0.00 0.43 0.00 0.00 52.55 55.26 2jma s ASP 14 Cb 0.07 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 40.08 2jma s ASP 14 CO 0.09 -0.09 -0.02 -0.47 -0.17 0.00 0.00 175.17 174.51 2jma s TYR 15 N -0.33 0.17 -0.09 -5.34 5.04 -0.95 -4.96 117.35 110.89 2jma s TYR 15 Ca 0.47 -0.24 0.04 0.00 -2.44 0.00 0.00 57.07 54.89 2jma s TYR 15 Cb -0.26 -0.12 -0.01 0.00 0.35 0.00 0.00 41.96 41.92 2jma s TYR 15 CO 0.32 -0.08 -0.21 -0.65 -1.34 0.00 0.00 175.55 173.59 2jma s GLN 16 N -0.67 2.97 0.31 4.97 -1.52 -1.26 -1.89 119.66 122.56 2jma s GLN 16 Ca -0.07 -0.83 -0.29 0.00 -1.95 0.00 0.00 55.36 52.22 2jma s GLN 16 Cb -0.05 -2.34 -0.11 0.00 -0.22 0.00 0.00 33.01 30.29 2jma s GLN 16 CO -0.00 0.26 1.47 -1.83 -0.25 0.00 0.00 175.29 174.94 2jma s GLU 17 N 0.16 4.20 -0.01 2.91 -1.05 -1.26 -4.90 118.70 118.75 2jma s GLU 17 Ca -0.12 2.43 0.10 0.00 -0.15 0.00 0.00 54.97 57.23 2jma s GLU 17 Cb -0.16 -3.04 -0.15 0.00 -0.44 0.00 0.00 34.13 30.34 2jma s GLU 17 CO 0.06 -0.47 0.27 1.63 0.95 0.00 0.00 175.26 177.71 2jma n LYS 18 N 1.56 1.13 -4.26 -4.83 5.02 -1.26 -4.97 118.16 110.55 2jma n LYS 18 Ca 0.05 -0.07 -0.15 0.00 -2.02 0.00 0.00 58.31 56.12 2jma n LYS 18 Cb 0.39 -1.18 -0.10 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 -2.88 0.73 0.00 4.39 1.04 -1.26 -5.02 113.70 110.70 2jma s SER 19 Ca -0.02 -1.42 0.07 0.00 0.48 0.00 0.00 55.95 55.05 2jma s SER 19 Cb 0.07 0.31 0.29 0.00 0.10 0.00 0.00 66.02 66.79 2jma s SER 19 CO 0.42 -0.82 1.18 -2.65 0.98 0.00 0.00 173.24 172.36 2jma n PRO 20 N -0.39 0.02 -0.65 4.02 -0.02 -1.26 -1.53 135.00 135.19 2jma n PRO 20 Ca 0.01 0.36 0.01 0.00 -2.02 0.00 0.00 63.50 61.86 2jma n PRO 20 Cb 0.66 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.85 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 -1.46 3.78 -2.65 3.55 0.00 -1.26 -4.97 120.51 117.50 2jma n ALA 21 Ca 0.02 -2.83 -0.20 0.00 0.00 0.00 0.00 53.44 50.43 2jma n ALA 21 Cb 0.07 -0.72 -0.12 0.00 0.00 0.00 0.00 19.45 18.67 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 -3.09 0.94 0.03 0.00 2.02 -0.58 -0.32 118.70 117.70 2jma s GLU 22 Ca 0.43 -0.97 0.06 0.00 0.02 0.00 0.00 54.97 54.52 2jma s GLU 22 Cb 0.38 -1.01 -0.02 0.00 0.10 0.00 0.00 34.13 33.58 2jma s GLU 22 CO 0.03 0.23 -0.18 0.14 0.02 0.00 0.00 175.26 175.51 2jma s VAL 23 N -1.15 1.42 0.20 2.63 -7.23 -1.01 -4.68 120.40 110.58 2jma s VAL 23 Ca 0.01 -1.04 -0.26 0.00 -1.81 0.00 0.00 61.98 58.88 2jma s VAL 23 Cb -0.10 -1.24 -0.08 0.00 0.56 0.00 0.00 36.38 35.52 2jma s VAL 23 CO 0.03 0.18 0.83 -0.89 -0.31 0.00 0.00 175.10 174.93 2jma s THR 24 N -0.73 4.29 0.21 5.32 2.01 -1.26 -4.29 115.64 121.18 2jma s THR 24 Ca 0.05 1.80 0.00 0.00 0.31 0.00 0.00 61.69 63.85 2jma s THR 24 Cb -0.08 -4.17 -0.05 0.00 0.01 0.00 0.00 72.50 68.21 2jma s THR 24 CO 0.01 0.48 0.08 0.00 -0.69 0.00 0.00 174.62 174.50 2jma s MET 25 N -1.25 1.22 0.06 4.92 0.23 -0.79 -4.96 119.30 118.73 2jma s MET 25 Ca 0.38 -1.64 0.03 0.00 -1.03 0.00 0.00 55.69 53.44 2jma s MET 25 Cb -0.23 -0.04 -0.03 0.00 -1.53 0.00 0.00 34.83 33.00 2jma s MET 25 CO 0.27 -0.29 -0.10 0.15 -2.03 0.00 0.00 175.02 173.03 2jma s LYS 26 N -4.05 0.67 0.18 3.16 3.01 -1.26 -2.23 119.74 119.22 2jma s LYS 26 Ca 0.34 -0.90 -0.32 0.00 -1.01 0.00 0.00 55.97 54.07 2jma s LYS 26 Cb 0.07 -0.47 -0.12 0.00 -1.01 0.00 0.00 37.83 36.30 2jma s LYS 26 CO 0.10 0.09 1.73 1.17 0.51 0.00 0.00 175.35 178.94 2jma n LYS 27 N 1.20 2.67 -0.08 1.68 3.00 -1.25 -1.41 118.16 123.97 2jma n LYS 27 Ca -0.21 0.97 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 2jma n LYS 27 Cb 0.55 -2.81 0.00 0.00 0.00 0.00 0.00 35.03 32.77 2jma n LYS 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2jma n GLY 28 N 3.95 0.54 3.83 3.14 0.00 -0.66 -4.99 105.19 111.00 2jma n GLY 28 Ca 0.17 0.00 -0.34 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 -2.66 6.90 -0.28 1.61 1.01 -0.50 -4.87 116.67 117.88 2jma s ASP 29 Ca 0.00 1.30 -0.10 0.00 0.71 0.00 0.00 52.55 54.46 2jma s ASP 29 Cb 0.00 -2.37 -0.03 0.00 1.01 0.00 0.00 42.92 41.52 2jma s ASP 29 CO 0.00 -0.05 0.16 -0.63 0.21 0.00 0.00 175.17 174.86 2jma s ILE 30 N -1.69 4.92 0.20 0.77 1.09 -1.26 -0.67 121.20 124.56 2jma s ILE 30 Ca 0.46 -0.07 0.05 0.00 -1.10 0.00 0.00 60.65 60.00 2jma s ILE 30 Cb -0.14 -3.38 -0.03 0.00 -1.06 0.00 0.00 42.46 37.84 2jma s ILE 30 CO 0.19 0.21 0.25 -0.76 -0.10 0.00 0.00 174.94 174.74 2jma s LEU 31 N 1.69 4.09 -0.19 2.97 2.01 0.50 -4.93 118.68 124.82 2jma s LEU 31 Ca 0.06 -0.03 -0.06 0.00 0.01 0.00 0.00 54.13 54.11 2jma s LEU 31 Cb -0.16 -2.65 -0.03 0.00 0.01 0.00 0.00 46.19 43.35 2jma s LEU 31 CO 0.08 -0.00 0.04 -0.89 1.01 0.00 0.00 176.35 176.59 2jma s THR 32 N -1.91 4.40 0.14 5.49 2.01 -0.89 -0.20 115.64 124.67 2jma s THR 32 Ca 0.33 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.87 2jma s THR 32 Cb -0.09 -2.99 -0.07 0.00 0.01 0.00 0.00 72.50 69.36 2jma s THR 32 CO 0.27 0.43 0.96 -0.76 -0.69 0.00 0.00 174.62 174.83 2jma s LEU 33 N 0.73 4.53 -0.05 4.42 1.43 0.13 -0.33 118.68 129.55 2jma s LEU 33 Ca 0.02 1.84 -0.00 0.00 -1.03 0.00 0.00 54.13 54.95 2jma s LEU 33 Cb -0.14 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 2jma s LEU 33 CO 0.02 -0.02 -0.05 0.18 0.23 0.00 0.00 176.35 176.71 2jma n LEU 34 N 2.50 2.56 -3.71 1.79 4.77 0.80 -4.39 117.00 121.33 2jma n LEU 34 Ca 0.01 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2jma n LEU 34 Cb 0.49 -0.16 -0.10 0.00 -2.33 0.00 0.00 43.42 41.32 2jma n LEU 34 CO 0.51 0.50 0.13 0.21 -1.33 0.00 0.00 177.39 177.42 2jma s ASN 35 N -4.63 -0.52 -0.20 -1.43 3.84 -0.89 -4.99 114.94 106.13 2jma s ASN 35 Ca -0.07 0.96 0.23 0.00 0.21 0.00 0.00 52.86 54.19 2jma s ASN 35 Cb 0.02 0.93 0.49 0.00 -0.55 0.00 0.00 41.25 42.14 2jma s ASN 35 CO 0.11 -0.17 1.13 -1.54 -2.79 0.00 0.00 177.10 173.83 2jma n SER 36 N 3.26 1.56 0.00 -4.21 3.41 -1.26 -0.50 113.62 115.88 2jma n SER 36 Ca -0.16 -2.10 0.13 0.00 -0.26 0.00 0.00 58.87 56.47 2jma n SER 36 Cb 0.56 -0.43 0.59 0.00 -0.26 0.00 0.00 64.21 64.67 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 -0.36 0.21 -4.07 6.66 5.66 -1.26 -4.73 114.28 116.39 2jma n THR 37 Ca 0.08 0.05 -0.32 0.00 -3.05 0.00 0.00 64.05 60.81 2jma n THR 37 Cb 0.88 -0.61 -0.07 0.00 -1.55 0.00 0.00 70.33 68.99 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 -2.85 5.72 0.00 1.09 3.84 -1.26 -5.02 114.94 116.47 2jma s ASN 38 Ca 0.17 0.13 0.25 0.00 0.21 0.00 0.00 52.86 53.61 2jma s ASN 38 Cb 0.17 -1.64 0.41 0.00 -0.55 0.00 0.00 41.25 39.64 2jma s ASN 38 CO 0.44 0.24 1.35 2.29 -2.79 0.00 0.00 177.10 178.63 2jma n LYS 39 N 0.94 0.80 -0.00 0.43 2.85 -1.26 -4.35 118.16 117.57 2jma n LYS 39 Ca -0.11 -0.56 0.00 0.00 -1.05 0.00 0.00 58.31 56.58 2jma n LYS 39 Cb 0.52 -1.49 -0.01 0.00 -0.65 0.00 0.00 35.03 33.41 2jma n LYS 39 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2jma n ASP 40 N -0.61 4.79 -3.96 -5.58 8.00 -1.26 -4.76 116.55 113.17 2jma n ASP 40 Ca 0.10 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.39 2jma n ASP 40 Cb 0.38 0.80 -0.16 0.00 -0.02 0.00 0.00 41.12 42.12 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 -2.04 0.92 -0.03 1.24 0.52 -1.26 -0.29 118.94 117.98 2jma s TRP 41 Ca -0.00 -0.26 0.07 0.00 0.02 0.00 0.00 56.10 55.93 2jma s TRP 41 Cb 0.00 -0.70 -0.02 0.00 -1.15 0.00 0.00 33.47 31.61 2jma s TRP 41 CO 0.04 -0.15 -0.25 -1.58 0.02 0.00 0.00 176.95 175.03 2jma s TRP 42 N 0.49 2.31 -0.30 -1.98 0.52 0.56 -4.18 118.94 116.36 2jma s TRP 42 Ca -0.08 -0.54 -0.26 0.00 0.02 0.00 0.00 56.10 55.24 2jma s TRP 42 Cb -0.11 -1.50 0.01 0.00 -1.15 0.00 0.00 33.47 30.72 2jma s TRP 42 CO 0.01 -0.11 0.93 0.21 0.02 0.00 0.00 176.95 178.01 2jma s LYS 43 N -0.40 4.04 0.32 4.98 2.20 0.34 -1.03 119.74 130.18 2jma s LYS 43 Ca 0.04 0.86 0.03 0.00 -0.36 0.00 0.00 55.97 56.55 2jma s LYS 43 Cb -0.11 -3.72 -0.06 0.00 -1.51 0.00 0.00 37.83 32.42 2jma s LYS 43 CO 0.01 -0.76 0.07 0.14 -0.36 0.00 0.00 175.35 174.44 2jma s VAL 44 N 3.26 1.07 -0.08 4.02 -7.23 0.87 -0.14 120.40 122.17 2jma s VAL 44 Ca 0.39 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 2jma s VAL 44 Cb -0.13 -2.75 0.01 0.00 0.56 0.00 0.00 36.38 34.07 2jma s VAL 44 CO 0.13 0.00 -0.13 -0.70 -0.31 0.00 0.00 175.10 174.09 2jma s GLU 45 N -3.90 1.88 -0.21 4.82 2.12 0.55 -1.37 118.70 122.58 2jma s GLU 45 Ca 0.36 -0.45 0.02 0.00 0.36 0.00 0.00 54.97 55.26 2jma s GLU 45 Cb 0.08 -1.60 0.04 0.00 0.26 0.00 0.00 34.13 32.91 2jma s GLU 45 CO 0.15 -0.03 -0.15 0.14 -0.54 0.00 0.00 175.26 174.84 2jma s VAL 46 N 0.87 2.00 0.00 3.70 -7.23 0.58 -2.11 120.40 118.22 2jma s VAL 46 Ca -0.10 -1.20 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 2jma s VAL 46 Cb -0.15 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.81 2jma s VAL 46 CO 0.01 0.26 0.00 -0.46 -0.31 0.00 0.00 175.10 174.60 2jma n ASN 47 N 4.57 0.00 0.00 4.85 0.23 -1.26 0.05 115.26 123.70 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 0.46 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.16 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 0.09 0.00 -4.72 0.53 2.03 -1.26 -4.99 116.55 108.23 2jma n ASP 48 Ca 0.00 -0.12 -0.36 0.00 0.52 0.00 0.00 54.79 54.83 2jma n ASP 48 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 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 4.25 -0.04 -0.67 1.81 0.11 -5.07 118.95 119.33 2jma s ARG 49 Ca 0.00 0.08 0.01 0.00 -1.72 0.00 0.00 55.73 54.11 2jma s ARG 49 Cb 0.00 -3.44 -0.03 0.00 -0.45 0.00 0.00 34.95 31.03 2jma s ARG 49 CO 0.00 0.22 -0.06 -0.65 -0.68 0.00 0.00 175.30 174.12 2jma s GLN 50 N 0.54 2.70 0.00 3.54 -0.21 -1.26 -0.31 119.66 124.66 2jma s GLN 50 Ca 0.16 -0.60 0.00 0.00 0.02 0.00 0.00 55.36 54.94 2jma s GLN 50 Cb -0.13 -2.58 0.00 0.00 1.00 0.00 0.00 33.01 31.30 2jma s GLN 50 CO 0.04 0.65 0.00 0.41 -2.12 0.00 0.00 175.29 174.26 2jma n GLY 51 N 1.97 -1.58 3.91 3.09 0.00 -0.47 -4.75 105.19 107.36 2jma n GLY 51 Ca -0.17 -1.06 -0.32 0.00 0.00 0.00 0.00 46.02 44.47 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 -2.48 3.53 0.06 1.61 0.40 0.57 -0.09 117.98 121.57 2jma s PHE 52 Ca 0.00 0.33 -0.03 0.00 -0.60 0.00 0.00 56.93 56.64 2jma s PHE 52 Cb 0.00 -1.82 -0.03 0.00 0.51 0.00 0.00 43.02 41.68 2jma s PHE 52 CO 0.00 0.59 0.02 0.14 0.70 0.00 0.00 175.22 176.67 2jma s VAL 53 N -1.47 0.20 0.11 -0.44 -7.23 -0.20 -2.40 120.40 108.97 2jma s VAL 53 Ca 0.33 -1.63 -0.32 0.00 -1.81 0.00 0.00 61.98 58.55 2jma s VAL 53 Cb -0.13 -1.43 -0.11 0.00 0.56 0.00 0.00 36.38 35.27 2jma s VAL 53 CO 0.25 -0.90 1.80 -2.65 -0.31 0.00 0.00 175.10 173.29 2jma n PRO 54 N 0.13 2.66 0.27 4.82 -0.02 -1.26 -0.32 135.00 141.27 2jma n PRO 54 Ca -0.15 0.96 0.14 0.00 -2.02 0.00 0.00 63.50 62.44 2jma n PRO 54 Cb 0.61 -2.84 0.76 0.00 -0.02 0.00 0.00 33.50 32.01 2jma n PRO 54 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jma h ALA 55 N 8.15 1.24 -0.00 3.55 0.00 -0.95 -0.13 119.26 131.12 2jma h ALA 55 Ca -0.46 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2jma h ALA 55 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2jma h ALA 55 CO 0.94 0.12 -0.03 0.00 0.00 0.00 0.00 179.25 180.29 2jma n ALA 56 N -2.25 2.56 0.46 0.00 0.00 -1.26 -2.90 120.51 117.11 2jma n ALA 56 Ca -0.02 -0.17 0.09 0.00 0.00 0.00 0.00 53.44 53.34 2jma n ALA 56 Cb 0.23 -1.46 0.12 0.00 0.00 0.00 0.00 19.45 18.33 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 -1.21 0.19 -4.02 0.00 4.02 -0.07 -4.91 117.16 111.16 2jma n TYR 57 Ca 0.15 -0.13 -0.12 0.00 -0.01 0.00 0.00 57.90 57.79 2jma n TYR 57 Cb 0.24 -0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.44 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 -1.32 0.31 -0.01 -0.72 1.01 -1.14 -0.17 120.40 118.36 2jma s VAL 58 Ca 0.24 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.42 2jma s VAL 58 Cb 0.15 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 36.15 2jma s VAL 58 CO 0.22 -0.33 -0.04 -0.75 0.00 0.00 0.00 175.10 174.20 2jma s LYS 59 N -1.22 0.39 -0.09 2.72 2.36 -0.48 -4.89 119.74 118.53 2jma s LYS 59 Ca -0.10 -0.13 -0.35 0.00 -2.55 0.00 0.00 55.97 52.84 2jma s LYS 59 Cb -0.08 -0.39 -0.13 0.00 -1.05 0.00 0.00 37.83 36.18 2jma s LYS 59 CO -0.00 0.06 1.83 1.63 1.55 0.00 0.00 175.35 180.42 2jma n LYS 60 N 3.14 2.02 0.06 4.03 4.01 -1.26 -0.62 118.16 129.53 2jma n LYS 60 Ca -0.15 0.74 0.12 0.00 -0.51 0.00 0.00 58.31 58.51 2jma n LYS 60 Cb 0.57 -2.55 0.16 0.00 -0.51 0.00 0.00 35.03 32.70 2jma n LYS 60 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2jma n LEU 61 N 6.12 0.68 -0.87 -0.35 4.77 -0.19 -4.87 117.00 122.30 2jma n LEU 61 Ca 0.23 0.20 0.12 0.00 -0.03 0.00 0.00 56.01 56.53 2jma n LEU 61 Cb 0.27 -0.18 0.18 0.00 -2.33 0.00 0.00 43.42 41.37 2jma n LEU 61 CO 0.73 -0.04 0.68 -0.67 -1.33 0.00 0.00 177.39 176.76