#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 0.61 -2.98 6.12 -0.08 -1.26 -5.09 116.55 113.86 2jma n ASP 2 Ca 0.00 -2.53 -0.14 0.00 -1.51 0.00 0.00 54.79 50.60 2jma n ASP 2 Cb 0.00 0.87 0.00 0.00 2.34 0.00 0.00 41.12 44.34 2jma n ASP 2 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2jma n GLU 3 N -0.58 1.03 -3.16 -0.67 1.02 -1.26 -4.90 120.64 112.11 2jma n GLU 3 Ca -0.01 -3.12 -0.21 0.00 -0.02 0.00 0.00 57.16 53.79 2jma n GLU 3 Cb 0.43 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 2jma n GLU 3 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2jma n THR 4 N 0.16 -1.12 -2.57 2.62 -2.24 -1.26 -4.88 114.28 105.00 2jma n THR 4 Ca 0.18 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.55 2jma n THR 4 Cb 0.71 -2.10 0.02 0.00 -2.10 0.00 0.00 70.33 66.86 2jma n THR 4 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jma n GLY 5 N -1.18 6.06 0.00 3.38 0.00 -1.26 -4.91 105.19 107.28 2jma n GLY 5 Ca -0.05 -2.58 0.00 0.00 0.00 0.00 0.00 46.02 43.39 2jma n GLY 5 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jma n LYS 6 N -0.12 0.00 -1.63 1.61 2.85 -1.26 -5.11 118.16 114.50 2jma n LYS 6 Ca 0.47 0.00 -0.52 0.00 -1.05 0.00 0.00 58.31 57.21 2jma n LYS 6 Cb 0.26 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.58 2jma n LYS 6 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2jma n GLU 7 N 0.00 1.48 -4.27 -1.58 0.00 -1.26 -4.88 120.64 110.13 2jma n GLU 7 Ca 0.00 0.51 -0.28 0.00 0.00 0.00 0.00 57.16 57.39 2jma n GLU 7 Cb 0.00 -2.39 -0.10 0.00 0.00 0.00 0.00 31.44 28.95 2jma n GLU 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2jma s LEU 8 N 4.85 2.96 0.09 4.31 1.43 -1.26 0.58 118.68 131.64 2jma s LEU 8 Ca 1.00 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 53.60 2jma s LEU 8 Cb -0.88 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.59 2jma s LEU 8 CO 0.56 0.14 -0.07 0.68 0.23 0.00 0.00 176.35 177.89 2jma s VAL 9 N -1.48 0.65 -0.11 -1.59 -7.23 0.43 -1.85 120.40 109.22 2jma s VAL 9 Ca 0.23 -1.83 -0.02 0.00 -1.81 0.00 0.00 61.98 58.56 2jma s VAL 9 Cb -0.10 -1.54 -0.03 0.00 0.56 0.00 0.00 36.38 35.27 2jma s VAL 9 CO 0.14 -0.82 -0.05 -0.22 -0.31 0.00 0.00 175.10 173.84 2jma s LEU 10 N -2.86 3.22 -0.44 1.32 2.96 0.27 -0.74 118.68 122.41 2jma s LEU 10 Ca 0.09 -0.07 -0.26 0.00 -0.22 0.00 0.00 54.13 53.67 2jma s LEU 10 Cb 0.04 -1.74 0.02 0.00 0.50 0.00 0.00 46.19 45.01 2jma s LEU 10 CO -0.04 0.26 0.93 0.00 -1.32 0.00 0.00 176.35 176.17 2jma s ALA 11 N -0.19 3.28 0.20 5.97 0.00 -0.73 -1.40 121.76 128.88 2jma s ALA 11 Ca 0.03 -0.70 -0.00 0.00 0.00 0.00 0.00 51.96 51.29 2jma s ALA 11 Cb -0.13 -3.61 0.13 0.00 0.00 0.00 0.00 23.12 19.51 2jma s ALA 11 CO 0.03 -1.94 1.49 -0.07 0.00 0.00 0.00 175.76 175.27 2jma h LEU 12 N 10.44 0.46 -8.74 0.00 4.07 -1.05 -2.61 115.31 117.89 2jma h LEU 12 Ca -0.24 -0.28 -0.35 0.00 0.08 0.00 0.00 57.88 57.10 2jma h LEU 12 Cb 1.08 -0.13 -0.14 0.00 1.08 0.00 0.00 40.66 42.54 2jma h LEU 12 CO 1.02 0.98 -0.54 -0.31 -1.08 0.00 0.00 178.44 178.51 2jma s TYR 13 N -3.77 1.44 0.20 1.13 2.02 -1.25 -4.76 117.35 112.36 2jma s TYR 13 Ca -0.06 -1.51 -0.22 0.00 -0.37 0.00 0.00 57.07 54.92 2jma s TYR 13 Cb 0.11 -0.62 -0.08 0.00 -0.40 0.00 0.00 41.96 40.97 2jma s TYR 13 CO 0.83 -0.77 0.74 0.16 -1.57 0.00 0.00 175.55 174.94 2jma s ASP 14 N -3.26 7.17 -0.05 2.29 -4.77 -1.26 -3.55 116.67 113.23 2jma s ASP 14 Ca 0.40 1.49 -0.07 0.00 -3.30 0.00 0.00 52.55 51.07 2jma s ASP 14 Cb 0.04 -2.45 0.01 0.00 -1.09 0.00 0.00 42.92 39.44 2jma s ASP 14 CO 0.20 0.10 0.17 -0.47 0.70 0.00 0.00 175.17 175.87 2jma s TYR 15 N -1.38 -0.13 -0.09 2.11 5.04 -0.12 -4.98 117.35 117.80 2jma s TYR 15 Ca 0.40 0.31 0.02 0.00 -2.44 0.00 0.00 57.07 55.36 2jma s TYR 15 Cb -0.19 0.04 -0.02 0.00 0.35 0.00 0.00 41.96 42.14 2jma s TYR 15 CO 0.22 -0.15 -0.15 -1.14 -1.34 0.00 0.00 175.55 172.99 2jma s GLN 16 N -0.33 2.97 0.34 4.97 2.00 -1.26 -1.38 119.66 126.97 2jma s GLN 16 Ca -0.04 -0.72 -0.29 0.00 -2.00 0.00 0.00 55.36 52.31 2jma s GLN 16 Cb -0.03 -2.48 -0.11 0.00 0.80 0.00 0.00 33.01 31.20 2jma s GLN 16 CO 0.01 0.37 1.46 -1.83 -0.50 0.00 0.00 175.29 174.80 2jma s GLU 17 N -0.08 4.18 -0.22 1.67 -1.05 -1.26 -4.90 118.70 117.03 2jma s GLU 17 Ca -0.03 2.48 -0.05 0.00 -0.15 0.00 0.00 54.97 57.22 2jma s GLU 17 Cb -0.14 -3.01 -0.12 0.00 -0.44 0.00 0.00 34.13 30.42 2jma s GLU 17 CO 0.04 -0.47 -0.24 1.63 0.95 0.00 0.00 175.26 177.17 2jma n LYS 18 N 0.94 0.51 -4.00 -4.83 5.02 -1.26 -4.98 118.16 109.56 2jma n LYS 18 Ca 0.02 0.17 -0.23 0.00 -2.02 0.00 0.00 58.31 56.25 2jma n LYS 18 Cb 0.40 -1.38 -0.06 0.00 -0.02 0.00 0.00 35.03 33.97 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 -6.55 4.71 0.00 4.39 1.04 -1.26 -4.99 113.70 111.04 2jma s SER 19 Ca -0.30 -0.83 0.07 0.00 0.48 0.00 0.00 55.95 55.36 2jma s SER 19 Cb 0.10 -0.65 0.31 0.00 0.10 0.00 0.00 66.02 65.88 2jma s SER 19 CO 0.45 -0.42 1.14 -2.65 0.98 0.00 0.00 173.24 172.74 2jma n PRO 20 N -1.25 0.05 -0.61 4.02 -0.02 -1.26 -0.88 135.00 135.05 2jma n PRO 20 Ca -0.01 0.30 0.08 0.00 -2.02 0.00 0.00 63.50 61.85 2jma n PRO 20 Cb 0.62 -1.50 0.32 0.00 -0.02 0.00 0.00 33.50 32.92 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 -1.39 3.27 -2.44 3.55 0.00 -1.26 -4.95 120.51 117.30 2jma n ALA 21 Ca 0.02 -2.02 -0.24 0.00 0.00 0.00 0.00 53.44 51.21 2jma n ALA 21 Cb 0.06 -0.88 -0.11 0.00 0.00 0.00 0.00 19.45 18.53 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 -2.57 1.46 0.04 0.00 2.02 -0.06 -0.19 118.70 119.40 2jma s GLU 22 Ca 0.47 -1.56 0.02 0.00 0.02 0.00 0.00 54.97 53.92 2jma s GLU 22 Cb 0.35 -1.59 -0.02 0.00 0.10 0.00 0.00 34.13 32.97 2jma s GLU 22 CO 0.14 0.32 -0.08 0.14 0.02 0.00 0.00 175.26 175.79 2jma s VAL 23 N -2.14 0.59 0.06 2.63 -7.23 -0.86 -4.61 120.40 108.84 2jma s VAL 23 Ca 0.22 -1.07 -0.24 0.00 -1.81 0.00 0.00 61.98 59.08 2jma s VAL 23 Cb -0.06 -0.64 -0.06 0.00 0.56 0.00 0.00 36.38 36.18 2jma s VAL 23 CO 0.10 -0.35 0.73 -0.89 -0.31 0.00 0.00 175.10 174.38 2jma s THR 24 N -1.33 4.70 0.13 5.32 2.01 -1.26 -4.11 115.64 121.10 2jma s THR 24 Ca -0.09 1.56 0.04 0.00 0.31 0.00 0.00 61.69 63.51 2jma s THR 24 Cb -0.10 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 2jma s THR 24 CO 0.01 0.41 -0.10 0.00 -0.69 0.00 0.00 174.62 174.24 2jma s MET 25 N -0.31 1.00 0.07 4.92 0.23 -0.48 -4.92 119.30 119.81 2jma s MET 25 Ca 0.36 -1.36 0.05 0.00 -1.03 0.00 0.00 55.69 53.71 2jma s MET 25 Cb -0.20 -0.61 -0.03 0.00 -1.53 0.00 0.00 34.83 32.46 2jma s MET 25 CO 0.22 0.08 -0.13 0.15 -2.03 0.00 0.00 175.02 173.31 2jma s LYS 26 N -3.42 0.78 0.09 3.16 3.01 -1.26 -0.94 119.74 121.15 2jma s LYS 26 Ca 0.13 -0.93 -0.31 0.00 -1.01 0.00 0.00 55.97 53.86 2jma s LYS 26 Cb 0.01 -0.76 -0.10 0.00 -1.01 0.00 0.00 37.83 35.97 2jma s LYS 26 CO 0.00 0.17 1.85 0.21 0.51 0.00 0.00 175.35 178.09 2jma s LYS 27 N -1.71 4.14 0.00 1.68 2.47 -1.23 -1.36 119.74 123.73 2jma s LYS 27 Ca -0.03 2.57 0.00 0.00 -1.56 0.00 0.00 55.97 56.95 2jma s LYS 27 Cb -0.10 -3.77 0.00 0.00 -1.46 0.00 0.00 37.83 32.50 2jma s LYS 27 CO 0.02 -0.87 0.00 0.41 0.16 0.00 0.00 175.35 175.07 2jma n GLY 28 N 4.30 0.55 3.82 5.54 0.00 -0.98 -5.01 105.19 113.41 2jma n GLY 28 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.16 6.97 -0.32 1.61 1.01 -0.46 -4.92 116.67 118.40 2jma s ASP 29 Ca 0.00 1.17 -0.13 0.00 0.71 0.00 0.00 52.55 54.31 2jma s ASP 29 Cb 0.00 -2.33 -0.03 0.00 1.01 0.00 0.00 42.92 41.58 2jma s ASP 29 CO 0.00 0.24 0.25 -0.63 0.21 0.00 0.00 175.17 175.25 2jma s ILE 30 N -1.19 5.27 0.04 0.77 1.09 -1.26 -1.78 121.20 124.13 2jma s ILE 30 Ca 0.30 -0.00 -0.01 0.00 -1.10 0.00 0.00 60.65 59.84 2jma s ILE 30 Cb -0.18 -3.68 -0.04 0.00 -1.06 0.00 0.00 42.46 37.50 2jma s ILE 30 CO 0.18 0.06 0.20 -0.76 -0.10 0.00 0.00 174.94 174.52 2jma s LEU 31 N 1.81 4.35 -0.26 2.97 2.01 0.08 -4.85 118.68 124.80 2jma s LEU 31 Ca 0.08 0.29 -0.11 0.00 0.01 0.00 0.00 54.13 54.40 2jma s LEU 31 Cb -0.17 -2.83 -0.05 0.00 0.01 0.00 0.00 46.19 43.15 2jma s LEU 31 CO 0.11 0.20 0.20 -0.89 1.01 0.00 0.00 176.35 176.98 2jma s THR 32 N -1.44 5.32 0.03 5.49 2.01 -1.12 -0.43 115.64 125.49 2jma s THR 32 Ca 0.32 0.22 -0.30 0.00 0.31 0.00 0.00 61.69 62.24 2jma s THR 32 Cb -0.13 -3.54 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 2jma s THR 32 CO 0.25 0.28 1.22 -0.76 -0.69 0.00 0.00 174.62 174.92 2jma s LEU 33 N 1.51 4.34 -0.09 4.42 1.43 0.20 -1.16 118.68 129.32 2jma s LEU 33 Ca 0.08 1.98 0.03 0.00 -1.03 0.00 0.00 54.13 55.20 2jma s LEU 33 Cb -0.15 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.42 2jma s LEU 33 CO 0.08 -0.52 -0.04 0.18 0.23 0.00 0.00 176.35 176.28 2jma n LEU 34 N 4.35 1.66 -3.69 1.79 4.77 0.92 -4.57 117.00 122.24 2jma n LEU 34 Ca 0.10 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.93 2jma n LEU 34 Cb 0.46 -0.11 -0.09 0.00 -2.33 0.00 0.00 43.42 41.35 2jma n LEU 34 CO 0.56 0.45 0.19 0.21 -1.33 0.00 0.00 177.39 177.47 2jma s ASN 35 N -4.50 -0.57 -0.19 -1.43 3.84 -0.86 -4.99 114.94 106.24 2jma s ASN 35 Ca -0.09 1.06 0.22 0.00 0.21 0.00 0.00 52.86 54.26 2jma s ASN 35 Cb 0.03 1.04 0.46 0.00 -0.55 0.00 0.00 41.25 42.23 2jma s ASN 35 CO 0.26 -0.19 1.16 -1.54 -2.79 0.00 0.00 177.10 174.01 2jma n SER 36 N 3.19 1.04 -0.00 -4.21 3.41 -1.26 -0.79 113.62 115.00 2jma n SER 36 Ca -0.16 -2.03 0.14 0.00 -0.26 0.00 0.00 58.87 56.56 2jma n SER 36 Cb 0.56 -0.29 0.60 0.00 -0.26 0.00 0.00 64.21 64.82 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 0.00 -3.94 6.66 5.66 -1.26 -4.76 114.28 116.28 2jma n THR 37 Ca 0.03 -0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.70 2jma n THR 37 Cb 0.90 -0.45 -0.05 0.00 -1.55 0.00 0.00 70.33 69.18 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 -2.97 6.24 0.00 1.09 3.84 -1.26 -5.01 114.94 116.87 2jma s ASN 38 Ca 0.15 0.31 0.24 0.00 0.21 0.00 0.00 52.86 53.77 2jma s ASN 38 Cb 0.19 -1.93 0.39 0.00 -0.55 0.00 0.00 41.25 39.35 2jma s ASN 38 CO 0.54 0.26 1.33 2.29 -2.79 0.00 0.00 177.10 178.73 2jma n LYS 39 N 0.98 0.46 -0.00 0.43 2.85 -1.26 -4.26 118.16 117.36 2jma n LYS 39 Ca -0.11 -0.31 0.01 0.00 -1.05 0.00 0.00 58.31 56.84 2jma n LYS 39 Cb 0.53 -1.49 -0.01 0.00 -0.65 0.00 0.00 35.03 33.40 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 -1.00 4.71 -3.85 -5.58 8.00 -1.26 -4.72 116.55 112.85 2jma n ASP 40 Ca 0.08 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.38 2jma n ASP 40 Cb 0.36 1.05 -0.17 0.00 -0.02 0.00 0.00 41.12 42.34 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 -2.09 0.64 -0.08 1.24 0.52 -1.26 -0.38 118.94 117.53 2jma s TRP 41 Ca -0.00 -0.16 0.04 0.00 0.02 0.00 0.00 56.10 56.00 2jma s TRP 41 Cb 0.01 -0.64 -0.01 0.00 -1.15 0.00 0.00 33.47 31.68 2jma s TRP 41 CO 0.05 -0.21 -0.23 -1.58 0.02 0.00 0.00 176.95 175.00 2jma s TRP 42 N 1.15 2.54 -0.19 -1.98 0.52 0.90 -4.12 118.94 117.75 2jma s TRP 42 Ca -0.08 -0.87 -0.25 0.00 0.02 0.00 0.00 56.10 54.92 2jma s TRP 42 Cb -0.14 -1.68 -0.01 0.00 -1.15 0.00 0.00 33.47 30.50 2jma s TRP 42 CO -0.01 -0.31 0.83 0.21 0.02 0.00 0.00 176.95 177.69 2jma s LYS 43 N 0.12 4.26 0.26 4.98 2.20 0.03 -0.71 119.74 130.88 2jma s LYS 43 Ca -0.12 1.00 0.01 0.00 -0.36 0.00 0.00 55.97 56.50 2jma s LYS 43 Cb -0.16 -3.59 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 2jma s LYS 43 CO 0.06 -0.38 0.13 0.14 -0.36 0.00 0.00 175.35 174.94 2jma s VAL 44 N 2.35 0.31 -0.12 4.02 -7.23 0.10 -0.05 120.40 119.79 2jma s VAL 44 Ca 0.37 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 2jma s VAL 44 Cb -0.16 -2.56 0.01 0.00 0.56 0.00 0.00 36.38 34.23 2jma s VAL 44 CO 0.11 0.00 -0.16 -0.70 -0.31 0.00 0.00 175.10 174.04 2jma s GLU 45 N -3.99 2.35 -0.30 4.82 2.12 -0.31 -1.20 118.70 122.19 2jma s GLU 45 Ca 0.38 -0.61 -0.07 0.00 0.36 0.00 0.00 54.97 55.03 2jma s GLU 45 Cb 0.07 -2.00 0.01 0.00 0.26 0.00 0.00 34.13 32.46 2jma s GLU 45 CO 0.15 -0.08 0.09 0.08 -0.54 0.00 0.00 175.26 174.96 2jma s VAL 46 N 1.02 4.03 0.00 3.70 1.01 0.35 -2.78 120.40 127.73 2jma s VAL 46 Ca -0.05 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.26 2jma s VAL 46 Cb -0.15 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.15 2jma s VAL 46 CO -0.03 0.07 0.00 -0.46 0.00 0.00 0.00 175.10 174.68 2jma n ASN 47 N 4.88 0.00 0.00 3.32 0.23 -1.26 -0.05 115.26 122.38 2jma n ASN 47 Ca -0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.91 2jma n ASN 47 Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 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 0.50 0.00 -4.62 0.53 2.03 -1.26 -4.93 116.55 108.80 2jma n ASP 48 Ca 0.00 -0.45 -0.39 0.00 0.52 0.00 0.00 54.79 54.47 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 4.05 -0.17 -0.67 1.81 0.93 -4.69 118.95 120.21 2jma s ARG 49 Ca 0.00 0.11 -0.08 0.00 -1.72 0.00 0.00 55.73 54.04 2jma s ARG 49 Cb 0.00 -3.63 -0.05 0.00 -0.45 0.00 0.00 34.95 30.82 2jma s ARG 49 CO 0.00 -0.24 0.12 -0.65 -0.68 0.00 0.00 175.30 173.85 2jma s GLN 50 N 1.96 3.90 0.00 3.54 -0.21 -1.26 -0.50 119.66 127.09 2jma s GLN 50 Ca 0.17 -0.22 0.00 0.00 0.02 0.00 0.00 55.36 55.33 2jma s GLN 50 Cb -0.16 -3.30 0.00 0.00 1.00 0.00 0.00 33.01 30.55 2jma s GLN 50 CO 0.09 0.45 0.00 0.41 -2.12 0.00 0.00 175.29 174.12 2jma n GLY 51 N 3.02 -1.44 3.90 3.09 0.00 -0.34 -4.77 105.19 108.66 2jma n GLY 51 Ca -0.17 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.52 3.52 0.06 1.61 0.40 0.73 0.01 117.98 121.78 2jma s PHE 52 Ca 0.00 0.45 0.00 0.00 -0.60 0.00 0.00 56.93 56.78 2jma s PHE 52 Cb 0.00 -1.91 -0.04 0.00 0.51 0.00 0.00 43.02 41.58 2jma s PHE 52 CO 0.00 0.53 -0.04 0.14 0.70 0.00 0.00 175.22 176.55 2jma s VAL 53 N -1.51 0.36 0.12 -0.44 -7.23 0.11 -2.03 120.40 109.78 2jma s VAL 53 Ca 0.35 -1.68 -0.31 0.00 -1.81 0.00 0.00 61.98 58.53 2jma s VAL 53 Cb -0.13 -1.35 -0.10 0.00 0.56 0.00 0.00 36.38 35.36 2jma s VAL 53 CO 0.24 -0.86 1.78 -2.84 -0.31 0.00 0.00 175.10 173.10 2jma s PRO 54 N -3.44 4.15 0.53 4.82 0.02 -1.26 -0.07 135.00 139.75 2jma s PRO 54 Ca 0.04 2.53 0.24 0.00 0.02 0.00 0.00 61.00 63.84 2jma s PRO 54 Cb 0.04 -3.55 1.44 0.00 0.02 0.00 0.00 34.50 32.46 2jma s PRO 54 CO -0.07 -0.81 2.12 0.00 -0.33 0.00 0.00 177.00 177.91 2jma h ALA 55 N 8.36 1.53 0.00 -1.55 0.00 -1.00 0.42 119.26 127.02 2jma h ALA 55 Ca -0.45 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2jma h ALA 55 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jma h ALA 55 CO 0.94 0.11 0.00 0.00 0.00 0.00 0.00 179.25 180.30 2jma n ALA 56 N -2.37 2.23 0.61 0.00 0.00 -1.26 -2.47 120.51 117.25 2jma n ALA 56 Ca -0.02 -0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.38 2jma n ALA 56 Cb 0.18 -1.39 0.08 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.29 0.05 -4.11 0.00 4.02 0.13 -4.95 117.16 111.01 2jma n TYR 57 Ca 0.11 -0.04 -0.14 0.00 -0.01 0.00 0.00 57.90 57.82 2jma n TYR 57 Cb 0.19 -0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.39 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 -1.33 0.57 -0.00 -0.72 1.01 -1.03 -0.40 120.40 118.49 2jma s VAL 58 Ca 0.20 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.33 2jma s VAL 58 Cb 0.14 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 2jma s VAL 58 CO 0.21 -0.23 -0.11 -0.75 0.00 0.00 0.00 175.10 174.22 2jma s LYS 59 N -1.21 0.84 0.23 2.72 2.36 -0.49 -4.89 119.74 119.28 2jma s LYS 59 Ca -0.06 -0.42 -0.32 0.00 -2.55 0.00 0.00 55.97 52.62 2jma s LYS 59 Cb -0.08 -0.81 -0.12 0.00 -1.05 0.00 0.00 37.83 35.77 2jma s LYS 59 CO 0.00 0.22 1.66 1.63 1.55 0.00 0.00 175.35 180.41 2jma n LYS 60 N 2.69 2.66 0.13 4.03 4.01 -1.26 -0.57 118.16 129.85 2jma n LYS 60 Ca -0.14 0.95 0.06 0.00 -0.51 0.00 0.00 58.31 58.67 2jma n LYS 60 Cb 0.56 -2.77 0.03 0.00 -0.51 0.00 0.00 35.03 32.34 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 6.04 0.00 0.00 -0.35 3.38 -1.71 -3.46 115.31 119.22 2jma h LEU 61 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2jma h LEU 61 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2jma h LEU 61 CO 0.90 0.33 0.00 -0.67 0.09 0.00 0.00 178.44 179.08