#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 0.83 -2.88 6.12 -0.08 -1.26 -5.10 116.55 114.18 2jma n ASP 2 Ca 0.00 -3.26 -0.12 0.00 -1.51 0.00 0.00 54.79 49.90 2jma n ASP 2 Cb 0.00 1.21 0.02 0.00 2.34 0.00 0.00 41.12 44.70 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 -0.89 1.07 -3.18 -0.67 1.02 -1.26 -4.96 120.64 111.77 2jma n GLU 3 Ca -0.03 -2.98 -0.20 0.00 -0.02 0.00 0.00 57.16 53.93 2jma n GLU 3 Cb 0.63 -1.26 -0.01 0.00 -0.02 0.00 0.00 31.44 30.79 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 0.06 -0.80 -2.57 2.62 -2.24 -1.26 -4.86 114.28 105.23 2jma n THR 4 Ca 0.13 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.53 2jma n THR 4 Cb 0.75 -1.59 0.01 0.00 -2.10 0.00 0.00 70.33 67.40 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 -1.04 5.98 0.00 3.38 0.00 -1.26 -4.92 105.19 107.33 2jma n GLY 5 Ca -0.03 -2.60 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 -0.17 0.00 -1.70 1.61 2.85 -1.26 -5.11 118.16 114.37 2jma n LYS 6 Ca 0.46 0.00 -0.56 0.00 -1.05 0.00 0.00 58.31 57.15 2jma n LYS 6 Cb 0.28 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.60 2jma n LYS 6 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2jma n GLU 7 N 0.00 1.26 -4.53 -1.58 -0.58 -1.26 -4.88 120.64 109.07 2jma n GLU 7 Ca 0.00 0.46 -0.29 0.00 -0.42 0.00 0.00 57.16 56.91 2jma n GLU 7 Cb 0.00 -2.16 -0.13 0.00 -0.57 0.00 0.00 31.44 28.58 2jma n GLU 7 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2jma s LEU 8 N 3.42 2.32 0.12 -4.62 1.43 -1.26 0.16 118.68 120.25 2jma s LEU 8 Ca 0.97 -0.68 0.04 0.00 -1.03 0.00 0.00 54.13 53.42 2jma s LEU 8 Cb -1.02 -1.27 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 2jma s LEU 8 CO 0.63 0.20 -0.10 0.68 0.23 0.00 0.00 176.35 178.00 2jma s VAL 9 N -0.99 1.03 -0.12 -1.59 -7.23 0.34 -1.98 120.40 109.86 2jma s VAL 9 Ca 0.14 -1.92 -0.02 0.00 -1.81 0.00 0.00 61.98 58.36 2jma s VAL 9 Cb -0.10 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 2jma s VAL 9 CO 0.05 -0.71 -0.03 -0.22 -0.31 0.00 0.00 175.10 173.88 2jma s LEU 10 N -2.94 3.35 -0.56 1.32 2.96 0.10 -0.52 118.68 122.39 2jma s LEU 10 Ca 0.13 -0.02 -0.28 0.00 -0.22 0.00 0.00 54.13 53.74 2jma s LEU 10 Cb 0.01 -1.78 0.03 0.00 0.50 0.00 0.00 46.19 44.96 2jma s LEU 10 CO -0.00 0.27 1.14 0.00 -1.32 0.00 0.00 176.35 176.43 2jma s ALA 11 N -0.24 3.05 0.19 5.97 0.00 -0.15 -1.91 121.76 128.68 2jma s ALA 11 Ca 0.04 -0.83 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 2jma s ALA 11 Cb -0.13 -3.96 0.12 0.00 0.00 0.00 0.00 23.12 19.16 2jma s ALA 11 CO 0.02 -2.54 1.52 -0.07 0.00 0.00 0.00 175.76 174.69 2jma h LEU 12 N 11.64 0.62 -8.66 0.00 4.07 -1.10 -1.81 115.31 120.07 2jma h LEU 12 Ca -0.25 -0.32 -0.27 0.00 0.08 0.00 0.00 57.88 57.12 2jma h LEU 12 Cb 1.06 -0.18 -0.15 0.00 1.08 0.00 0.00 40.66 42.48 2jma h LEU 12 CO 1.16 1.03 -0.61 -0.31 -1.08 0.00 0.00 178.44 178.62 2jma s TYR 13 N -4.03 1.25 0.08 1.13 2.02 -1.25 -4.79 117.35 111.77 2jma s TYR 13 Ca -0.07 -1.36 -0.29 0.00 -0.37 0.00 0.00 57.07 54.99 2jma s TYR 13 Cb 0.11 -0.63 -0.06 0.00 -0.40 0.00 0.00 41.96 40.99 2jma s TYR 13 CO 0.84 -0.59 0.91 0.16 -1.57 0.00 0.00 175.55 175.29 2jma s ASP 14 N -3.20 7.41 0.00 2.29 -4.77 -1.26 -3.71 116.67 113.44 2jma s ASP 14 Ca 0.39 1.68 0.01 0.00 -3.30 0.00 0.00 52.55 51.33 2jma s ASP 14 Cb 0.07 -2.55 -0.01 0.00 -1.09 0.00 0.00 42.92 39.34 2jma s ASP 14 CO 0.13 -0.05 -0.04 -0.47 0.70 0.00 0.00 175.17 175.43 2jma s TYR 15 N 0.05 0.36 -0.05 2.11 5.04 -0.50 -4.97 117.35 119.37 2jma s TYR 15 Ca 0.45 -0.14 0.06 0.00 -2.44 0.00 0.00 57.07 55.00 2jma s TYR 15 Cb -0.22 -0.23 -0.01 0.00 0.35 0.00 0.00 41.96 41.85 2jma s TYR 15 CO 0.28 -0.03 -0.24 -1.14 -1.34 0.00 0.00 175.55 173.08 2jma s GLN 16 N -0.36 2.50 0.38 4.97 0.74 -1.26 -1.31 119.66 125.32 2jma s GLN 16 Ca -0.01 -0.90 -0.28 0.00 0.05 0.00 0.00 55.36 54.22 2jma s GLN 16 Cb -0.03 -2.16 -0.11 0.00 1.10 0.00 0.00 33.01 31.81 2jma s GLN 16 CO -0.00 0.42 1.45 -1.83 -0.55 0.00 0.00 175.29 174.77 2jma s GLU 17 N -0.25 4.11 -0.17 1.67 -1.05 -1.26 -4.91 118.70 116.85 2jma s GLU 17 Ca -0.01 2.49 -0.02 0.00 -0.15 0.00 0.00 54.97 57.28 2jma s GLU 17 Cb -0.13 -2.96 -0.10 0.00 -0.44 0.00 0.00 34.13 30.50 2jma s GLU 17 CO 0.03 -0.50 -0.18 1.63 0.95 0.00 0.00 175.26 177.19 2jma n LYS 18 N 0.46 0.40 -3.98 -4.83 5.02 -1.26 -4.99 118.16 108.98 2jma n LYS 18 Ca 0.01 0.12 -0.23 0.00 -2.02 0.00 0.00 58.31 56.19 2jma n LYS 18 Cb 0.40 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 34.09 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 -5.97 4.69 0.00 4.39 1.04 -1.26 -5.00 113.70 111.59 2jma s SER 19 Ca -0.23 -0.87 0.05 0.00 0.48 0.00 0.00 55.95 55.38 2jma s SER 19 Cb 0.07 -0.61 0.25 0.00 0.10 0.00 0.00 66.02 65.83 2jma s SER 19 CO 0.36 -0.47 1.08 -2.65 0.98 0.00 0.00 173.24 172.54 2jma n PRO 20 N -1.28 0.04 -0.34 4.02 -0.02 -1.26 -1.36 135.00 134.80 2jma n PRO 20 Ca -0.01 0.31 0.11 0.00 -2.02 0.00 0.00 63.50 61.89 2jma n PRO 20 Cb 0.62 -1.50 0.29 0.00 -0.02 0.00 0.00 33.50 32.90 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 -1.38 2.35 -2.53 3.55 0.00 -1.26 -4.95 120.51 116.28 2jma n ALA 21 Ca 0.02 -1.28 -0.25 0.00 0.00 0.00 0.00 53.44 51.93 2jma n ALA 21 Cb 0.05 -0.83 -0.09 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.01 1.90 0.11 0.00 2.02 -0.47 -0.02 118.70 121.23 2jma s GLU 22 Ca 0.44 -1.49 0.06 0.00 0.02 0.00 0.00 54.97 54.00 2jma s GLU 22 Cb 0.23 -1.99 -0.04 0.00 0.10 0.00 0.00 34.13 32.43 2jma s GLU 22 CO 0.30 0.38 -0.15 0.14 0.02 0.00 0.00 175.26 175.95 2jma s VAL 23 N -2.06 1.33 0.13 2.63 -7.23 -0.88 -4.64 120.40 109.68 2jma s VAL 23 Ca 0.27 -1.61 -0.17 0.00 -1.81 0.00 0.00 61.98 58.66 2jma s VAL 23 Cb -0.07 -1.43 -0.07 0.00 0.56 0.00 0.00 36.38 35.37 2jma s VAL 23 CO 0.15 -0.33 0.59 -0.89 -0.31 0.00 0.00 175.10 174.31 2jma s THR 24 N -1.84 4.75 0.05 5.32 2.01 -1.26 -3.98 115.64 120.69 2jma s THR 24 Ca 0.06 1.07 -0.06 0.00 0.31 0.00 0.00 61.69 63.08 2jma s THR 24 Cb -0.07 -3.83 -0.01 0.00 0.01 0.00 0.00 72.50 68.61 2jma s THR 24 CO 0.03 0.36 0.10 0.00 -0.69 0.00 0.00 174.62 174.42 2jma s MET 25 N -1.62 0.64 0.07 4.92 0.23 -0.42 -4.91 119.30 118.21 2jma s MET 25 Ca 0.35 -0.86 0.08 0.00 -1.03 0.00 0.00 55.69 54.23 2jma s MET 25 Cb -0.17 0.25 -0.03 0.00 -1.53 0.00 0.00 34.83 33.35 2jma s MET 25 CO 0.19 -0.17 -0.22 0.15 -2.03 0.00 0.00 175.02 172.95 2jma s LYS 26 N -3.05 1.35 0.12 3.16 3.01 -1.26 -1.42 119.74 121.66 2jma s LYS 26 Ca -0.01 -1.06 -0.33 0.00 -1.01 0.00 0.00 55.97 53.55 2jma s LYS 26 Cb 0.01 -1.55 -0.13 0.00 -1.01 0.00 0.00 37.83 35.16 2jma s LYS 26 CO -0.07 0.38 1.70 1.17 0.51 0.00 0.00 175.35 179.05 2jma n LYS 27 N 1.51 2.40 0.00 1.68 3.00 -1.24 -2.01 118.16 123.51 2jma n LYS 27 Ca -0.18 0.87 0.00 0.00 -0.00 0.00 0.00 58.31 59.00 2jma n LYS 27 Cb 0.53 -2.69 0.00 0.00 0.00 0.00 0.00 35.03 32.87 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 3.83 0.61 3.90 3.14 0.00 -0.68 -5.00 105.19 111.00 2jma n GLY 28 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2jma n GLY 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jma s ASP 29 N -2.32 6.45 -0.32 1.61 -1.08 -0.85 -4.91 116.67 115.25 2jma s ASP 29 Ca 0.00 0.48 -0.10 0.00 -0.52 0.00 0.00 52.55 52.41 2jma s ASP 29 Cb 0.00 -2.05 -0.00 0.00 -1.46 0.00 0.00 42.92 39.41 2jma s ASP 29 CO 0.00 0.11 0.17 -0.63 0.52 0.00 0.00 175.17 175.34 2jma s ILE 30 N -1.58 4.72 0.08 4.11 1.09 -1.26 -0.98 121.20 127.38 2jma s ILE 30 Ca 0.38 -0.44 0.01 0.00 -1.10 0.00 0.00 60.65 59.49 2jma s ILE 30 Cb -0.13 -3.44 -0.04 0.00 -1.06 0.00 0.00 42.46 37.80 2jma s ILE 30 CO 0.25 0.02 0.22 -0.76 -0.10 0.00 0.00 174.94 174.56 2jma s LEU 31 N 1.62 4.32 -0.23 2.97 2.01 0.32 -4.92 118.68 124.78 2jma s LEU 31 Ca 0.05 0.23 -0.12 0.00 0.01 0.00 0.00 54.13 54.29 2jma s LEU 31 Cb -0.17 -2.92 -0.05 0.00 0.01 0.00 0.00 46.19 43.06 2jma s LEU 31 CO 0.07 0.15 0.25 -0.89 1.01 0.00 0.00 176.35 176.94 2jma s THR 32 N -1.55 5.30 -0.06 5.49 2.01 -1.21 -0.50 115.64 125.12 2jma s THR 32 Ca 0.35 0.37 -0.30 0.00 0.31 0.00 0.00 61.69 62.42 2jma s THR 32 Cb -0.13 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 2jma s THR 32 CO 0.28 0.31 1.27 -0.76 -0.69 0.00 0.00 174.62 175.02 2jma s LEU 33 N 1.18 4.27 -0.18 4.42 1.43 0.12 -1.79 118.68 128.14 2jma s LEU 33 Ca 0.12 1.88 0.03 0.00 -1.03 0.00 0.00 54.13 55.13 2jma s LEU 33 Cb -0.14 -3.56 -0.13 0.00 0.03 0.00 0.00 46.19 42.39 2jma s LEU 33 CO 0.06 -0.65 -0.13 0.18 0.23 0.00 0.00 176.35 176.03 2jma n LEU 34 N 5.49 2.50 -3.66 1.79 4.77 0.85 -4.61 117.00 124.14 2jma n LEU 34 Ca 0.12 -0.09 -0.07 0.00 -0.03 0.00 0.00 56.01 55.94 2jma n LEU 34 Cb 0.45 -0.50 -0.08 0.00 -2.33 0.00 0.00 43.42 40.96 2jma n LEU 34 CO 0.56 0.75 0.24 0.21 -1.33 0.00 0.00 177.39 177.82 2jma s ASN 35 N -5.69 -0.81 -0.17 -1.43 3.84 -0.93 -4.99 114.94 104.75 2jma s ASN 35 Ca -0.23 1.32 0.16 0.00 0.21 0.00 0.00 52.86 54.33 2jma s ASN 35 Cb 0.06 1.30 0.44 0.00 -0.55 0.00 0.00 41.25 42.51 2jma s ASN 35 CO 0.47 -0.22 1.18 -1.54 -2.79 0.00 0.00 177.10 174.20 2jma n SER 36 N 4.47 2.13 0.00 -4.21 3.41 -1.26 -0.54 113.62 117.62 2jma n SER 36 Ca -0.20 -3.05 0.08 0.00 -0.26 0.00 0.00 58.87 55.44 2jma n SER 36 Cb 0.56 -0.42 0.38 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.50 0.74 -4.13 6.66 5.66 -1.26 -4.67 114.28 116.77 2jma n THR 37 Ca 0.19 0.18 -0.30 0.00 -3.05 0.00 0.00 64.05 61.07 2jma n THR 37 Cb 0.89 -0.90 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 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 -2.87 5.09 0.00 1.09 3.84 -1.26 -5.03 114.94 115.80 2jma s ASN 38 Ca 0.11 -0.14 0.23 0.00 0.21 0.00 0.00 52.86 53.26 2jma s ASN 38 Cb 0.11 -1.24 0.08 0.00 -0.55 0.00 0.00 41.25 39.65 2jma s ASN 38 CO 0.29 0.18 1.15 2.29 -2.79 0.00 0.00 177.10 178.22 2jma n LYS 39 N 0.61 1.21 -0.01 0.43 2.85 -1.26 -4.38 118.16 117.62 2jma n LYS 39 Ca -0.11 -0.98 0.00 0.00 -1.05 0.00 0.00 58.31 56.17 2jma n LYS 39 Cb 0.52 -1.48 -0.02 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 -0.04 4.28 -3.95 -5.58 8.00 -1.26 -4.77 116.55 113.23 2jma n ASP 40 Ca 0.10 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.38 2jma n ASP 40 Cb 0.46 0.88 -0.16 0.00 -0.02 0.00 0.00 41.12 42.27 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 -2.15 1.01 -0.05 1.24 0.52 -1.26 -0.37 118.94 117.88 2jma s TRP 41 Ca -0.01 -0.32 0.06 0.00 0.02 0.00 0.00 56.10 55.85 2jma s TRP 41 Cb 0.01 -0.80 -0.01 0.00 -1.15 0.00 0.00 33.47 31.53 2jma s TRP 41 CO 0.13 -0.20 -0.24 -1.58 0.02 0.00 0.00 176.95 175.07 2jma s TRP 42 N 0.71 2.31 -0.20 -1.98 0.52 0.86 -4.13 118.94 117.04 2jma s TRP 42 Ca -0.12 -0.66 -0.21 0.00 0.02 0.00 0.00 56.10 55.14 2jma s TRP 42 Cb -0.14 -1.52 -0.03 0.00 -1.15 0.00 0.00 33.47 30.64 2jma s TRP 42 CO 0.02 -0.19 0.63 0.21 0.02 0.00 0.00 176.95 177.64 2jma s LYS 43 N -0.19 4.21 0.26 4.98 2.20 0.29 -0.47 119.74 131.03 2jma s LYS 43 Ca -0.02 0.62 0.01 0.00 -0.36 0.00 0.00 55.97 56.22 2jma s LYS 43 Cb -0.13 -3.58 -0.05 0.00 -1.51 0.00 0.00 37.83 32.56 2jma s LYS 43 CO 0.03 -0.24 0.10 0.14 -0.36 0.00 0.00 175.35 175.02 2jma s VAL 44 N 1.90 0.53 -0.10 4.02 -7.23 0.75 -0.10 120.40 120.16 2jma s VAL 44 Ca 0.29 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.49 2jma s VAL 44 Cb -0.16 -2.63 0.01 0.00 0.56 0.00 0.00 36.38 34.16 2jma s VAL 44 CO 0.10 0.00 -0.20 -0.70 -0.31 0.00 0.00 175.10 173.99 2jma s GLU 45 N -4.03 2.67 -0.19 4.82 2.12 -0.74 -1.75 118.70 121.61 2jma s GLU 45 Ca 0.38 -0.74 -0.00 0.00 0.36 0.00 0.00 54.97 54.96 2jma s GLU 45 Cb 0.08 -2.09 0.01 0.00 0.26 0.00 0.00 34.13 32.39 2jma s GLU 45 CO 0.14 0.09 -0.16 0.14 -0.54 0.00 0.00 175.26 174.93 2jma s VAL 46 N 0.54 2.39 0.00 3.70 -7.23 0.18 -3.34 120.40 116.64 2jma s VAL 46 Ca -0.15 -0.83 0.00 0.00 -1.81 0.00 0.00 61.98 59.19 2jma s VAL 46 Cb -0.17 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.74 2jma s VAL 46 CO 0.05 0.51 0.00 -0.46 -0.31 0.00 0.00 175.10 174.89 2jma n ASN 47 N 4.63 0.00 0.00 4.85 0.23 -1.26 0.12 115.26 123.83 2jma n ASN 47 Ca -0.20 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.85 2jma n ASN 47 Cb 0.50 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.20 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 0.43 0.00 -4.70 0.53 2.03 -1.26 -4.97 116.55 108.61 2jma n ASP 48 Ca 0.00 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.91 2jma n ASP 48 Cb 0.00 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 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 4.40 -0.12 -0.67 1.81 0.12 -4.61 118.95 119.87 2jma s ARG 49 Ca 0.00 0.94 -0.02 0.00 -1.72 0.00 0.00 55.73 54.93 2jma s ARG 49 Cb 0.00 -3.49 -0.03 0.00 -0.45 0.00 0.00 34.95 30.98 2jma s ARG 49 CO 0.00 -0.06 -0.04 -0.65 -0.68 0.00 0.00 175.30 173.87 2jma s GLN 50 N 1.22 3.31 0.00 3.54 -0.21 -1.26 -0.65 119.66 125.61 2jma s GLN 50 Ca 0.38 -0.50 0.00 0.00 0.02 0.00 0.00 55.36 55.26 2jma s GLN 50 Cb -0.18 -2.81 0.00 0.00 1.00 0.00 0.00 33.01 31.02 2jma s GLN 50 CO 0.17 0.44 0.00 0.41 -2.12 0.00 0.00 175.29 174.19 2jma n GLY 51 N 2.92 -1.40 3.90 3.09 0.00 -0.72 -4.79 105.19 108.19 2jma n GLY 51 Ca -0.18 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 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 -2.54 3.52 0.04 1.61 0.40 0.97 -0.18 117.98 121.80 2jma s PHE 52 Ca 0.00 0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 56.74 2jma s PHE 52 Cb 0.00 -1.89 -0.03 0.00 0.51 0.00 0.00 43.02 41.61 2jma s PHE 52 CO 0.00 0.55 -0.01 0.14 0.70 0.00 0.00 175.22 176.60 2jma s VAL 53 N -1.50 0.18 0.12 -0.44 -7.23 0.38 -2.07 120.40 109.83 2jma s VAL 53 Ca 0.35 -1.45 -0.32 0.00 -1.81 0.00 0.00 61.98 58.75 2jma s VAL 53 Cb -0.13 -1.08 -0.11 0.00 0.56 0.00 0.00 36.38 35.62 2jma s VAL 53 CO 0.24 -0.80 1.79 -2.65 -0.31 0.00 0.00 175.10 173.37 2jma n PRO 54 N 0.61 2.66 0.25 4.82 -0.02 -1.26 -0.10 135.00 141.97 2jma n PRO 54 Ca -0.17 0.97 0.09 0.00 -2.02 0.00 0.00 63.50 62.36 2jma n PRO 54 Cb 0.59 -2.84 0.65 0.00 -0.02 0.00 0.00 33.50 31.89 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 8.03 1.72 0.00 3.55 0.00 -1.01 0.12 119.26 131.67 2jma h ALA 55 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2jma h ALA 55 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2jma h ALA 55 CO 0.94 0.10 0.00 0.00 0.00 0.00 0.00 179.25 180.29 2jma n ALA 56 N -2.46 2.02 0.74 0.00 0.00 -1.26 -2.10 120.51 117.45 2jma n ALA 56 Ca -0.03 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.41 2jma n ALA 56 Cb 0.16 -1.33 0.07 0.00 0.00 0.00 0.00 19.45 18.35 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 -1.36 0.00 -4.07 0.00 4.02 0.40 -4.93 117.16 111.23 2jma n TYR 57 Ca 0.08 -0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.84 2jma n TYR 57 Cb 0.19 -0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.40 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 -1.48 0.54 -0.02 -0.72 1.01 -0.89 -0.46 120.40 118.37 2jma s VAL 58 Ca 0.21 -1.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 2jma s VAL 58 Cb 0.15 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.87 2jma s VAL 58 CO 0.22 -0.41 0.05 -0.75 0.00 0.00 0.00 175.10 174.21 2jma s LYS 59 N -1.70 0.06 0.22 2.72 2.36 -0.80 -4.87 119.74 117.72 2jma s LYS 59 Ca -0.09 0.08 -0.32 0.00 -2.55 0.00 0.00 55.97 53.09 2jma s LYS 59 Cb -0.09 0.03 -0.13 0.00 -1.05 0.00 0.00 37.83 36.58 2jma s LYS 59 CO 0.00 -0.01 1.50 1.63 1.55 0.00 0.00 175.35 180.02 2jma n LYS 60 N 3.07 2.17 0.11 4.03 4.01 -1.26 -0.72 118.16 129.57 2jma n LYS 60 Ca -0.12 0.78 0.04 0.00 -0.51 0.00 0.00 58.31 58.49 2jma n LYS 60 Cb 0.60 -2.49 0.01 0.00 -0.51 0.00 0.00 35.03 32.63 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 4.94 0.00 0.00 -0.35 3.38 -1.74 -3.46 115.31 118.08 2jma h LEU 61 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2jma h LEU 61 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2jma h LEU 61 CO 0.81 0.41 0.00 -0.67 0.09 0.00 0.00 178.44 179.08