#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jm9 n ASP 2 N 0.00 -0.72 -1.65 7.83 5.68 -1.26 -5.19 116.55 121.25 2jm9 n ASP 2 Ca 0.00 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 2jm9 n ASP 2 Cb 0.00 1.29 0.00 0.00 -1.14 0.00 0.00 41.12 41.27 2jm9 n ASP 2 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2jm9 n GLU 3 N -0.26 2.01 -4.10 0.11 0.00 -1.26 -4.77 120.64 112.37 2jm9 n GLU 3 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.81 2jm9 n GLU 3 Cb 0.27 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 31.67 2jm9 n GLU 3 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 2jm9 n THR 4 N 0.00 -0.63 -2.68 3.84 5.66 -1.26 -4.85 114.28 114.36 2jm9 n THR 4 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 2jm9 n THR 4 Cb 0.00 -1.23 0.05 0.00 -1.55 0.00 0.00 70.33 67.60 2jm9 n THR 4 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jm9 n GLY 5 N -1.20 1.50 2.93 1.09 0.00 -1.26 -4.86 105.19 103.40 2jm9 n GLY 5 Ca 0.08 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.89 2jm9 n GLY 5 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jm9 s LYS 6 N -2.55 0.17 -0.30 1.61 0.00 -1.26 -5.01 119.74 112.40 2jm9 s LYS 6 Ca 0.26 0.60 -0.02 0.00 0.00 0.00 0.00 55.97 56.81 2jm9 s LYS 6 Cb 0.44 -0.35 0.00 0.00 0.00 0.00 0.00 37.83 37.93 2jm9 s LYS 6 CO 0.01 -0.40 0.07 0.39 0.00 0.00 0.00 175.35 175.42 2jm9 n GLU 7 N 5.34 -3.15 -3.34 1.78 1.02 -1.26 -2.41 120.64 118.62 2jm9 n GLU 7 Ca -0.06 2.57 -0.36 0.00 -0.02 0.00 0.00 57.16 59.30 2jm9 n GLU 7 Cb 0.50 -5.07 -0.06 0.00 -0.02 0.00 0.00 31.44 26.78 2jm9 n GLU 7 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2jm9 s LEU 8 N -1.71 4.36 0.12 -4.62 1.43 -1.26 -0.49 118.68 116.51 2jm9 s LEU 8 Ca 0.03 1.11 0.05 0.00 -1.03 0.00 0.00 54.13 54.29 2jm9 s LEU 8 Cb -0.01 -3.23 -0.04 0.00 0.03 0.00 0.00 46.19 42.94 2jm9 s LEU 8 CO 0.73 0.12 -0.12 0.68 0.23 0.00 0.00 176.35 177.99 2jm9 s VAL 9 N -1.42 1.21 -0.14 -1.59 -7.23 0.41 -1.53 120.40 110.10 2jm9 s VAL 9 Ca 0.37 -1.74 -0.07 0.00 -1.81 0.00 0.00 61.98 58.73 2jm9 s VAL 9 Cb -0.16 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.22 2jm9 s VAL 9 CO 0.19 -0.50 0.11 -0.22 -0.31 0.00 0.00 175.10 174.37 2jm9 s LEU 10 N -2.55 4.17 -0.40 1.32 2.96 0.07 -1.12 118.68 123.14 2jm9 s LEU 10 Ca 0.09 0.32 -0.26 0.00 -0.22 0.00 0.00 54.13 54.06 2jm9 s LEU 10 Cb -0.03 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 44.64 2jm9 s LEU 10 CO 0.02 0.32 0.94 0.00 -1.32 0.00 0.00 176.35 176.31 2jm9 s ALA 11 N -0.48 3.34 0.10 5.97 0.00 -0.79 -1.11 121.76 128.80 2jm9 s ALA 11 Ca 0.11 -0.55 -0.04 0.00 0.00 0.00 0.00 51.96 51.49 2jm9 s ALA 11 Cb -0.12 -3.60 -0.18 0.00 0.00 0.00 0.00 23.12 19.23 2jm9 s ALA 11 CO 0.02 -1.79 1.23 -0.07 0.00 0.00 0.00 175.76 175.15 2jm9 h LEU 12 N 10.30 0.46 -8.85 0.00 4.07 -1.02 -1.86 115.31 118.41 2jm9 h LEU 12 Ca -0.23 -0.43 -0.35 0.00 0.08 0.00 0.00 57.88 56.95 2jm9 h LEU 12 Cb 1.08 -0.14 -0.14 0.00 1.08 0.00 0.00 40.66 42.53 2jm9 h LEU 12 CO 1.01 1.27 -0.64 -0.31 -1.08 0.00 0.00 178.44 178.69 2jm9 s TYR 13 N -2.95 1.48 -0.07 1.13 2.02 -1.24 -4.75 117.35 112.97 2jm9 s TYR 13 Ca -0.05 -1.06 -0.25 0.00 -0.37 0.00 0.00 57.07 55.34 2jm9 s TYR 13 Cb 0.08 -0.87 -0.03 0.00 -0.40 0.00 0.00 41.96 40.74 2jm9 s TYR 13 CO 0.87 -0.21 0.78 0.34 -1.57 0.00 0.00 175.55 175.77 2jm9 s ASP 14 N -3.28 7.07 0.00 2.29 -1.08 -1.26 -3.68 116.67 116.73 2jm9 s ASP 14 Ca 0.32 1.29 0.04 0.00 -0.52 0.00 0.00 52.55 53.68 2jm9 s ASP 14 Cb 0.07 -2.45 -0.01 0.00 -1.46 0.00 0.00 42.92 39.06 2jm9 s ASP 14 CO 0.10 -0.20 -0.14 -0.47 0.52 0.00 0.00 175.17 174.98 2jm9 s TYR 15 N 1.08 1.22 -0.13 -5.34 5.04 -0.21 -4.99 117.35 114.03 2jm9 s TYR 15 Ca 0.41 -0.27 -0.02 0.00 -2.44 0.00 0.00 57.07 54.76 2jm9 s TYR 15 Cb -0.18 -0.77 -0.02 0.00 0.35 0.00 0.00 41.96 41.33 2jm9 s TYR 15 CO 0.19 -0.00 -0.07 -1.14 -1.34 0.00 0.00 175.55 173.19 2jm9 s GLN 16 N -0.57 3.36 0.50 4.97 2.00 -1.26 -1.56 119.66 127.10 2jm9 s GLN 16 Ca 0.04 -0.57 -0.21 0.00 -2.00 0.00 0.00 55.36 52.61 2jm9 s GLN 16 Cb -0.06 -2.75 -0.07 0.00 0.80 0.00 0.00 33.01 30.93 2jm9 s GLN 16 CO 0.00 0.34 1.15 -1.83 -0.50 0.00 0.00 175.29 174.45 2jm9 s GLU 17 N 0.07 3.57 0.00 1.67 -1.05 -1.26 -4.88 118.70 116.82 2jm9 s GLU 17 Ca -0.02 1.70 0.14 0.00 -0.15 0.00 0.00 54.97 56.64 2jm9 s GLU 17 Cb -0.14 -2.22 0.21 0.00 -0.44 0.00 0.00 34.13 31.54 2jm9 s GLU 17 CO 0.03 -0.69 1.08 0.36 0.95 0.00 0.00 175.26 177.00 2jm9 n LYS 18 N -0.86 1.63 0.00 -4.83 2.85 -1.26 -4.96 118.16 110.73 2jm9 n LYS 18 Ca 0.09 -1.65 0.00 0.00 -1.05 0.00 0.00 58.31 55.70 2jm9 n LYS 18 Cb 0.49 -1.30 0.00 0.00 -0.65 0.00 0.00 35.03 33.57 2jm9 n LYS 18 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2jm9 n SER 19 N 0.81 0.00 0.00 -5.58 3.41 -1.26 -4.99 113.62 106.01 2jm9 n SER 19 Ca 0.11 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.73 2jm9 n SER 19 Cb 0.40 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.40 2jm9 n SER 19 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2jm9 n PRO 20 N -0.08 0.03 0.14 4.33 -0.02 -1.26 -0.80 135.00 137.33 2jm9 n PRO 20 Ca 0.00 0.24 0.07 0.00 -2.02 0.00 0.00 63.50 61.79 2jm9 n PRO 20 Cb 0.00 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.02 2jm9 n PRO 20 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jm9 h ALA 21 N 2.10 0.73 -1.93 3.55 0.00 -1.94 -3.45 119.26 118.32 2jm9 h ALA 21 Ca 0.00 -0.30 -0.47 0.00 0.00 0.00 0.00 54.91 54.14 2jm9 h ALA 21 Cb 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2jm9 h ALA 21 CO 0.00 0.37 -0.41 -1.21 0.00 0.00 0.00 179.25 178.00 2jm9 s GLU 22 N -3.11 3.03 0.02 0.00 8.01 0.02 -0.01 118.70 126.66 2jm9 s GLU 22 Ca 0.03 -1.06 0.05 0.00 0.01 0.00 0.00 54.97 53.99 2jm9 s GLU 22 Cb 0.07 -2.70 -0.02 0.00 -4.31 0.00 0.00 34.13 27.18 2jm9 s GLU 22 CO 0.75 0.18 -0.14 0.14 0.01 0.00 0.00 175.26 176.19 2jm9 s VAL 23 N -2.17 1.10 -0.03 2.63 -7.23 -1.08 -4.62 120.40 109.00 2jm9 s VAL 23 Ca 0.40 -0.85 -0.30 0.00 -1.81 0.00 0.00 61.98 59.43 2jm9 s VAL 23 Cb -0.08 -0.97 -0.03 0.00 0.56 0.00 0.00 36.38 35.86 2jm9 s VAL 23 CO 0.29 0.11 0.98 -0.89 -0.31 0.00 0.00 175.10 175.27 2jm9 s THR 24 N -0.66 4.86 0.12 5.32 2.01 -1.26 -4.27 115.64 121.75 2jm9 s THR 24 Ca 0.03 2.03 0.08 0.00 0.31 0.00 0.00 61.69 64.14 2jm9 s THR 24 Cb -0.07 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 2jm9 s THR 24 CO 0.01 0.13 -0.19 0.00 -0.69 0.00 0.00 174.62 173.88 2jm9 s MET 25 N 1.22 1.12 0.04 4.92 0.23 -0.60 -4.97 119.30 121.25 2jm9 s MET 25 Ca 0.51 -1.21 0.08 0.00 -1.03 0.00 0.00 55.69 54.04 2jm9 s MET 25 Cb -0.20 -1.27 -0.03 0.00 -1.53 0.00 0.00 34.83 31.80 2jm9 s MET 25 CO 0.25 0.28 -0.20 0.15 -2.03 0.00 0.00 175.02 173.47 2jm9 s LYS 26 N -2.17 2.02 -0.20 3.16 3.01 -1.26 -1.05 119.74 123.25 2jm9 s LYS 26 Ca 0.08 -1.00 -0.38 0.00 -1.01 0.00 0.00 55.97 53.65 2jm9 s LYS 26 Cb -0.09 -2.13 -0.15 0.00 -1.01 0.00 0.00 37.83 34.45 2jm9 s LYS 26 CO 0.04 0.54 1.75 1.17 0.51 0.00 0.00 175.35 179.36 2jm9 n LYS 27 N 1.68 1.43 -0.16 1.68 3.00 -1.24 -1.36 118.16 123.20 2jm9 n LYS 27 Ca -0.16 0.53 0.00 0.00 -0.00 0.00 0.00 58.31 58.67 2jm9 n LYS 27 Cb 0.52 -2.25 0.00 0.00 0.00 0.00 0.00 35.03 33.30 2jm9 n LYS 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2jm9 n GLY 28 N 4.13 0.91 3.92 3.14 0.00 -0.70 -5.02 105.19 111.57 2jm9 n GLY 28 Ca 0.25 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2jm9 n GLY 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jm9 s ASP 29 N -2.08 6.37 -0.34 1.61 -1.08 -0.46 -4.93 116.67 115.76 2jm9 s ASP 29 Ca 0.00 0.29 -0.11 0.00 -0.52 0.00 0.00 52.55 52.21 2jm9 s ASP 29 Cb 0.00 -1.97 0.00 0.00 -1.46 0.00 0.00 42.92 39.49 2jm9 s ASP 29 CO 0.00 0.11 0.20 -0.63 0.52 0.00 0.00 175.17 175.37 2jm9 s ILE 30 N -1.61 4.84 0.04 4.11 1.09 -1.26 -1.89 121.20 126.52 2jm9 s ILE 30 Ca 0.36 -0.49 -0.00 0.00 -1.10 0.00 0.00 60.65 59.42 2jm9 s ILE 30 Cb -0.12 -3.54 -0.04 0.00 -1.06 0.00 0.00 42.46 37.69 2jm9 s ILE 30 CO 0.28 -0.05 0.19 -0.76 -0.10 0.00 0.00 174.94 174.49 2jm9 s LEU 31 N 1.64 4.29 -0.18 2.97 2.01 -0.27 -4.88 118.68 124.25 2jm9 s LEU 31 Ca 0.04 0.25 -0.04 0.00 0.01 0.00 0.00 54.13 54.40 2jm9 s LEU 31 Cb -0.18 -2.81 -0.02 0.00 0.01 0.00 0.00 46.19 43.19 2jm9 s LEU 31 CO 0.08 0.19 -0.02 -0.89 1.01 0.00 0.00 176.35 176.72 2jm9 s THR 32 N -1.44 3.82 0.22 5.49 2.01 -1.16 -0.44 115.64 124.14 2jm9 s THR 32 Ca 0.32 -0.37 -0.30 0.00 0.31 0.00 0.00 61.69 61.66 2jm9 s THR 32 Cb -0.13 -2.71 -0.09 0.00 0.01 0.00 0.00 72.50 69.59 2jm9 s THR 32 CO 0.25 0.45 1.24 -0.76 -0.69 0.00 0.00 174.62 175.11 2jm9 s LEU 33 N 0.80 4.45 -0.07 4.42 1.43 0.36 -1.06 118.68 129.01 2jm9 s LEU 33 Ca -0.01 2.35 -0.03 0.00 -1.03 0.00 0.00 54.13 55.42 2jm9 s LEU 33 Cb -0.14 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.43 2jm9 s LEU 33 CO 0.02 -0.41 -0.08 0.18 0.23 0.00 0.00 176.35 176.28 2jm9 n LEU 34 N 2.18 1.06 -3.66 1.79 4.77 0.12 -4.71 117.00 118.55 2jm9 n LEU 34 Ca 0.04 0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.89 2jm9 n LEU 34 Cb 0.44 -0.21 -0.17 0.00 -2.33 0.00 0.00 43.42 41.15 2jm9 n LEU 34 CO 0.57 0.25 -0.29 0.21 -1.33 0.00 0.00 177.39 176.80 2jm9 s ASN 35 N -5.42 1.09 -0.08 -1.43 3.84 -0.92 -5.00 114.94 107.02 2jm9 s ASN 35 Ca -0.10 0.11 0.19 0.00 0.21 0.00 0.00 52.86 53.28 2jm9 s ASN 35 Cb 0.03 0.04 0.40 0.00 -0.55 0.00 0.00 41.25 41.18 2jm9 s ASN 35 CO 0.13 -0.26 1.18 -1.54 -2.79 0.00 0.00 177.10 173.82 2jm9 n SER 36 N 5.31 1.26 0.07 -4.21 3.41 -1.26 -0.35 113.62 117.84 2jm9 n SER 36 Ca -0.04 -2.74 0.12 0.00 -0.26 0.00 0.00 58.87 55.95 2jm9 n SER 36 Cb 0.50 -0.39 0.47 0.00 -0.26 0.00 0.00 64.21 64.53 2jm9 n SER 36 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2jm9 n THR 37 N -0.19 0.54 -3.41 6.66 5.66 -1.26 -4.70 114.28 117.58 2jm9 n THR 37 Ca 0.11 -0.02 -0.32 0.00 -3.05 0.00 0.00 64.05 60.77 2jm9 n THR 37 Cb 0.94 -0.74 -0.05 0.00 -1.55 0.00 0.00 70.33 68.92 2jm9 n THR 37 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2jm9 s ASN 38 N -3.82 6.64 0.00 1.09 3.84 -1.26 -5.00 114.94 116.44 2jm9 s ASN 38 Ca 0.10 0.93 0.21 0.00 0.21 0.00 0.00 52.86 54.31 2jm9 s ASN 38 Cb 0.13 -2.23 -0.15 0.00 -0.55 0.00 0.00 41.25 38.45 2jm9 s ASN 38 CO 0.49 -0.06 0.94 2.29 -2.79 0.00 0.00 177.10 177.97 2jm9 n LYS 39 N -0.05 0.54 -0.02 0.43 2.85 -1.26 -4.46 118.16 116.19 2jm9 n LYS 39 Ca -0.00 -0.34 -0.01 0.00 -1.05 0.00 0.00 58.31 56.91 2jm9 n LYS 39 Cb 0.52 -1.47 -0.04 0.00 -0.65 0.00 0.00 35.03 33.39 2jm9 n LYS 39 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2jm9 n ASP 40 N -0.99 3.81 -4.02 -5.58 2.03 -1.26 -4.72 116.55 105.82 2jm9 n ASP 40 Ca 0.06 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.11 2jm9 n ASP 40 Cb 0.37 0.81 -0.17 0.00 -0.72 0.00 0.00 41.12 41.42 2jm9 n ASP 40 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 2jm9 s TRP 41 N -2.19 1.53 -0.17 -0.67 0.52 -1.26 -0.88 118.94 115.82 2jm9 s TRP 41 Ca -0.02 -0.61 -0.00 0.00 0.02 0.00 0.00 56.10 55.48 2jm9 s TRP 41 Cb 0.02 -1.14 0.00 0.00 -1.15 0.00 0.00 33.47 31.20 2jm9 s TRP 41 CO 0.20 -0.33 -0.15 -1.58 0.02 0.00 0.00 176.95 175.11 2jm9 s TRP 42 N 0.83 2.80 -0.23 -1.98 0.52 0.80 -4.28 118.94 117.40 2jm9 s TRP 42 Ca -0.11 -1.20 -0.28 0.00 0.02 0.00 0.00 56.10 54.52 2jm9 s TRP 42 Cb -0.15 -1.92 0.01 0.00 -1.15 0.00 0.00 33.47 30.25 2jm9 s TRP 42 CO 0.02 -0.58 1.01 0.21 0.02 0.00 0.00 176.95 177.63 2jm9 s LYS 43 N 1.03 4.25 0.22 4.98 2.20 0.52 -1.16 119.74 131.80 2jm9 s LYS 43 Ca -0.01 1.31 0.02 0.00 -0.36 0.00 0.00 55.97 56.92 2jm9 s LYS 43 Cb -0.15 -3.64 -0.05 0.00 -1.51 0.00 0.00 37.83 32.49 2jm9 s LYS 43 CO -0.04 -0.61 0.05 0.14 -0.36 0.00 0.00 175.35 174.53 2jm9 s VAL 44 N 3.14 0.66 -0.13 4.02 -7.23 0.81 0.13 120.40 121.79 2jm9 s VAL 44 Ca 0.43 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.63 2jm9 s VAL 44 Cb -0.15 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.38 2jm9 s VAL 44 CO 0.06 -0.22 -0.20 -0.70 -0.31 0.00 0.00 175.10 173.73 2jm9 s GLU 45 N -3.97 3.09 -0.28 4.82 2.12 -0.22 -0.44 118.70 123.83 2jm9 s GLU 45 Ca 0.31 -0.83 -0.01 0.00 0.36 0.00 0.00 54.97 54.81 2jm9 s GLU 45 Cb 0.07 -2.46 0.04 0.00 0.26 0.00 0.00 34.13 32.05 2jm9 s GLU 45 CO 0.09 0.05 -0.03 0.14 -0.54 0.00 0.00 175.26 174.98 2jm9 s VAL 46 N 0.67 2.86 0.00 3.70 -7.23 0.44 -2.98 120.40 117.87 2jm9 s VAL 46 Ca -0.10 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 2jm9 s VAL 46 Cb -0.16 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.18 2jm9 s VAL 46 CO 0.02 -0.02 0.00 0.59 -0.31 0.00 0.00 175.10 175.38 2jm9 n ASN 47 N 4.61 0.00 0.00 4.85 3.02 -1.26 -1.14 115.26 125.34 2jm9 n ASN 47 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 2jm9 n ASN 47 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 2jm9 n ASN 47 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2jm9 n ASP 48 N 1.61 0.00 -4.65 6.41 2.03 -1.26 -5.09 116.55 115.60 2jm9 n ASP 48 Ca 0.00 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.93 2jm9 n ASP 48 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 2jm9 n ASP 48 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2jm9 s ARG 49 N 0.00 4.11 -0.32 -0.67 1.81 -0.29 -5.04 118.95 118.55 2jm9 s ARG 49 Ca 0.00 0.07 -0.10 0.00 -1.72 0.00 0.00 55.73 53.98 2jm9 s ARG 49 Cb 0.00 -3.57 -0.01 0.00 -0.45 0.00 0.00 34.95 30.91 2jm9 s ARG 49 CO 0.00 -0.10 0.17 -0.65 -0.68 0.00 0.00 175.30 174.05 2jm9 s GLN 50 N 1.50 3.41 0.27 3.54 -0.21 -1.26 -0.42 119.66 126.49 2jm9 s GLN 50 Ca 0.16 -0.68 -0.16 0.00 0.02 0.00 0.00 55.36 54.70 2jm9 s GLN 50 Cb -0.15 -3.63 0.01 0.00 1.00 0.00 0.00 33.01 30.24 2jm9 s GLN 50 CO 0.08 -0.41 0.59 0.20 -2.12 0.00 0.00 175.29 173.63 2jm9 s GLY 51 N 1.65 0.30 0.27 3.09 0.00 0.42 -4.79 107.32 108.26 2jm9 s GLY 51 Ca 0.05 -0.66 -0.18 0.00 0.00 0.00 0.00 44.72 43.93 2jm9 s GLY 51 CO 0.07 -0.40 0.75 -1.36 0.00 0.00 0.00 173.10 172.16 2jm9 s PHE 52 N -3.87 3.54 0.05 1.90 0.08 0.98 -0.14 117.98 120.52 2jm9 s PHE 52 Ca 0.18 1.35 -0.02 0.00 0.12 0.00 0.00 56.93 58.56 2jm9 s PHE 52 Cb -0.03 -2.61 -0.03 0.00 -0.57 0.00 0.00 43.02 39.77 2jm9 s PHE 52 CO 0.09 0.23 -0.00 0.14 -0.10 0.00 0.00 175.22 175.57 2jm9 s VAL 53 N -1.71 0.21 0.10 -0.44 -7.23 -0.31 -2.63 120.40 108.39 2jm9 s VAL 53 Ca 0.48 -1.70 -0.31 0.00 -1.81 0.00 0.00 61.98 58.64 2jm9 s VAL 53 Cb -0.14 -1.45 -0.10 0.00 0.56 0.00 0.00 36.38 35.25 2jm9 s VAL 53 CO 0.20 -0.94 1.88 -2.84 -0.31 0.00 0.00 175.10 173.09 2jm9 s PRO 54 N -3.81 4.13 0.54 4.82 0.02 -1.26 -0.14 135.00 139.31 2jm9 s PRO 54 Ca 0.06 2.62 0.23 0.00 0.02 0.00 0.00 61.00 63.93 2jm9 s PRO 54 Cb 0.07 -3.76 1.51 0.00 0.02 0.00 0.00 34.50 32.33 2jm9 s PRO 54 CO -0.10 -0.88 2.17 0.00 -0.33 0.00 0.00 177.00 177.86 2jm9 h ALA 55 N 9.21 1.69 0.00 -1.55 0.00 -1.30 0.13 119.26 127.45 2jm9 h ALA 55 Ca -0.47 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2jm9 h ALA 55 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2jm9 h ALA 55 CO 0.95 0.04 0.00 0.00 0.00 0.00 0.00 179.25 180.24 2jm9 h ALA 56 N 1.97 1.00 -0.02 0.00 0.00 -1.86 -2.67 119.26 117.68 2jm9 h ALA 56 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jm9 h ALA 56 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2jm9 h ALA 56 CO 0.00 0.00 -0.15 0.66 0.00 0.00 0.00 179.25 179.77 2jm9 n TYR 57 N -2.65 0.00 -4.31 0.00 4.02 0.03 -4.88 117.16 109.37 2jm9 n TYR 57 Ca 0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.70 2jm9 n TYR 57 Cb 0.26 -0.03 -0.13 0.00 -0.02 0.00 0.00 39.34 39.42 2jm9 n TYR 57 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2jm9 s VAL 58 N -2.21 1.20 -0.05 -0.72 0.11 -1.01 -0.34 120.40 117.38 2jm9 s VAL 58 Ca 0.29 -1.15 0.04 0.00 -2.93 0.00 0.00 61.98 58.22 2jm9 s VAL 58 Cb 0.20 -1.10 0.00 0.00 -1.53 0.00 0.00 36.38 33.95 2jm9 s VAL 58 CO 0.41 -0.06 -0.16 -0.75 -3.33 0.00 0.00 175.10 171.22 2jm9 s LYS 59 N -1.39 1.75 -0.17 1.54 2.20 -0.26 -4.91 119.74 118.49 2jm9 s LYS 59 Ca 0.01 -0.55 -0.33 0.00 -0.36 0.00 0.00 55.97 54.74 2jm9 s LYS 59 Cb -0.09 -1.49 -0.10 0.00 -1.51 0.00 0.00 37.83 34.63 2jm9 s LYS 59 CO 0.02 0.18 2.01 1.17 -0.36 0.00 0.00 175.35 178.38 2jm9 n LYS 60 N 3.31 1.92 -0.00 4.03 3.00 -1.26 -0.75 118.16 128.39 2jm9 n LYS 60 Ca -0.19 0.65 -0.21 0.00 -0.00 0.00 0.00 58.31 58.56 2jm9 n LYS 60 Cb 0.53 -2.72 -0.14 0.00 0.00 0.00 0.00 35.03 32.70 2jm9 n LYS 60 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2jm9 h LEU 61 N 11.00 0.33 0.00 3.14 3.38 -1.62 -3.47 115.31 128.08 2jm9 h LEU 61 Ca -0.43 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 56.71 2jm9 h LEU 61 Cb 1.28 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2jm9 h LEU 61 CO 0.97 1.56 0.00 -0.67 0.09 0.00 0.00 178.44 180.39