#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jk0 s LEU 4 N 0.00 4.36 0.33 1.20 2.96 -1.26 -5.04 118.68 121.24 2jk0 s LEU 4 Ca 0.00 0.81 -0.28 0.00 -0.22 0.00 0.00 54.13 54.44 2jk0 s LEU 4 Cb 0.00 -2.56 -0.13 0.00 0.50 0.00 0.00 46.19 44.00 2jk0 s LEU 4 CO 0.00 0.18 1.17 -2.65 -1.32 0.00 0.00 176.35 173.73 2jk0 n PRO 5 N 2.75 1.79 -3.27 0.98 -0.02 -1.26 -4.29 135.00 131.67 2jk0 n PRO 5 Ca -0.12 0.63 -0.38 0.00 -2.02 0.00 0.00 63.50 61.61 2jk0 n PRO 5 Cb 0.52 -2.13 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 2jk0 n PRO 5 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2jk0 s ASN 6 N -0.44 6.71 -0.03 2.55 0.01 -1.26 -0.61 114.94 121.86 2jk0 s ASN 6 Ca 0.57 0.84 0.01 0.00 -0.71 0.00 0.00 52.86 53.57 2jk0 s ASN 6 Cb -0.61 -2.30 0.02 0.00 0.41 0.00 0.00 41.25 38.77 2jk0 s ASN 6 CO 0.61 -0.04 -0.02 -0.63 -1.51 0.00 0.00 177.10 175.52 2jk0 s ILE 7 N 0.77 0.30 -0.22 0.60 -1.09 -0.47 -1.01 121.20 120.08 2jk0 s ILE 7 Ca 0.27 0.01 -0.09 0.00 -2.23 0.00 0.00 60.65 58.62 2jk0 s ILE 7 Cb -0.15 -0.37 -0.04 0.00 -1.58 0.00 0.00 42.46 40.32 2jk0 s ILE 7 CO 0.11 0.17 0.11 -0.69 -1.23 0.00 0.00 174.94 173.41 2jk0 s VAL 8 N 0.96 4.91 -0.30 2.92 1.01 -0.80 -2.00 120.40 127.11 2jk0 s VAL 8 Ca -0.11 0.02 -0.15 0.00 0.00 0.00 0.00 61.98 61.75 2jk0 s VAL 8 Cb -0.14 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 2jk0 s VAL 8 CO -0.01 0.38 0.36 -0.63 0.00 0.00 0.00 175.10 175.20 2jk0 s ILE 9 N 1.00 5.17 -0.28 2.22 1.01 0.08 -0.54 121.20 129.86 2jk0 s ILE 9 Ca 0.05 0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.93 2jk0 s ILE 9 Cb -0.14 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 2jk0 s ILE 9 CO 0.03 0.05 0.18 -0.76 0.00 0.00 0.00 174.94 174.44 2jk0 s LEU 10 N 2.05 4.01 -0.15 2.97 1.02 0.20 -1.50 118.68 127.28 2jk0 s LEU 10 Ca 0.13 -0.08 -0.14 0.00 0.02 0.00 0.00 54.13 54.07 2jk0 s LEU 10 Cb -0.16 -2.10 -0.05 0.00 0.02 0.00 0.00 46.19 43.90 2jk0 s LEU 10 CO 0.11 -0.07 0.30 0.00 0.02 0.00 0.00 176.35 176.71 2jk0 s ALA 11 N 1.74 3.60 -0.12 4.21 0.00 0.76 -1.06 121.76 130.89 2jk0 s ALA 11 Ca 0.07 -0.45 0.06 0.00 0.00 0.00 0.00 51.96 51.64 2jk0 s ALA 11 Cb -0.16 -2.39 -0.08 0.00 0.00 0.00 0.00 23.12 20.50 2jk0 s ALA 11 CO 0.10 0.11 0.17 2.41 0.00 0.00 0.00 175.76 178.56 2jk0 n THR 12 N 3.48 0.00 0.00 0.00 -1.04 -0.37 -0.71 114.28 115.65 2jk0 n THR 12 Ca -0.12 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 2jk0 n THR 12 Cb 0.52 0.63 0.00 0.00 -1.82 0.00 0.00 70.33 69.66 2jk0 n THR 12 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jk0 n GLY 13 N 1.74 0.02 0.00 3.41 0.00 -1.17 -1.85 105.19 107.33 2jk0 n GLY 13 Ca -0.00 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.17 2jk0 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jk0 n GLY 14 N 0.00 -0.11 0.28 -0.02 0.00 -0.66 -3.80 105.19 100.88 2jk0 n GLY 14 Ca 0.00 -1.78 0.17 0.00 0.00 0.00 0.00 46.02 44.41 2jk0 n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2jk0 h THR 15 N 0.00 0.24 0.00 2.61 2.02 -1.83 -1.73 112.91 114.23 2jk0 h THR 15 Ca 0.00 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.75 2jk0 h THR 15 Cb 0.00 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2jk0 h THR 15 CO 0.00 0.06 0.00 -0.29 0.37 0.00 0.00 175.52 175.66 2jk0 h ILE 16 N 0.00 0.00 -0.06 3.11 2.10 -1.80 -2.40 117.51 118.46 2jk0 h ILE 16 Ca -0.00 -0.02 -0.02 0.00 1.08 0.00 0.00 64.86 65.90 2jk0 h ILE 16 Cb 0.34 0.99 -0.01 0.00 -1.09 0.00 0.00 36.82 37.04 2jk0 h ILE 16 CO 0.01 0.00 -0.23 0.00 -1.08 0.00 0.00 178.15 176.85 2jk0 n ALA 17 N -2.06 3.19 -2.85 0.18 0.00 -0.65 -4.47 120.51 113.85 2jk0 n ALA 17 Ca -0.03 -2.97 -0.37 0.00 0.00 0.00 0.00 53.44 50.07 2jk0 n ALA 17 Cb 0.08 -0.43 -0.07 0.00 0.00 0.00 0.00 19.45 19.03 2jk0 n ALA 17 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jk0 s GLY 18 N -2.93 2.11 0.26 0.00 0.00 -0.90 -0.33 107.32 105.53 2jk0 s GLY 18 Ca 0.37 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.42 2jk0 s GLY 18 CO -0.01 -0.42 0.45 -0.56 0.00 0.00 0.00 173.10 172.56 2jk0 s SER 19 N -1.03 6.35 0.21 1.64 0.01 -1.26 -3.16 113.70 116.47 2jk0 s SER 19 Ca 0.15 0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.81 2jk0 s SER 19 Cb -0.12 -2.01 -0.00 0.00 0.21 0.00 0.00 66.02 64.10 2jk0 s SER 19 CO 0.04 -0.14 0.27 0.00 0.41 0.00 0.00 173.24 173.82 2jk0 n ALA 20 N -1.14 -0.05 -1.22 1.44 0.00 -1.26 -5.03 120.51 113.25 2jk0 n ALA 20 Ca -0.05 -1.05 0.07 0.00 0.00 0.00 0.00 53.44 52.41 2jk0 n ALA 20 Cb 0.55 0.85 0.19 0.00 0.00 0.00 0.00 19.45 21.03 2jk0 n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jk0 n ALA 21 N -1.58 2.99 -1.52 0.00 0.00 -1.26 -5.05 120.51 114.09 2jk0 n ALA 21 Ca -0.08 -2.78 0.00 0.00 0.00 0.00 0.00 53.44 50.58 2jk0 n ALA 21 Cb 0.36 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.32 2jk0 n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jk0 n ALA 22 N -1.14 0.00 0.00 0.00 0.00 -1.26 -5.20 120.51 112.91 2jk0 n ALA 22 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2jk0 n ALA 22 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.21 2jk0 n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jk0 n LEU 34 N 0.00 0.00 -4.78 0.00 4.77 0.55 -4.49 117.00 113.05 2jk0 n LEU 34 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 2jk0 n LEU 34 Cb 0.19 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.37 2jk0 n LEU 34 CO 0.00 0.00 0.70 -0.83 -1.33 0.00 0.00 177.39 175.93 2jk0 s GLY 35 N 0.00 1.67 0.54 -0.72 0.00 -1.26 -4.81 107.32 102.74 2jk0 s GLY 35 Ca 0.00 0.22 0.27 0.00 0.00 0.00 0.00 44.72 45.21 2jk0 s GLY 35 CO 0.00 0.56 1.96 -0.24 0.00 0.00 0.00 173.10 175.38 2jk0 h VAL 36 N -1.07 0.64 0.05 1.40 3.04 -1.96 -1.71 116.25 116.65 2jk0 h VAL 36 Ca -0.44 0.00 -0.23 0.00 -1.01 0.00 0.00 66.70 65.02 2jk0 h VAL 36 Cb 1.23 0.68 -0.01 0.00 -2.01 0.00 0.00 31.29 31.18 2jk0 h VAL 36 CO 0.53 0.00 -1.07 -0.08 -1.01 0.00 0.00 177.57 175.94 2jk0 h GLU 37 N 0.00 0.15 -0.26 4.17 4.57 -1.96 -1.75 114.58 119.49 2jk0 h GLU 37 Ca 0.29 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 2jk0 h GLU 37 Cb 1.19 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.85 2jk0 h GLU 37 CO -0.00 1.07 0.13 1.15 -1.18 0.00 0.00 179.01 180.18 2jk0 h THR 38 N 0.05 1.14 -0.40 0.32 2.02 -1.68 -0.63 112.91 113.74 2jk0 h THR 38 Ca -0.07 -0.40 0.06 0.00 0.77 0.00 0.00 66.41 66.77 2jk0 h THR 38 Cb 1.79 0.92 -0.05 0.00 -1.74 0.00 0.00 68.15 69.07 2jk0 h THR 38 CO 0.16 0.14 0.09 -0.07 0.37 0.00 0.00 175.52 176.21 2jk0 h LEU 39 N 0.30 0.03 -0.03 2.58 4.07 -1.45 -1.36 115.31 119.45 2jk0 h LEU 39 Ca 0.09 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.11 2jk0 h LEU 39 Cb 0.11 0.08 -0.00 0.00 1.08 0.00 0.00 40.66 41.93 2jk0 h LEU 39 CO -0.01 0.05 0.01 0.40 -1.08 0.00 0.00 178.44 177.82 2jk0 h ILE 40 N 0.23 1.13 -0.99 1.22 2.04 -1.21 -2.73 117.51 117.19 2jk0 h ILE 40 Ca 0.19 -0.38 0.25 0.00 1.00 0.00 0.00 64.86 65.93 2jk0 h ILE 40 Cb 0.22 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 37.56 2jk0 h ILE 40 CO -0.24 0.10 0.67 -0.61 0.00 0.00 0.00 178.15 178.07 2jk0 h GLN 41 N -0.10 0.27 0.00 2.37 5.75 -0.80 -2.26 115.11 120.34 2jk0 h GLN 41 Ca 0.01 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.46 2jk0 h GLN 41 Cb 0.16 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.64 2jk0 h GLN 41 CO -0.00 0.18 -0.15 0.00 -2.65 0.00 0.00 178.83 176.21 2jk0 h ALA 42 N 1.58 0.92 -3.05 3.38 0.00 -0.93 -3.35 119.26 117.81 2jk0 h ALA 42 Ca 0.52 -0.13 -0.63 0.00 0.00 0.00 0.00 54.91 54.66 2jk0 h ALA 42 Cb 1.53 -0.02 -0.41 0.00 0.00 0.00 0.00 17.79 18.89 2jk0 h ALA 42 CO -0.17 0.18 -0.50 0.08 0.00 0.00 0.00 179.25 178.84 2jk0 s VAL 43 N -3.26 3.11 -1.74 0.00 1.01 -0.85 -4.94 120.40 113.74 2jk0 s VAL 43 Ca 0.05 -4.25 0.07 0.00 0.00 0.00 0.00 61.98 57.84 2jk0 s VAL 43 Cb 0.07 -3.02 0.16 0.00 0.00 0.00 0.00 36.38 33.59 2jk0 s VAL 43 CO 0.67 -1.02 0.96 -2.65 0.00 0.00 0.00 175.10 173.06 2jk0 n PRO 44 N 1.99 0.16 0.00 2.72 -0.02 -1.26 -2.04 135.00 136.55 2jk0 n PRO 44 Ca 0.20 0.10 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 2jk0 n PRO 44 Cb 0.35 -1.50 0.44 0.00 -0.02 0.00 0.00 33.50 32.77 2jk0 n PRO 44 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2jk0 n GLU 45 N -1.13 0.84 0.07 -0.52 4.71 -1.26 -3.41 120.64 119.93 2jk0 n GLU 45 Ca 0.04 -0.45 -0.01 0.00 -0.01 0.00 0.00 57.16 56.73 2jk0 n GLU 45 Cb 0.04 -1.49 0.28 0.00 -1.01 0.00 0.00 31.44 29.25 2jk0 n GLU 45 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2jk0 h LEU 46 N 1.10 0.34 -2.00 -4.62 3.38 -1.77 -2.84 115.31 108.90 2jk0 h LEU 46 Ca 0.00 -0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.05 2jk0 h LEU 46 Cb 0.47 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2jk0 h LEU 46 CO 0.00 0.58 0.48 0.11 0.09 0.00 0.00 178.44 179.70 2jk0 h LYS 47 N 0.31 0.00 0.00 1.13 1.57 -1.75 0.20 116.57 118.04 2jk0 h LYS 47 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2jk0 h LYS 47 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2jk0 h LYS 47 CO 0.04 0.00 0.00 1.79 -0.57 0.00 0.00 179.45 180.71 2jk0 h THR 48 N 0.00 0.00 0.04 -0.16 1.35 -1.75 -3.35 112.91 109.04 2jk0 h THR 48 Ca 0.29 -0.79 -0.34 0.00 -0.55 0.00 0.00 66.41 65.02 2jk0 h THR 48 Cb 1.25 1.78 -0.04 0.00 -1.73 0.00 0.00 68.15 69.41 2jk0 h THR 48 CO -0.00 0.00 -1.93 0.18 -0.25 0.00 0.00 175.52 173.51 2jk0 n LEU 49 N -3.01 2.28 -3.78 3.87 4.77 0.64 -5.08 117.00 116.69 2jk0 n LEU 49 Ca 0.03 0.26 -0.07 0.00 -0.03 0.00 0.00 56.01 56.20 2jk0 n LEU 49 Cb 0.44 -0.97 -0.02 0.00 -2.33 0.00 0.00 43.42 40.54 2jk0 n LEU 49 CO 0.31 0.61 0.50 0.00 -1.33 0.00 0.00 177.39 177.48 2jk0 s ALA 50 N -2.47 -1.34 -0.25 -1.18 0.00 -0.73 -4.37 121.76 111.42 2jk0 s ALA 50 Ca -0.30 -0.12 -0.21 0.00 0.00 0.00 0.00 51.96 51.33 2jk0 s ALA 50 Cb 0.08 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 24.01 2jk0 s ALA 50 CO 0.62 -1.00 0.66 -0.80 0.00 0.00 0.00 175.76 175.25 2jk0 s ASN 51 N -2.89 6.62 -0.13 0.00 0.01 0.22 -4.34 114.94 114.43 2jk0 s ASN 51 Ca 0.10 0.76 -0.01 0.00 -0.71 0.00 0.00 52.86 53.00 2jk0 s ASN 51 Cb -0.05 -2.35 -0.02 0.00 0.41 0.00 0.00 41.25 39.24 2jk0 s ASN 51 CO 0.03 -0.40 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.49 2jk0 s ILE 52 N 2.57 3.32 -0.04 0.60 -1.09 -1.26 -1.37 121.20 123.93 2jk0 s ILE 52 Ca 0.28 -0.57 0.05 0.00 -2.23 0.00 0.00 60.65 58.18 2jk0 s ILE 52 Cb -0.15 -2.41 -0.02 0.00 -1.58 0.00 0.00 42.46 38.29 2jk0 s ILE 52 CO 0.08 0.52 -0.18 -0.54 -1.23 0.00 0.00 174.94 173.59 2jk0 s LYS 53 N 0.30 2.39 0.06 2.79 3.01 -0.85 -5.01 119.74 122.43 2jk0 s LYS 53 Ca -0.08 -0.77 0.05 0.00 -1.01 0.00 0.00 55.97 54.16 2jk0 s LYS 53 Cb -0.15 -2.28 -0.04 0.00 -1.01 0.00 0.00 37.83 34.35 2jk0 s LYS 53 CO 0.05 0.60 -0.05 0.20 0.51 0.00 0.00 175.35 176.66 2jk0 s GLY 54 N -0.69 1.82 -0.06 -3.33 0.00 -1.26 -0.74 107.32 103.06 2jk0 s GLY 54 Ca 0.11 -1.11 -0.06 0.00 0.00 0.00 0.00 44.72 43.66 2jk0 s GLY 54 CO 0.00 -1.04 0.17 1.85 0.00 0.00 0.00 173.10 174.08 2jk0 s GLU 55 N -1.93 0.19 -0.61 2.90 2.12 -0.56 -4.95 118.70 115.86 2jk0 s GLU 55 Ca 0.21 0.24 -0.14 0.00 0.36 0.00 0.00 54.97 55.65 2jk0 s GLU 55 Cb -0.11 0.09 0.15 0.00 0.26 0.00 0.00 34.13 34.52 2jk0 s GLU 55 CO 0.13 -0.03 0.54 -1.14 -0.54 0.00 0.00 175.26 174.22 2jk0 s GLN 56 N 0.13 3.04 0.12 4.30 2.00 -1.26 -0.17 119.66 127.82 2jk0 s GLN 56 Ca -0.00 -1.97 -0.09 0.00 -2.00 0.00 0.00 55.36 51.29 2jk0 s GLN 56 Cb -0.01 -4.24 -0.09 0.00 0.80 0.00 0.00 33.01 29.47 2jk0 s GLN 56 CO -0.00 -1.29 1.34 0.28 -0.50 0.00 0.00 175.29 175.13 2jk0 h VAL 57 N 5.60 1.31 -2.34 1.34 2.07 -1.27 -3.48 116.25 119.48 2jk0 h VAL 57 Ca -0.16 -2.02 0.17 0.00 0.82 0.00 0.00 66.70 65.52 2jk0 h VAL 57 Cb 1.07 2.02 -0.08 0.00 -1.52 0.00 0.00 31.29 32.77 2jk0 h VAL 57 CO 0.91 0.63 0.48 0.00 0.02 0.00 0.00 177.57 179.62 2jk0 s ALA 58 N -3.71 -1.67 -0.41 1.67 0.00 -0.78 -5.01 121.76 111.86 2jk0 s ALA 58 Ca -0.09 0.17 0.07 0.00 0.00 0.00 0.00 51.96 52.12 2jk0 s ALA 58 Cb 0.09 0.63 0.24 0.00 0.00 0.00 0.00 23.12 24.08 2jk0 s ALA 58 CO 0.89 -1.02 0.53 0.45 0.00 0.00 0.00 175.76 176.60 2jk0 n SER 59 N -0.46 -0.30 -4.34 0.00 2.88 -1.19 -3.06 113.62 107.16 2jk0 n SER 59 Ca -0.06 -2.70 -0.18 0.00 -1.33 0.00 0.00 58.87 54.60 2jk0 n SER 59 Cb 0.61 -0.34 -0.10 0.00 -0.75 0.00 0.00 64.21 63.62 2jk0 n SER 59 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2jk0 s ILE 60 N -0.77 1.61 0.27 2.46 -4.36 -0.77 -4.90 121.20 114.74 2jk0 s ILE 60 Ca 0.34 -2.17 -0.30 0.00 -0.26 0.00 0.00 60.65 58.26 2jk0 s ILE 60 Cb 0.15 -2.06 -0.10 0.00 1.25 0.00 0.00 42.46 41.71 2jk0 s ILE 60 CO -0.14 -0.59 1.34 -0.83 0.24 0.00 0.00 174.94 174.97 2jk0 s GLY 61 N -3.30 2.64 0.57 6.27 0.00 -1.26 -1.66 107.32 110.58 2jk0 s GLY 61 Ca 0.22 1.23 0.31 0.00 0.00 0.00 0.00 44.72 46.48 2jk0 s GLY 61 CO 0.06 2.06 2.19 1.48 0.00 0.00 0.00 173.10 178.89 2jk0 h SER 62 N 4.45 0.00 -0.21 1.64 4.64 -1.91 0.16 113.55 122.32 2jk0 h SER 62 Ca -0.47 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 60.91 2jk0 h SER 62 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2jk0 h SER 62 CO 0.72 0.05 0.27 1.05 -0.87 0.00 0.00 176.83 178.05 2jk0 h GLU 63 N 0.00 0.00 -0.61 4.77 -0.00 -1.91 0.44 114.58 117.27 2jk0 h GLU 63 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2jk0 h GLU 63 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.90 2jk0 h GLU 63 CO 0.01 0.00 0.00 0.09 -0.00 0.00 0.00 179.01 179.11 2jk0 n ASN 64 N -3.63 3.77 -4.75 3.06 3.02 0.56 -4.97 115.26 112.33 2jk0 n ASN 64 Ca 0.02 -1.99 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 2jk0 n ASN 64 Cb 0.39 -0.40 -0.01 0.00 -0.61 0.00 0.00 39.78 39.14 2jk0 n ASN 64 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2jk0 s MET 65 N -1.16 4.13 0.04 3.52 1.75 0.14 -4.99 119.30 122.73 2jk0 s MET 65 Ca 0.45 2.57 0.03 0.00 -1.25 0.00 0.00 55.69 57.49 2jk0 s MET 65 Cb 0.24 -3.02 -0.02 0.00 2.84 0.00 0.00 34.83 34.87 2jk0 s MET 65 CO 0.32 -0.62 -0.10 0.95 -0.65 0.00 0.00 175.02 174.92 2jk0 s THR 66 N -0.09 0.77 0.29 10.11 -4.23 -1.26 -5.06 115.64 116.18 2jk0 s THR 66 Ca 0.62 -0.94 0.00 0.00 -1.18 0.00 0.00 61.69 60.19 2jk0 s THR 66 Cb -0.47 -0.75 0.40 0.00 1.34 0.00 0.00 72.50 73.02 2jk0 s THR 66 CO 0.49 -0.16 1.47 -1.54 -0.54 0.00 0.00 174.62 174.34 2jk0 n SER 67 N 1.82 -0.14 0.20 3.99 3.41 -1.26 -0.83 113.62 120.81 2jk0 n SER 67 Ca -0.19 1.60 0.05 0.00 -0.26 0.00 0.00 58.87 60.07 2jk0 n SER 67 Cb 0.55 -0.57 0.44 0.00 -0.26 0.00 0.00 64.21 64.37 2jk0 n SER 67 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2jk0 h ASP 68 N 0.00 0.00 0.52 4.04 2.03 -1.97 0.15 116.42 121.19 2jk0 h ASP 68 Ca 0.55 0.00 -0.25 0.00 -0.73 0.00 0.00 57.03 56.60 2jk0 h ASP 68 Cb 1.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.60 2jk0 h ASP 68 CO -0.90 0.31 -1.10 0.58 -1.03 0.00 0.00 179.24 177.10 2jk0 h VAL 69 N 0.00 1.46 -0.35 4.15 2.07 -1.40 -2.88 116.25 119.30 2jk0 h VAL 69 Ca -0.00 -2.80 0.02 0.00 0.82 0.00 0.00 66.70 64.74 2jk0 h VAL 69 Cb 0.60 2.71 -0.03 0.00 -1.52 0.00 0.00 31.29 33.05 2jk0 h VAL 69 CO 0.04 0.82 0.19 -0.07 0.02 0.00 0.00 177.57 178.57 2jk0 h LEU 70 N 0.13 0.28 -0.10 2.57 3.38 -0.40 -0.44 115.31 120.74 2jk0 h LEU 70 Ca -0.11 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.91 2jk0 h LEU 70 Cb 1.79 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.46 2jk0 h LEU 70 CO 0.18 0.21 -0.10 -0.07 0.09 0.00 0.00 178.44 178.75 2jk0 h LEU 71 N 0.38 -0.31 -0.76 1.67 3.38 -0.78 0.63 115.31 119.52 2jk0 h LEU 71 Ca 0.15 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.30 2jk0 h LEU 71 Cb 0.04 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.86 2jk0 h LEU 71 CO -0.09 -0.13 0.36 0.74 0.09 0.00 0.00 178.44 179.40 2jk0 h THR 72 N -0.12 0.76 -0.06 0.22 2.02 -1.32 -0.74 112.91 113.67 2jk0 h THR 72 Ca 0.07 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2jk0 h THR 72 Cb 0.23 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 66.78 2jk0 h THR 72 CO -0.18 0.10 -0.02 0.25 0.37 0.00 0.00 175.52 176.05 2jk0 h LEU 73 N 0.56 0.12 -0.35 2.58 5.85 -0.18 -2.43 115.31 121.46 2jk0 h LEU 73 Ca 0.40 -0.38 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2jk0 h LEU 73 Cb 0.52 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2jk0 h LEU 73 CO -0.33 0.47 0.16 -1.28 -0.34 0.00 0.00 178.44 177.12 2jk0 h SER 74 N -0.24 0.22 -0.74 1.25 0.87 0.75 0.91 113.55 116.57 2jk0 h SER 74 Ca 0.01 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 2jk0 h SER 74 Cb 0.42 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 2jk0 h SER 74 CO 0.01 0.17 0.31 0.11 -0.53 0.00 0.00 176.83 176.90 2jk0 h LYS 75 N 0.33 1.10 -0.41 2.24 1.57 -1.22 -1.15 116.57 119.04 2jk0 h LYS 75 Ca 0.15 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 2jk0 h LYS 75 Cb 0.08 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2jk0 h LYS 75 CO -0.12 0.89 -0.07 -0.09 -0.57 0.00 0.00 179.45 179.49 2jk0 h ARG 76 N 1.06 0.77 0.01 3.15 9.65 -0.85 0.22 114.38 128.39 2jk0 h ARG 76 Ca 0.25 -0.28 0.02 0.00 -1.10 0.00 0.00 59.98 58.87 2jk0 h ARG 76 Cb 0.19 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 2jk0 h ARG 76 CO -0.02 0.89 -0.12 0.28 2.80 0.00 0.00 179.97 183.79 2jk0 h VAL 77 N 0.59 0.71 -0.89 0.20 2.07 -0.79 0.50 116.25 118.64 2jk0 h VAL 77 Ca 0.11 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.69 2jk0 h VAL 77 Cb 0.58 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 2jk0 h VAL 77 CO 0.03 0.00 0.56 0.78 0.02 0.00 0.00 177.57 178.96 2jk0 h ASN 78 N -0.21 0.89 -0.60 0.57 2.35 -0.76 -0.23 115.58 117.59 2jk0 h ASN 78 Ca 0.04 0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.73 2jk0 h ASN 78 Cb 0.26 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 2jk0 h ASN 78 CO -0.11 0.58 0.10 -0.08 -1.65 0.00 0.00 177.43 176.27 2jk0 h GLU 79 N 1.03 0.99 -0.06 0.81 4.81 -0.23 -2.75 114.58 119.18 2jk0 h GLU 79 Ca 0.38 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2jk0 h GLU 79 Cb 0.14 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 2jk0 h GLU 79 CO -0.16 0.93 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.89 2jk0 h LEU 80 N 0.89 0.19 -1.33 1.64 3.38 -0.23 -3.13 115.31 116.73 2jk0 h LEU 80 Ca 0.18 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2jk0 h LEU 80 Cb 0.42 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2jk0 h LEU 80 CO 0.01 0.67 0.00 -0.07 0.09 0.00 0.00 178.44 179.14 2jk0 h LEU 81 N -0.30 0.00 -0.32 1.67 3.38 -1.07 -2.23 115.31 116.44 2jk0 h LEU 81 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2jk0 h LEU 81 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2jk0 h LEU 81 CO 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 178.44 178.55 2jk0 n ALA 82 N -1.82 2.65 -2.41 1.53 0.00 -1.04 -4.89 120.51 114.53 2jk0 n ALA 82 Ca -0.00 -0.28 -0.33 0.00 0.00 0.00 0.00 53.44 52.83 2jk0 n ALA 82 Cb 0.12 -1.40 -0.05 0.00 0.00 0.00 0.00 19.45 18.12 2jk0 n ALA 82 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jk0 s ARG 83 N -2.02 3.83 0.44 0.00 0.52 -0.84 -4.98 118.95 115.90 2jk0 s ARG 83 Ca 0.44 0.30 0.12 0.00 -0.52 0.00 0.00 55.73 56.07 2jk0 s ARG 83 Cb 0.22 -2.71 1.02 0.00 0.52 0.00 0.00 34.95 33.99 2jk0 s ARG 83 CO 0.36 0.35 2.05 0.77 0.02 0.00 0.00 175.30 178.86 2jk0 h SER 84 N 2.76 0.32 -0.63 0.23 0.02 -1.90 -3.21 113.55 111.14 2jk0 h SER 84 Ca -0.47 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2jk0 h SER 84 Cb 1.17 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.64 2jk0 h SER 84 CO 0.69 0.22 0.00 -0.90 -1.14 0.00 0.00 176.83 175.70 2jk0 n ASP 85 N -4.48 3.78 -4.28 3.07 5.75 -1.26 -4.80 116.55 114.32 2jk0 n ASP 85 Ca 0.04 -2.05 -0.34 0.00 -0.01 0.00 0.00 54.79 52.43 2jk0 n ASP 85 Cb 0.18 -0.44 -0.15 0.00 -1.03 0.00 0.00 41.12 39.69 2jk0 n ASP 85 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2jk0 s VAL 86 N -1.09 3.01 -0.10 2.12 1.01 -1.22 -4.70 120.40 119.43 2jk0 s VAL 86 Ca 0.43 -0.63 0.21 0.00 0.00 0.00 0.00 61.98 61.98 2jk0 s VAL 86 Cb 0.23 -2.32 -0.26 0.00 0.00 0.00 0.00 36.38 34.03 2jk0 s VAL 86 CO 0.28 0.47 0.49 0.47 0.00 0.00 0.00 175.10 176.82 2jk0 n ASP 87 N 4.43 0.19 -3.63 3.32 8.00 -0.18 -4.77 116.55 123.90 2jk0 n ASP 87 Ca -0.19 0.08 -0.02 0.00 0.71 0.00 0.00 54.79 55.37 2jk0 n ASP 87 Cb 0.51 1.42 -0.02 0.00 -0.02 0.00 0.00 41.12 43.01 2jk0 n ASP 87 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2jk0 s GLY 88 N -4.73 -0.25 -0.07 0.44 0.00 -1.17 -4.25 107.32 97.28 2jk0 s GLY 88 Ca -0.07 1.74 0.02 0.00 0.00 0.00 0.00 44.72 46.41 2jk0 s GLY 88 CO 0.87 0.57 -0.12 0.14 0.00 0.00 0.00 173.10 174.56 2jk0 s VAL 89 N -2.12 1.13 -0.19 1.40 1.01 -0.38 -1.90 120.40 119.35 2jk0 s VAL 89 Ca 0.12 -0.47 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 2jk0 s VAL 89 Cb -0.00 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 2jk0 s VAL 89 CO -0.03 0.36 -0.02 -0.69 0.00 0.00 0.00 175.10 174.72 2jk0 s VAL 90 N 0.73 3.81 -0.35 2.92 1.01 0.30 -0.62 120.40 128.20 2jk0 s VAL 90 Ca -0.13 -0.36 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 2jk0 s VAL 90 Cb -0.16 -2.71 0.03 0.00 0.00 0.00 0.00 36.38 33.55 2jk0 s VAL 90 CO 0.03 0.44 0.14 -0.63 0.00 0.00 0.00 175.10 175.08 2jk0 s ILE 91 N 0.93 4.05 0.16 2.22 1.01 0.28 0.63 121.20 130.48 2jk0 s ILE 91 Ca 0.01 -1.01 -0.29 0.00 0.00 0.00 0.00 60.65 59.35 2jk0 s ILE 91 Cb -0.14 -3.27 -0.07 0.00 0.01 0.00 0.00 42.46 38.99 2jk0 s ILE 91 CO 0.01 -0.18 0.92 0.42 0.00 0.00 0.00 174.94 176.12 2jk0 s THR 92 N 1.46 4.35 -0.05 2.92 -4.23 -0.22 -0.77 115.64 119.09 2jk0 s THR 92 Ca -0.00 2.02 -0.30 0.00 -1.18 0.00 0.00 61.69 62.23 2jk0 s THR 92 Cb -0.19 -4.30 0.09 0.00 1.34 0.00 0.00 72.50 69.44 2jk0 s THR 92 CO 0.04 0.40 0.78 -2.28 -0.54 0.00 0.00 174.62 173.02 2jk0 s HIS 93 N -0.53 -0.53 0.91 3.99 5.04 -0.95 -1.23 115.29 121.99 2jk0 s HIS 93 Ca 0.43 0.80 -0.12 0.00 -1.54 0.00 0.00 55.06 54.63 2jk0 s HIS 93 Cb -0.24 0.45 0.14 0.00 0.04 0.00 0.00 32.58 32.97 2jk0 s HIS 93 CO 0.30 -0.56 1.10 0.20 -2.34 0.00 0.00 174.74 173.45 2jk0 s GLY 94 N -1.49 1.59 0.00 1.59 0.00 -1.26 -4.24 107.32 103.52 2jk0 s GLY 94 Ca -0.05 -0.30 0.14 0.00 0.00 0.00 0.00 44.72 44.51 2jk0 s GLY 94 CO 0.03 0.23 0.75 -0.91 0.00 0.00 0.00 173.10 173.20 2jk0 h THR 95 N -1.54 0.73 0.00 0.90 1.35 -1.96 -3.29 112.91 109.09 2jk0 h THR 95 Ca -0.51 -2.43 0.00 0.00 -0.55 0.00 0.00 66.41 62.92 2jk0 h THR 95 Cb 1.31 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 70.00 2jk0 h THR 95 CO 0.58 0.41 0.00 0.44 -0.25 0.00 0.00 175.52 176.71 2jk0 h ASP 96 N 0.00 0.00 0.00 5.36 3.32 -1.94 -2.12 116.42 121.03 2jk0 h ASP 96 Ca -0.23 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 2jk0 h ASP 96 Cb 1.84 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.37 2jk0 h ASP 96 CO 0.07 0.00 -0.40 0.41 -1.72 0.00 0.00 179.24 177.59 2jk0 n THR 97 N -2.30 0.47 0.32 0.35 -1.04 -1.26 -4.74 114.28 106.08 2jk0 n THR 97 Ca 0.00 -0.61 0.04 0.00 -2.04 0.00 0.00 64.05 61.44 2jk0 n THR 97 Cb 0.14 0.34 0.18 0.00 -1.82 0.00 0.00 70.33 69.17 2jk0 n THR 97 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2jk0 n LEU 98 N -0.33 0.00 -0.20 -4.42 4.77 -0.80 -1.80 117.00 114.22 2jk0 n LEU 98 Ca 0.04 0.37 -0.09 0.00 -0.03 0.00 0.00 56.01 56.30 2jk0 n LEU 98 Cb 0.70 -0.37 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 2jk0 n LEU 98 CO 0.00 -0.27 0.82 0.44 -1.33 0.00 0.00 177.39 177.05 2jk0 h ASP 99 N 0.00 0.98 0.00 -1.43 5.19 -1.85 -3.39 116.42 115.92 2jk0 h ASP 99 Ca 0.00 -0.30 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 2jk0 h ASP 99 Cb 0.09 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.34 2jk0 h ASP 99 CO 0.00 1.04 -0.45 -0.62 -3.12 0.00 0.00 179.24 176.09 2jk0 n GLU 100 N -4.24 0.35 -0.29 3.56 4.71 -0.74 -4.35 120.64 119.63 2jk0 n GLU 100 Ca 0.02 0.40 -0.00 0.00 -0.01 0.00 0.00 57.16 57.57 2jk0 n GLU 100 Cb 0.33 -1.40 0.06 0.00 -1.01 0.00 0.00 31.44 29.42 2jk0 n GLU 100 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2jk0 h SER 101 N -0.74 -1.04 -0.62 1.62 0.02 -1.72 -0.58 113.55 110.49 2jk0 h SER 101 Ca 0.00 0.26 -0.09 0.00 -0.84 0.00 0.00 61.79 61.12 2jk0 h SER 101 Cb 0.45 0.59 -0.02 0.00 0.14 0.00 0.00 62.40 63.56 2jk0 h SER 101 CO 0.00 -0.29 0.04 -0.65 -1.14 0.00 0.00 176.83 174.79 2jk0 h PRO 102 N -0.05 1.08 -0.66 3.45 0.11 -1.82 -2.19 132.00 131.92 2jk0 h PRO 102 Ca 0.34 -0.32 0.01 0.00 0.11 0.00 0.00 66.00 66.14 2jk0 h PRO 102 Cb 0.59 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 2jk0 h PRO 102 CO -0.84 1.03 0.44 -0.92 -0.21 0.00 0.00 178.00 177.50 2jk0 h TYR 103 N 0.99 0.83 0.01 0.65 3.20 -1.31 0.16 116.97 121.51 2jk0 h TYR 103 Ca 0.18 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.10 2jk0 h TYR 103 Cb 0.51 -0.28 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 2jk0 h TYR 103 CO 0.04 0.53 -0.50 0.35 -1.64 0.00 0.00 178.16 176.93 2jk0 h PHE 104 N 0.90 -1.47 -0.55 -3.82 3.57 -0.90 -1.00 116.94 113.67 2jk0 h PHE 104 Ca 0.24 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.83 2jk0 h PHE 104 Cb -0.11 0.64 -0.03 0.00 2.79 0.00 0.00 35.95 39.24 2jk0 h PHE 104 CO -0.03 -0.56 0.37 -0.07 -2.23 0.00 0.00 178.31 175.79 2jk0 h LEU 105 N -0.66 0.51 -1.90 0.59 3.38 -0.99 -1.82 115.31 114.41 2jk0 h LEU 105 Ca 0.02 -0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.17 2jk0 h LEU 105 Cb 0.71 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 2jk0 h LEU 105 CO -0.34 0.34 0.47 -1.13 0.09 0.00 0.00 178.44 177.87 2jk0 h ASN 106 N 0.58 0.09 0.19 -0.43 -1.24 0.66 0.24 115.58 115.66 2jk0 h ASN 106 Ca 0.23 0.01 -0.23 0.00 0.71 0.00 0.00 56.30 57.02 2jk0 h ASN 106 Cb 0.18 -0.01 -0.04 0.00 0.73 0.00 0.00 38.32 39.17 2jk0 h ASN 106 CO -0.06 0.04 -2.03 0.18 -1.29 0.00 0.00 177.43 174.27 2jk0 n LEU 107 N -4.38 0.24 -0.05 0.34 4.77 -0.73 -0.18 117.00 117.01 2jk0 n LEU 107 Ca 0.13 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2jk0 n LEU 107 Cb 0.68 0.26 -0.16 0.00 -2.33 0.00 0.00 43.42 41.86 2jk0 n LEU 107 CO 0.36 0.28 -0.94 1.07 -1.33 0.00 0.00 177.39 176.84 2jk0 n THR 108 N -2.67 0.75 -2.16 -5.08 5.66 -0.85 -4.12 114.28 105.81 2jk0 n THR 108 Ca -0.19 -0.69 -0.34 0.00 -3.05 0.00 0.00 64.05 59.78 2jk0 n THR 108 Cb 0.93 -0.26 0.01 0.00 -1.55 0.00 0.00 70.33 69.45 2jk0 n THR 108 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2jk0 s VAL 109 N -2.98 3.47 0.00 1.08 1.01 0.78 -4.70 120.40 119.06 2jk0 s VAL 109 Ca -0.09 0.81 0.08 0.00 0.00 0.00 0.00 61.98 62.78 2jk0 s VAL 109 Cb 0.10 -3.30 0.13 0.00 0.00 0.00 0.00 36.38 33.30 2jk0 s VAL 109 CO 0.87 -0.30 0.97 2.29 0.00 0.00 0.00 175.10 178.92 2jk0 n LYS 110 N -1.65 0.00 -4.16 2.72 2.85 -1.26 -3.92 118.16 112.75 2jk0 n LYS 110 Ca 0.10 -1.14 -0.23 0.00 -1.05 0.00 0.00 58.31 56.00 2jk0 n LYS 110 Cb 0.52 -0.14 -0.06 0.00 -0.65 0.00 0.00 35.03 34.70 2jk0 n LYS 110 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2jk0 s SER 111 N -1.14 4.90 0.00 -5.58 0.15 -1.26 -4.52 113.70 106.25 2jk0 s SER 111 Ca 0.10 -0.56 0.27 0.00 0.70 0.00 0.00 55.95 56.46 2jk0 s SER 111 Cb 0.12 -0.98 0.86 0.00 -1.71 0.00 0.00 66.02 64.31 2jk0 s SER 111 CO -0.05 -0.11 1.65 0.47 1.20 0.00 0.00 173.24 176.39 2jk0 n ASP 112 N -1.08 0.41 -4.75 5.45 8.00 -1.26 -4.27 116.55 119.05 2jk0 n ASP 112 Ca -0.06 -0.17 -0.41 0.00 0.71 0.00 0.00 54.79 54.86 2jk0 n ASP 112 Cb 0.59 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.65 2jk0 n ASP 112 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2jk0 s LYS 113 N -2.86 4.24 0.19 -1.24 1.02 -1.26 -0.16 119.74 119.68 2jk0 s LYS 113 Ca 0.16 2.35 -0.32 0.00 0.02 0.00 0.00 55.97 58.19 2jk0 s LYS 113 Cb 0.19 -3.08 -0.11 0.00 -0.52 0.00 0.00 37.83 34.31 2jk0 s LYS 113 CO 0.60 -0.43 1.63 -2.14 -0.92 0.00 0.00 175.35 174.09 2jk0 s PRO 114 N -0.72 4.17 -0.28 -1.68 0.02 -1.26 -4.85 135.00 130.40 2jk0 s PRO 114 Ca 0.58 2.47 -0.02 0.00 0.02 0.00 0.00 61.00 64.06 2jk0 s PRO 114 Cb -0.43 -3.11 0.04 0.00 0.02 0.00 0.00 34.50 31.02 2jk0 s PRO 114 CO 0.47 -0.66 -0.02 0.08 -0.33 0.00 0.00 177.00 176.54 2jk0 s VAL 115 N 1.07 2.97 -0.28 3.83 1.01 -1.26 -1.25 120.40 126.48 2jk0 s VAL 115 Ca 0.71 -1.27 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2jk0 s VAL 115 Cb -0.46 -2.65 0.07 0.00 0.00 0.00 0.00 36.38 33.33 2jk0 s VAL 115 CO 0.33 -0.02 -0.05 -0.69 0.00 0.00 0.00 175.10 174.67 2jk0 s VAL 116 N 1.28 2.38 0.38 2.92 1.01 0.21 -0.77 120.40 127.81 2jk0 s VAL 116 Ca -0.04 -1.71 -0.25 0.00 0.00 0.00 0.00 61.98 59.99 2jk0 s VAL 116 Cb -0.19 -2.46 -0.09 0.00 0.00 0.00 0.00 36.38 33.64 2jk0 s VAL 116 CO -0.02 -0.15 1.06 -0.36 0.00 0.00 0.00 175.10 175.63 2jk0 s PHE 117 N 1.10 3.31 0.01 5.22 0.40 0.40 -0.55 117.98 127.87 2jk0 s PHE 117 Ca -0.05 1.65 -0.06 0.00 -0.60 0.00 0.00 56.93 57.87 2jk0 s PHE 117 Cb -0.20 -3.16 -0.00 0.00 0.51 0.00 0.00 43.02 40.17 2jk0 s PHE 117 CO -0.05 -0.63 0.11 0.54 0.70 0.00 0.00 175.22 175.89 2jk0 s VAL 118 N -1.57 0.09 0.33 -0.44 0.11 0.05 -1.19 120.40 117.78 2jk0 s VAL 118 Ca 0.56 -0.76 -0.11 0.00 -2.93 0.00 0.00 61.98 58.73 2jk0 s VAL 118 Cb -0.24 -0.45 0.02 0.00 -1.53 0.00 0.00 36.38 34.18 2jk0 s VAL 118 CO 0.30 -0.42 0.61 0.00 -3.33 0.00 0.00 175.10 172.26 2jk0 s ALA 119 N -1.51 -0.18 -0.04 1.54 0.00 -1.26 -2.23 121.76 118.08 2jk0 s ALA 119 Ca -0.14 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 50.81 2jk0 s ALA 119 Cb -0.07 0.94 0.02 0.00 0.00 0.00 0.00 23.12 24.01 2jk0 s ALA 119 CO 0.01 -0.90 0.10 0.00 0.00 0.00 0.00 175.76 174.96 2jk0 s ALA 120 N -3.13 -0.20 -0.13 0.00 0.00 -1.26 -4.74 121.76 112.29 2jk0 s ALA 120 Ca 0.21 0.34 0.15 0.00 0.00 0.00 0.00 51.96 52.66 2jk0 s ALA 120 Cb -0.03 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.89 2jk0 s ALA 120 CO 0.13 -0.07 1.33 0.52 0.00 0.00 0.00 175.76 177.67 2jk0 h MET 121 N 6.36 0.00 -6.03 0.00 2.86 -1.91 -3.35 114.93 112.86 2jk0 h MET 121 Ca -0.30 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.67 2jk0 h MET 121 Cb 1.18 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.72 2jk0 h MET 121 CO 0.45 0.51 -0.60 1.03 1.06 0.00 0.00 176.91 179.35 2jk0 s ARG 122 N -2.93 2.97 0.64 1.72 0.52 -1.26 -5.03 118.95 115.58 2jk0 s ARG 122 Ca 0.03 -0.49 -0.15 0.00 -0.52 0.00 0.00 55.73 54.60 2jk0 s ARG 122 Cb 0.08 -2.80 -0.01 0.00 0.52 0.00 0.00 34.95 32.74 2jk0 s ARG 122 CO 0.76 0.66 1.09 -1.25 0.02 0.00 0.00 175.30 176.58 2jk0 s PRO 123 N -1.43 2.98 0.60 3.54 0.04 -1.26 -4.44 135.00 135.04 2jk0 s PRO 123 Ca 0.19 1.29 0.28 0.00 0.04 0.00 0.00 61.00 62.79 2jk0 s PRO 123 Cb -0.12 -1.98 1.36 0.00 0.04 0.00 0.00 34.50 33.80 2jk0 s PRO 123 CO 0.09 -1.09 1.77 0.00 0.04 0.00 0.00 177.00 177.81 2jk0 h ALA 124 N 0.10 2.21 0.00 8.56 0.00 -1.69 0.24 119.26 128.68 2jk0 h ALA 124 Ca -0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2jk0 h ALA 124 Cb 1.23 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2jk0 h ALA 124 CO 0.55 -0.87 -0.69 1.79 0.00 0.00 0.00 179.25 180.04 2jk0 h THR 125 N 0.00 0.00 -3.98 0.00 1.35 -1.91 -3.44 112.91 104.93 2jk0 h THR 125 Ca 0.23 -0.74 -0.53 0.00 -0.55 0.00 0.00 66.41 64.82 2jk0 h THR 125 Cb 1.46 1.35 0.10 0.00 -1.73 0.00 0.00 68.15 69.32 2jk0 h THR 125 CO -0.00 0.00 0.62 0.00 -0.25 0.00 0.00 175.52 175.88 2jk0 s ALA 126 N -3.25 3.15 0.03 6.62 0.00 0.07 -4.88 121.76 123.51 2jk0 s ALA 126 Ca 0.04 1.27 -0.37 0.00 0.00 0.00 0.00 51.96 52.89 2jk0 s ALA 126 Cb 0.11 -3.51 -0.17 0.00 0.00 0.00 0.00 23.12 19.55 2jk0 s ALA 126 CO 0.74 -0.98 1.40 0.44 0.00 0.00 0.00 175.76 177.37 2jk0 n ILE 127 N -0.20 0.05 -3.70 0.00 -5.35 -1.26 -1.61 119.36 107.28 2jk0 n ILE 127 Ca 0.05 -0.01 -0.25 0.00 -0.27 0.00 0.00 62.75 62.27 2jk0 n ILE 127 Cb 0.44 -0.89 0.06 0.00 -1.74 0.00 0.00 39.64 37.51 2jk0 n ILE 127 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2jk0 n SER 128 N 2.96 -4.85 -4.68 7.28 7.64 -1.26 -4.92 113.62 115.80 2jk0 n SER 128 Ca 0.20 -0.66 -0.44 0.00 1.01 0.00 0.00 58.87 58.97 2jk0 n SER 128 Cb 0.18 -4.54 -0.02 0.00 -1.01 0.00 0.00 64.21 58.82 2jk0 n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jk0 n ALA 129 N -4.73 1.18 0.31 -0.43 0.00 -0.63 -4.91 120.51 111.29 2jk0 n ALA 129 Ca -0.04 0.40 0.12 0.00 0.00 0.00 0.00 53.44 53.92 2jk0 n ALA 129 Cb 0.57 -2.27 0.09 0.00 0.00 0.00 0.00 19.45 17.84 2jk0 n ALA 129 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2jk0 h ASP 130 N 3.87 0.00 -0.28 0.00 2.03 -1.87 -3.40 116.42 116.76 2jk0 h ASP 130 Ca -0.45 -0.09 0.03 0.00 -0.73 0.00 0.00 57.03 55.79 2jk0 h ASP 130 Cb 1.28 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.73 2jk0 h ASP 130 CO 0.73 0.04 -0.30 1.23 -1.03 0.00 0.00 179.24 179.92 2jk0 h GLY 131 N 4.21 -1.52 -0.52 7.15 0.00 -1.85 -0.41 103.07 110.13 2jk0 h GLY 131 Ca 0.00 0.82 0.07 0.00 0.00 0.00 0.00 47.33 48.21 2jk0 h GLY 131 CO 0.00 -0.43 -0.53 -2.55 0.00 0.00 0.00 176.54 173.03 2jk0 h PRO 132 N -0.17 -0.29 -0.43 4.80 0.11 -1.93 0.27 132.00 134.37 2jk0 h PRO 132 Ca 0.05 0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.19 2jk0 h PRO 132 Cb 0.29 0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.44 2jk0 h PRO 132 CO -0.35 -0.19 0.26 1.98 -0.21 0.00 0.00 178.00 179.49 2jk0 h MET 133 N -0.30 0.52 -0.46 1.05 1.85 -1.78 -0.62 114.93 115.20 2jk0 h MET 133 Ca 0.11 -0.03 0.05 0.00 -0.61 0.00 0.00 59.70 59.22 2jk0 h MET 133 Cb 0.56 -0.12 -0.04 0.00 0.43 0.00 0.00 31.60 32.43 2jk0 h MET 133 CO -0.67 0.34 0.21 -0.91 -0.40 0.00 0.00 176.91 175.48 2jk0 h ASN 134 N 0.54 0.27 -1.00 1.39 2.35 -0.08 -1.15 115.58 117.90 2jk0 h ASN 134 Ca 0.17 0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.97 2jk0 h ASN 134 Cb -0.02 -0.01 -0.05 0.00 0.05 0.00 0.00 38.32 38.29 2jk0 h ASN 134 CO -0.06 0.20 0.66 0.25 -1.65 0.00 0.00 177.43 176.82 2jk0 h LEU 135 N 0.41 1.12 0.27 1.61 5.85 -0.02 0.37 115.31 124.92 2jk0 h LEU 135 Ca 0.21 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2jk0 h LEU 135 Cb 0.15 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 2jk0 h LEU 135 CO -0.17 0.79 -0.23 0.22 -0.34 0.00 0.00 178.44 178.71 2jk0 h TYR 136 N 1.31 -0.62 -0.47 1.25 3.20 -0.71 -2.46 116.97 118.47 2jk0 h TYR 136 Ca 0.38 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.31 2jk0 h TYR 136 Cb -0.08 0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.38 2jk0 h TYR 136 CO -0.00 -0.35 0.20 0.78 -1.64 0.00 0.00 178.16 177.15 2jk0 h GLY 137 N -0.52 0.64 0.80 1.82 0.00 -0.62 -1.37 103.07 103.81 2jk0 h GLY 137 Ca -0.01 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.24 2jk0 h GLY 137 CO -0.03 0.05 0.39 0.00 0.00 0.00 0.00 176.54 176.95 2jk0 h ALA 138 N 1.29 0.87 -0.34 3.60 0.00 -0.86 0.87 119.26 124.69 2jk0 h ALA 138 Ca 0.22 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 2jk0 h ALA 138 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2jk0 h ALA 138 CO -0.19 0.12 -0.32 0.28 0.00 0.00 0.00 179.25 179.14 2jk0 h VAL 139 N 0.76 1.29 -0.01 0.00 2.07 -1.04 0.44 116.25 119.75 2jk0 h VAL 139 Ca 0.28 -1.49 0.01 0.00 0.82 0.00 0.00 66.70 66.32 2jk0 h VAL 139 Cb 0.08 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2jk0 h VAL 139 CO -0.13 0.49 -0.04 0.50 0.02 0.00 0.00 177.57 178.41 2jk0 h LYS 140 N 0.59 -0.06 -0.10 1.57 3.64 -0.66 0.29 116.57 121.85 2jk0 h LYS 140 Ca 0.06 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 2jk0 h LYS 140 Cb 0.90 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.68 2jk0 h LYS 140 CO 0.08 -0.04 -0.23 0.28 -2.27 0.00 0.00 179.45 177.27 2jk0 h VAL 141 N -0.06 0.44 -0.73 2.00 2.07 -0.74 -2.19 116.25 117.05 2jk0 h VAL 141 Ca 0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 2jk0 h VAL 141 Cb 0.08 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 2jk0 h VAL 141 CO -0.05 0.00 0.41 0.00 0.02 0.00 0.00 177.57 177.96 2jk0 h ALA 142 N 0.62 1.36 0.00 1.67 0.00 -0.26 -1.97 119.26 120.68 2jk0 h ALA 142 Ca 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jk0 h ALA 142 Cb 0.44 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2jk0 h ALA 142 CO -0.28 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.51 2jk0 n ALA 143 N -2.43 2.49 -2.66 0.00 0.00 0.96 -4.70 120.51 114.18 2jk0 n ALA 143 Ca 0.07 -0.16 -0.40 0.00 0.00 0.00 0.00 53.44 52.95 2jk0 n ALA 143 Cb 0.09 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.02 2jk0 n ALA 143 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jk0 s ASP 144 N -2.15 6.65 0.38 0.00 -1.08 -0.74 -4.89 116.67 114.84 2jk0 s ASP 144 Ca 0.38 0.79 0.09 0.00 -0.52 0.00 0.00 52.55 53.29 2jk0 s ASP 144 Cb 0.19 -2.33 0.85 0.00 -1.46 0.00 0.00 42.92 40.17 2jk0 s ASP 144 CO 0.35 -0.25 1.92 0.11 0.52 0.00 0.00 175.17 177.82 2jk0 h LYS 145 N 7.49 0.62 0.00 4.34 1.57 -1.87 -1.12 116.57 127.60 2jk0 h LYS 145 Ca -0.32 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2jk0 h LYS 145 Cb 1.15 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2jk0 h LYS 145 CO 0.76 0.41 0.00 -1.71 -0.57 0.00 0.00 179.45 178.34 2jk0 n ASN 146 N -4.51 0.65 0.20 0.86 5.15 -1.26 -2.36 115.26 114.00 2jk0 n ASN 146 Ca 0.14 0.70 0.09 0.00 -0.60 0.00 0.00 54.58 54.90 2jk0 n ASN 146 Cb 0.38 -0.82 0.31 0.00 -0.53 0.00 0.00 39.78 39.12 2jk0 n ASN 146 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2jk0 h SER 147 N 0.00 0.00 -2.67 1.20 0.02 -1.46 -3.48 113.55 107.17 2jk0 h SER 147 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 2jk0 h SER 147 Cb 0.26 0.00 0.13 0.00 0.14 0.00 0.00 62.40 62.93 2jk0 h SER 147 CO 0.00 0.24 -0.06 0.54 -1.14 0.00 0.00 176.83 176.41 2jk0 n ARG 148 N -3.26 1.02 -2.20 3.45 1.74 -0.99 -3.44 116.66 112.97 2jk0 n ARG 148 Ca 0.01 0.37 -0.14 0.00 -0.77 0.00 0.00 57.85 57.32 2jk0 n ARG 148 Cb 0.52 -1.80 -0.01 0.00 -1.02 0.00 0.00 32.46 30.15 2jk0 n ARG 148 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jk0 n GLY 149 N 1.42 -0.09 0.64 -0.13 0.00 0.77 -4.87 105.19 102.94 2jk0 n GLY 149 Ca 0.11 -0.29 0.06 0.00 0.00 0.00 0.00 46.02 45.90 2jk0 n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jk0 n ARG 150 N -2.39 1.93 0.00 1.61 1.74 -1.22 -5.05 116.66 113.28 2jk0 n ARG 150 Ca -0.17 -1.75 0.00 0.00 -0.77 0.00 0.00 57.85 55.16 2jk0 n ARG 150 Cb 0.62 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 2jk0 n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jk0 n GLY 151 N 0.70 -0.80 3.76 -0.13 0.00 -1.26 -4.62 105.19 102.84 2jk0 n GLY 151 Ca 0.11 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 2jk0 n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jk0 s VAL 152 N -1.97 2.58 0.24 1.61 1.01 -1.26 -4.72 120.40 117.90 2jk0 s VAL 152 Ca 0.00 0.47 0.11 0.00 0.00 0.00 0.00 61.98 62.56 2jk0 s VAL 152 Cb 0.00 -3.26 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2jk0 s VAL 152 CO 0.00 0.03 -0.20 -0.76 0.00 0.00 0.00 175.10 174.17 2jk0 s LEU 153 N -2.92 2.54 -0.22 3.92 1.43 0.05 -2.73 118.68 120.75 2jk0 s LEU 153 Ca 0.63 -0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2jk0 s LEU 153 Cb -0.36 -1.05 0.06 0.00 0.03 0.00 0.00 46.19 44.88 2jk0 s LEU 153 CO 0.45 0.03 0.01 -0.69 0.23 0.00 0.00 176.35 176.38 2jk0 s VAL 154 N -2.32 0.91 -0.23 -1.59 1.01 0.48 -0.45 120.40 118.21 2jk0 s VAL 154 Ca 0.26 -0.89 -0.08 0.00 0.00 0.00 0.00 61.98 61.27 2jk0 s VAL 154 Cb -0.05 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 2jk0 s VAL 154 CO 0.12 -0.23 0.07 -0.69 0.00 0.00 0.00 175.10 174.37 2jk0 s VAL 155 N 1.67 4.52 0.00 2.92 1.01 -0.33 -0.08 120.40 130.12 2jk0 s VAL 155 Ca -0.01 -0.11 -0.23 0.00 0.00 0.00 0.00 61.98 61.63 2jk0 s VAL 155 Cb -0.18 -3.09 0.05 0.00 0.00 0.00 0.00 36.38 33.16 2jk0 s VAL 155 CO -0.09 0.37 0.51 -0.76 0.00 0.00 0.00 175.10 175.12 2jk0 s LEU 156 N 1.23 0.01 -1.38 3.92 1.02 -1.03 -4.00 118.68 118.45 2jk0 s LEU 156 Ca 0.05 0.30 -0.10 0.00 0.02 0.00 0.00 54.13 54.39 2jk0 s LEU 156 Cb -0.14 2.01 0.07 0.00 0.02 0.00 0.00 46.19 48.15 2jk0 s LEU 156 CO 0.04 -0.62 0.59 -3.20 0.02 0.00 0.00 176.35 173.18 2jk0 n ASN 157 N 0.77 -4.09 -0.11 2.29 5.15 -1.26 -1.44 115.26 116.56 2jk0 n ASN 157 Ca -0.19 -0.48 -0.01 0.00 -0.60 0.00 0.00 54.58 53.30 2jk0 n ASN 157 Cb 0.58 -3.35 -0.01 0.00 -0.53 0.00 0.00 39.78 36.47 2jk0 n ASN 157 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2jk0 n ASP 158 N -2.41 -3.59 -4.48 1.20 8.00 -1.26 -5.02 116.55 108.99 2jk0 n ASP 158 Ca -0.01 0.04 -0.30 0.00 0.71 0.00 0.00 54.79 55.23 2jk0 n ASP 158 Cb 0.54 -1.22 -0.12 0.00 -0.02 0.00 0.00 41.12 40.31 2jk0 n ASP 158 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2jk0 s ARG 159 N -1.08 1.89 -0.40 -1.24 1.81 -0.52 -0.96 118.95 118.44 2jk0 s ARG 159 Ca 0.00 -1.11 -0.10 0.00 -1.72 0.00 0.00 55.73 52.80 2jk0 s ARG 159 Cb 0.00 -2.15 0.06 0.00 -0.45 0.00 0.00 34.95 32.41 2jk0 s ARG 159 CO 0.00 0.50 0.23 0.42 -0.68 0.00 0.00 175.30 175.77 2jk0 s ILE 160 N -1.08 4.32 0.12 1.52 1.01 -0.92 -2.47 121.20 123.70 2jk0 s ILE 160 Ca 0.17 -1.21 -0.02 0.00 0.00 0.00 0.00 60.65 59.60 2jk0 s ILE 160 Cb -0.11 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 2jk0 s ILE 160 CO 0.09 -0.40 0.31 -0.83 0.00 0.00 0.00 174.94 174.11 2jk0 s GLY 161 N 1.90 2.09 0.18 6.18 0.00 0.89 -1.15 107.32 117.40 2jk0 s GLY 161 Ca 0.02 -0.76 -0.25 0.00 0.00 0.00 0.00 44.72 43.74 2jk0 s GLY 161 CO 0.04 -0.71 0.78 -0.45 0.00 0.00 0.00 173.10 172.76 2jk0 s SER 162 N -2.67 7.37 0.49 1.64 0.15 -1.26 -0.39 113.70 119.04 2jk0 s SER 162 Ca 0.38 1.65 0.27 0.00 0.70 0.00 0.00 55.95 58.94 2jk0 s SER 162 Cb -0.12 -2.50 1.25 0.00 -1.71 0.00 0.00 66.02 62.94 2jk0 s SER 162 CO 0.27 0.19 1.98 0.00 1.20 0.00 0.00 173.24 176.87 2jk0 h ALA 163 N 4.21 1.16 -0.00 5.45 0.00 -1.86 -0.33 119.26 127.90 2jk0 h ALA 163 Ca -0.47 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.19 2jk0 h ALA 163 Cb 1.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2jk0 h ALA 163 CO 0.66 0.20 -0.51 -0.09 0.00 0.00 0.00 179.25 179.51 2jk0 h ARG 164 N 0.00 0.01 0.00 0.00 9.65 -1.92 -3.36 114.38 118.76 2jk0 h ARG 164 Ca -0.00 -0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.68 2jk0 h ARG 164 Cb 0.50 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.05 2jk0 h ARG 164 CO 0.02 0.51 -1.64 1.19 2.80 0.00 0.00 179.97 182.86 2jk0 n PHE 165 N -3.93 0.00 -2.15 2.20 0.99 -0.63 -4.94 117.46 109.01 2jk0 n PHE 165 Ca -0.01 0.00 -0.38 0.00 -0.00 0.00 0.00 57.45 57.05 2jk0 n PHE 165 Cb 0.52 -0.41 -0.00 0.00 -1.00 0.00 0.00 39.48 38.59 2jk0 n PHE 165 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.76 175.26 2jk0 s ILE 166 N -2.21 2.85 0.21 4.37 2.07 -0.23 -4.72 121.20 123.53 2jk0 s ILE 166 Ca -0.16 0.68 -0.20 0.00 -1.41 0.00 0.00 60.65 59.57 2jk0 s ILE 166 Cb 0.06 -3.37 0.04 0.00 0.13 0.00 0.00 42.46 39.32 2jk0 s ILE 166 CO 0.20 0.04 0.59 -0.94 -1.91 0.00 0.00 174.94 172.92 2jk0 s SER 167 N -1.09 -0.33 -0.34 4.50 1.04 -1.16 -4.83 113.70 111.48 2jk0 s SER 167 Ca 0.61 -0.40 -0.29 0.00 0.48 0.00 0.00 55.95 56.36 2jk0 s SER 167 Cb -0.33 0.62 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 2jk0 s SER 167 CO 0.41 -1.11 1.63 -0.75 0.98 0.00 0.00 173.24 174.41 2jk0 s LYS 168 N -3.86 3.48 0.01 4.02 2.20 -1.26 -2.74 119.74 121.60 2jk0 s LYS 168 Ca 0.08 1.28 0.22 0.00 -0.36 0.00 0.00 55.97 57.19 2jk0 s LYS 168 Cb -0.02 -4.11 -0.20 0.00 -1.51 0.00 0.00 37.83 31.99 2jk0 s LYS 168 CO -0.03 -1.67 0.75 0.25 -0.36 0.00 0.00 175.35 174.29 2jk0 n THR 169 N 7.17 0.08 -4.49 3.43 -2.24 -0.42 -4.91 114.28 112.90 2jk0 n THR 169 Ca 0.20 -0.32 -0.20 0.00 -2.27 0.00 0.00 64.05 61.46 2jk0 n THR 169 Cb 0.47 0.27 -0.15 0.00 -2.10 0.00 0.00 70.33 68.83 2jk0 n THR 169 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2jk0 s ASN 170 N -4.06 1.35 0.28 3.42 3.84 -1.26 -5.06 114.94 113.45 2jk0 s ASN 170 Ca -0.01 -0.22 0.01 0.00 0.21 0.00 0.00 52.86 52.85 2jk0 s ASN 170 Cb 0.14 -0.15 0.53 0.00 -0.55 0.00 0.00 41.25 41.23 2jk0 s ASN 170 CO 0.87 0.13 1.83 0.00 -2.79 0.00 0.00 177.10 177.14 2jk0 h ALA 171 N 5.81 1.47 0.00 1.71 0.00 -1.97 -3.40 119.26 122.88 2jk0 h ALA 171 Ca -0.33 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2jk0 h ALA 171 Cb 1.17 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2jk0 h ALA 171 CO 0.49 0.19 0.00 0.43 0.00 0.00 0.00 179.25 180.36 2jk0 n SER 172 N -4.65 0.00 -4.98 0.00 7.64 -1.26 -5.09 113.62 105.28 2jk0 n SER 172 Ca 0.18 -1.00 -0.20 0.00 1.01 0.00 0.00 58.87 58.87 2jk0 n SER 172 Cb 0.35 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2jk0 n SER 172 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2jk0 s THR 173 N 0.00 4.12 0.20 0.44 -4.23 -1.26 -5.02 115.64 109.89 2jk0 s THR 173 Ca 0.00 -0.91 0.14 0.00 -1.18 0.00 0.00 61.69 59.74 2jk0 s THR 173 Cb 0.00 -3.44 0.02 0.00 1.34 0.00 0.00 72.50 70.42 2jk0 s THR 173 CO 0.00 -0.20 1.62 -0.07 -0.54 0.00 0.00 174.62 175.44 2jk0 h LEU 174 N 0.82 0.00 -2.46 4.79 3.38 -1.97 -3.11 115.31 116.76 2jk0 h LEU 174 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2jk0 h LEU 174 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2jk0 h LEU 174 CO 0.54 0.55 0.00 -0.90 0.09 0.00 0.00 178.44 178.72 2jk0 n ASP 175 N -3.64 3.72 -0.40 -0.43 5.75 -1.26 -4.59 116.55 115.70 2jk0 n ASP 175 Ca -0.01 -2.34 0.32 0.00 -0.01 0.00 0.00 54.79 52.76 2jk0 n ASP 175 Cb 0.61 -0.50 0.60 0.00 -1.03 0.00 0.00 41.12 40.80 2jk0 n ASP 175 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 2jk0 h THR 176 N 3.11 0.22 -2.70 2.12 2.02 -1.85 -3.40 112.91 112.43 2jk0 h THR 176 Ca 0.00 -0.06 -0.59 0.00 0.77 0.00 0.00 66.41 66.53 2jk0 h THR 176 Cb 1.16 0.04 -0.11 0.00 -1.74 0.00 0.00 68.15 67.49 2jk0 h THR 176 CO 0.18 0.03 0.76 -0.36 0.37 0.00 0.00 175.52 176.50 2jk0 s PHE 177 N -5.38 2.56 0.05 3.16 0.40 -1.26 -1.30 117.98 116.21 2jk0 s PHE 177 Ca -0.08 -0.20 0.01 0.00 -0.60 0.00 0.00 56.93 56.06 2jk0 s PHE 177 Cb 0.29 -4.39 -0.03 0.00 0.51 0.00 0.00 43.02 39.40 2jk0 s PHE 177 CO 0.81 -1.74 -0.06 0.15 0.70 0.00 0.00 175.22 175.08 2jk0 s LYS 178 N 4.68 0.58 -0.38 0.44 1.02 -1.11 -4.89 119.74 120.08 2jk0 s LYS 178 Ca 0.30 -0.93 0.01 0.00 0.02 0.00 0.00 55.97 55.36 2jk0 s LYS 178 Cb -0.12 -0.15 0.13 0.00 -0.52 0.00 0.00 37.83 37.17 2jk0 s LYS 178 CO 0.15 -0.00 0.20 0.00 -0.92 0.00 0.00 175.35 174.78 2jk0 s ALA 179 N -2.24 1.58 0.25 5.17 0.00 -1.26 -2.99 121.76 122.28 2jk0 s ALA 179 Ca -0.04 -2.14 -0.04 0.00 0.00 0.00 0.00 51.96 49.75 2jk0 s ALA 179 Cb -0.04 -1.73 0.44 0.00 0.00 0.00 0.00 23.12 21.79 2jk0 s ALA 179 CO -0.02 -2.00 1.77 -1.00 0.00 0.00 0.00 175.76 174.51 2jk0 h PRO 180 N 7.12 0.61 0.00 0.00 0.13 -1.94 1.09 132.00 139.02 2jk0 h PRO 180 Ca -0.02 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 64.96 2jk0 h PRO 180 Cb 0.96 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 2jk0 h PRO 180 CO 0.41 0.40 -0.57 0.93 -0.23 0.00 0.00 178.00 178.94 2jk0 h GLU 181 N 0.63 0.00 -0.00 0.86 4.39 -1.98 -3.35 114.58 115.13 2jk0 h GLU 181 Ca 0.41 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.11 2jk0 h GLU 181 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2jk0 h GLU 181 CO -0.32 0.57 -0.14 0.39 -1.16 0.00 0.00 179.01 178.35 2jk0 n GLU 182 N -3.39 4.29 0.00 2.33 4.71 -0.41 -5.11 120.64 123.06 2jk0 n GLU 182 Ca 0.01 -0.18 0.00 0.00 -0.01 0.00 0.00 57.16 56.98 2jk0 n GLU 182 Cb 0.70 -0.78 0.00 0.00 -1.01 0.00 0.00 31.44 30.35 2jk0 n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2jk0 n GLY 183 N 0.89 0.93 3.79 0.62 0.00 0.36 -4.81 105.19 106.98 2jk0 n GLY 183 Ca 0.01 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 2jk0 n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jk0 s TYR 184 N 0.00 3.04 0.01 1.61 1.51 -1.26 -4.43 117.35 117.83 2jk0 s TYR 184 Ca 0.00 -0.13 -0.21 0.00 -1.01 0.00 0.00 57.07 55.72 2jk0 s TYR 184 Cb 0.00 -1.37 -0.20 0.00 -0.11 0.00 0.00 41.96 40.29 2jk0 s TYR 184 CO 0.00 0.54 1.18 -0.07 -1.11 0.00 0.00 175.55 176.09 2jk0 h LEU 185 N 1.57 0.42 0.00 -1.29 3.38 -1.38 -3.37 115.31 114.63 2jk0 h LEU 185 Ca -0.48 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 56.84 2jk0 h LEU 185 Cb 1.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2jk0 h LEU 185 CO 0.61 1.01 0.00 0.61 0.09 0.00 0.00 178.44 180.75 2jk0 n GLY 186 N 0.72 3.20 3.54 0.83 0.00 -1.08 0.10 105.19 112.51 2jk0 n GLY 186 Ca -0.08 -1.11 -0.17 0.00 0.00 0.00 0.00 46.02 44.66 2jk0 n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jk0 s VAL 187 N -2.50 0.00 -0.29 1.61 1.01 -0.29 -2.16 120.40 117.79 2jk0 s VAL 187 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.97 2jk0 s VAL 187 Cb 0.00 -0.99 0.05 0.00 0.00 0.00 0.00 36.38 35.44 2jk0 s VAL 187 CO 0.00 -0.00 -0.03 -0.63 0.00 0.00 0.00 175.10 174.43 2jk0 s ILE 188 N -0.83 2.70 -0.04 2.22 1.01 -0.13 -0.64 121.20 125.48 2jk0 s ILE 188 Ca -0.09 -1.50 0.02 0.00 0.00 0.00 0.00 60.65 59.08 2jk0 s ILE 188 Cb -0.01 -2.57 0.01 0.00 0.01 0.00 0.00 42.46 39.90 2jk0 s ILE 188 CO 0.08 -0.10 -0.08 -0.63 0.00 0.00 0.00 174.94 174.22 2jk0 s ILE 189 N 1.19 0.72 -1.58 2.92 -1.09 -0.29 -4.79 121.20 118.29 2jk0 s ILE 189 Ca -0.06 -0.28 -0.10 0.00 -2.23 0.00 0.00 60.65 57.97 2jk0 s ILE 189 Cb -0.20 -0.68 0.09 0.00 -1.58 0.00 0.00 42.46 40.09 2jk0 s ILE 189 CO -0.03 0.25 0.59 0.61 -1.23 0.00 0.00 174.94 175.13 2jk0 n GLY 190 N 3.61 -0.34 2.36 6.18 0.00 -1.26 -2.11 105.19 113.64 2jk0 n GLY 190 Ca -0.21 0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 2jk0 n GLY 190 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jk0 n ASP 191 N -2.80 -4.48 -3.96 1.61 2.03 -1.26 -5.01 116.55 102.68 2jk0 n ASP 191 Ca -0.10 -0.06 -0.08 0.00 0.52 0.00 0.00 54.79 55.06 2jk0 n ASP 191 Cb 0.58 -3.56 -0.09 0.00 -0.72 0.00 0.00 41.12 37.33 2jk0 n ASP 191 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2jk0 s LYS 192 N -4.87 0.67 -0.14 -0.67 -0.14 -0.90 -5.15 119.74 108.55 2jk0 s LYS 192 Ca 0.05 -0.97 -0.03 0.00 -1.36 0.00 0.00 55.97 53.66 2jk0 s LYS 192 Cb -0.02 0.26 -0.03 0.00 -1.68 0.00 0.00 37.83 36.36 2jk0 s LYS 192 CO 0.06 -0.17 -0.04 0.42 -0.76 0.00 0.00 175.35 174.86 2jk0 s ILE 193 N -3.44 3.88 -0.28 2.17 1.01 -1.26 -1.14 121.20 122.14 2jk0 s ILE 193 Ca 0.02 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.31 2jk0 s ILE 193 Cb 0.04 -2.67 0.08 0.00 0.01 0.00 0.00 42.46 39.91 2jk0 s ILE 193 CO -0.08 0.52 -0.02 -0.31 0.00 0.00 0.00 174.94 175.05 2jk0 s TYR 194 N 0.09 2.79 0.12 3.97 1.51 0.18 -4.98 117.35 121.03 2jk0 s TYR 194 Ca -0.01 -2.16 -0.21 0.00 -1.01 0.00 0.00 57.07 53.69 2jk0 s TYR 194 Cb -0.14 -1.99 -0.07 0.00 -0.11 0.00 0.00 41.96 39.65 2jk0 s TYR 194 CO 0.03 -0.85 0.64 0.71 -1.11 0.00 0.00 175.55 174.97 2jk0 s TYR 195 N 1.25 3.82 0.00 2.71 1.51 -1.26 -1.14 117.35 124.25 2jk0 s TYR 195 Ca -0.00 1.38 0.00 0.00 -1.01 0.00 0.00 57.07 57.44 2jk0 s TYR 195 Cb -0.19 -2.58 0.00 0.00 -0.11 0.00 0.00 41.96 39.08 2jk0 s TYR 195 CO -0.09 0.54 0.00 1.04 -1.11 0.00 0.00 175.55 175.93 2jk0 n GLN 196 N 1.56 0.00 -4.21 -0.62 6.02 0.12 -4.97 117.38 115.28 2jk0 n GLN 196 Ca -0.08 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.78 2jk0 n GLN 196 Cb 0.50 -0.58 -0.10 0.00 1.02 0.00 0.00 30.24 31.08 2jk0 n GLN 196 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2jk0 s THR 197 N -1.64 0.97 -0.04 5.09 -4.23 -0.66 -5.05 115.64 110.07 2jk0 s THR 197 Ca 0.00 -1.99 0.05 0.00 -1.18 0.00 0.00 61.69 58.57 2jk0 s THR 197 Cb 0.00 -1.75 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 2jk0 s THR 197 CO 0.00 -0.79 -0.18 -0.13 -0.54 0.00 0.00 174.62 172.99 2jk0 s ARG 198 N -3.72 1.77 -0.26 3.99 0.52 -1.26 -4.59 118.95 115.40 2jk0 s ARG 198 Ca 0.14 -0.63 -0.33 0.00 -0.52 0.00 0.00 55.73 54.39 2jk0 s ARG 198 Cb 0.03 -1.56 -0.09 0.00 0.52 0.00 0.00 34.95 33.85 2jk0 s ARG 198 CO -0.02 0.27 2.15 -0.11 0.02 0.00 0.00 175.30 177.62 2jk0 n LEU 199 N 3.05 2.74 -2.88 2.53 0.00 -1.26 -4.85 117.00 116.34 2jk0 n LEU 199 Ca -0.18 0.44 -0.32 0.00 0.00 0.00 0.00 56.01 55.96 2jk0 n LEU 199 Cb 0.53 -1.38 -0.04 0.00 0.00 0.00 0.00 43.42 42.53 2jk0 n LEU 199 CO 0.25 -0.60 1.94 -0.67 0.00 0.00 0.00 177.39 178.30 2jk0 n ASP 200 N 9.92 7.08 -4.02 1.96 -0.08 -1.26 -4.88 116.55 125.27 2jk0 n ASP 200 Ca 0.34 -3.14 -0.08 0.00 -1.51 0.00 0.00 54.79 50.40 2jk0 n ASP 200 Cb 0.31 -1.30 -0.09 0.00 2.34 0.00 0.00 41.12 42.39 2jk0 n ASP 200 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2jk0 s LYS 201 N -1.34 0.65 0.16 -0.67 -0.14 -1.26 -5.06 119.74 112.08 2jk0 s LYS 201 Ca 0.57 -1.11 -0.31 0.00 -1.36 0.00 0.00 55.97 53.76 2jk0 s LYS 201 Cb 0.30 0.24 -0.09 0.00 -1.68 0.00 0.00 37.83 36.59 2jk0 s LYS 201 CO -0.16 -0.15 1.49 0.08 -0.76 0.00 0.00 175.35 175.85 2jk0 s VAL 202 N -3.75 2.85 0.15 3.17 1.01 -0.76 -4.99 120.40 118.09 2jk0 s VAL 202 Ca 0.05 0.62 -0.13 0.00 0.00 0.00 0.00 61.98 62.52 2jk0 s VAL 202 Cb 0.06 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 33.06 2jk0 s VAL 202 CO -0.10 0.06 0.38 -1.38 0.00 0.00 0.00 175.10 174.06 2jk0 s HIS 203 N 0.96 0.05 0.00 5.22 -3.43 -1.26 -4.68 115.29 112.15 2jk0 s HIS 203 Ca 0.67 -0.40 0.00 0.00 -0.80 0.00 0.00 55.06 54.53 2jk0 s HIS 203 Cb -0.41 0.17 0.00 0.00 -1.43 0.00 0.00 32.58 30.91 2jk0 s HIS 203 CO 0.33 -0.76 0.00 0.25 -2.00 0.00 0.00 174.74 172.56 2jk0 n THR 204 N -0.24 0.00 -0.24 -5.38 -2.24 0.75 -1.61 114.28 105.32 2jk0 n THR 204 Ca -0.11 0.00 0.29 0.00 -2.27 0.00 0.00 64.05 61.95 2jk0 n THR 204 Cb 0.63 0.00 0.69 0.00 -2.10 0.00 0.00 70.33 69.54 2jk0 n THR 204 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2jk0 h THR 205 N 0.00 0.52 -0.00 4.28 1.35 -1.74 0.19 112.91 117.51 2jk0 h THR 205 Ca 0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 2jk0 h THR 205 Cb 0.00 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 66.85 2jk0 h THR 205 CO 0.00 0.02 -0.35 0.54 -0.25 0.00 0.00 175.52 175.47 2jk0 n ARG 206 N -4.31 0.34 -2.42 4.72 1.74 -0.64 -4.93 116.66 111.17 2jk0 n ARG 206 Ca 0.21 -0.19 -0.41 0.00 -0.77 0.00 0.00 57.85 56.70 2jk0 n ARG 206 Cb 1.00 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.91 2jk0 n ARG 206 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2jk0 s SER 207 N -2.79 7.18 0.16 0.55 0.15 0.66 -4.80 113.70 114.82 2jk0 s SER 207 Ca 0.17 2.30 0.26 0.00 0.70 0.00 0.00 55.95 59.38 2jk0 s SER 207 Cb 0.18 -2.62 0.69 0.00 -1.71 0.00 0.00 66.02 62.56 2jk0 s SER 207 CO 0.61 -0.24 1.64 1.33 1.20 0.00 0.00 173.24 177.78 2jk0 n VAL 208 N 1.51 0.45 -2.48 4.45 0.24 -1.26 -4.75 118.33 116.48 2jk0 n VAL 208 Ca 0.00 -0.25 -0.43 0.00 -2.04 0.00 0.00 64.34 61.63 2jk0 n VAL 208 Cb 0.44 -0.41 -0.02 0.00 -1.47 0.00 0.00 33.84 32.39 2jk0 n VAL 208 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2jk0 s PHE 209 N -3.11 2.61 -0.06 6.34 0.40 -1.26 -4.99 117.98 117.91 2jk0 s PHE 209 Ca 0.10 0.70 0.04 0.00 -0.60 0.00 0.00 56.93 57.16 2jk0 s PHE 209 Cb 0.13 -4.37 -0.02 0.00 0.51 0.00 0.00 43.02 39.27 2jk0 s PHE 209 CO 0.63 -1.62 -0.17 0.34 0.70 0.00 0.00 175.22 175.10 2jk0 s ASP 210 N 3.17 3.74 0.00 1.36 -1.08 -1.26 -4.15 116.67 118.46 2jk0 s ASP 210 Ca 0.54 -0.31 0.07 0.00 -0.52 0.00 0.00 52.55 52.33 2jk0 s ASP 210 Cb -0.10 -0.95 0.16 0.00 -1.46 0.00 0.00 42.92 40.56 2jk0 s ASP 210 CO 0.32 0.29 1.06 1.33 0.52 0.00 0.00 175.17 178.69 2jk0 n VAL 211 N 2.70 0.78 -0.30 1.11 0.24 -1.26 -4.74 118.33 116.86 2jk0 n VAL 211 Ca -0.17 -0.89 0.10 0.00 -2.04 0.00 0.00 64.34 61.34 2jk0 n VAL 211 Cb 0.52 0.64 0.24 0.00 -1.47 0.00 0.00 33.84 33.77 2jk0 n VAL 211 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2jk0 h THR 212 N 1.29 0.21 -1.11 3.34 2.02 -1.95 -1.99 112.91 114.71 2jk0 h THR 212 Ca 0.00 -0.03 -0.64 0.00 0.77 0.00 0.00 66.41 66.51 2jk0 h THR 212 Cb 0.57 0.11 -0.34 0.00 -1.74 0.00 0.00 68.15 66.74 2jk0 h THR 212 CO 0.00 0.02 0.20 0.59 0.37 0.00 0.00 175.52 176.70 2jk0 n ASN 213 N -5.38 6.50 -4.14 4.18 3.02 -1.26 -4.93 115.26 113.26 2jk0 n ASN 213 Ca 0.19 -3.78 -0.31 0.00 -0.03 0.00 0.00 54.58 50.65 2jk0 n ASN 213 Cb 0.63 -0.74 -0.17 0.00 -0.61 0.00 0.00 39.78 38.89 2jk0 n ASN 213 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2jk0 s VAL 214 N -4.86 1.84 -0.18 2.41 1.01 -0.75 -5.02 120.40 114.85 2jk0 s VAL 214 Ca 0.57 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.73 2jk0 s VAL 214 Cb 0.46 -1.64 -0.22 0.00 0.00 0.00 0.00 36.38 34.98 2jk0 s VAL 214 CO -0.07 0.51 0.11 0.47 0.00 0.00 0.00 175.10 176.12 2jk0 n ASP 215 N 4.02 1.54 -3.80 3.32 8.00 -1.26 -4.94 116.55 123.43 2jk0 n ASP 215 Ca -0.20 0.06 -0.16 0.00 0.71 0.00 0.00 54.79 55.20 2jk0 n ASP 215 Cb 0.52 -0.25 -0.16 0.00 -0.02 0.00 0.00 41.12 41.20 2jk0 n ASP 215 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2jk0 s LYS 216 N -2.54 0.19 0.44 -1.24 2.20 -1.26 -4.99 119.74 112.54 2jk0 s LYS 216 Ca -0.23 0.12 -0.17 0.00 -0.36 0.00 0.00 55.97 55.33 2jk0 s LYS 216 Cb 0.08 -0.41 -0.09 0.00 -1.51 0.00 0.00 37.83 35.90 2jk0 s LYS 216 CO 0.72 -0.15 0.90 -0.51 -0.36 0.00 0.00 175.35 175.95 2jk0 s LEU 217 N 1.07 3.83 0.73 5.43 1.43 -1.26 -5.04 118.68 124.87 2jk0 s LEU 217 Ca -0.09 1.50 -0.15 0.00 -1.03 0.00 0.00 54.13 54.36 2jk0 s LEU 217 Cb -0.13 -4.38 0.04 0.00 0.03 0.00 0.00 46.19 41.75 2jk0 s LEU 217 CO -0.02 -0.42 1.23 -2.84 0.23 0.00 0.00 176.35 174.53 2jk0 s PRO 218 N -3.57 2.07 0.03 1.29 0.02 -1.26 -4.99 135.00 128.59 2jk0 s PRO 218 Ca 0.58 1.86 -0.24 0.00 0.02 0.00 0.00 61.00 63.22 2jk0 s PRO 218 Cb -0.10 -1.81 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2jk0 s PRO 218 CO 0.23 -1.92 0.72 0.00 -0.33 0.00 0.00 177.00 175.70 2jk0 s ALA 219 N -1.86 3.40 -0.03 -1.55 0.00 -1.26 -4.92 121.76 115.53 2jk0 s ALA 219 Ca 0.77 0.21 -0.01 0.00 0.00 0.00 0.00 51.96 52.93 2jk0 s ALA 219 Cb -0.32 -2.93 0.03 0.00 0.00 0.00 0.00 23.12 19.90 2jk0 s ALA 219 CO 0.46 0.08 0.04 0.08 0.00 0.00 0.00 175.76 176.41 2jk0 s VAL 220 N -0.04 -0.05 0.11 0.00 1.01 -1.26 -0.78 120.40 119.40 2jk0 s VAL 220 Ca 0.37 0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.65 2jk0 s VAL 220 Cb -0.20 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 36.01 2jk0 s VAL 220 CO 0.21 0.13 0.17 -1.81 0.00 0.00 0.00 175.10 173.80 2jk0 s ASP 221 N 1.49 5.91 -0.21 3.32 1.01 -0.41 -4.93 116.67 122.83 2jk0 s ASP 221 Ca -0.04 0.07 -0.04 0.00 0.71 0.00 0.00 52.55 53.25 2jk0 s ASP 221 Cb -0.13 -1.68 -0.01 0.00 1.01 0.00 0.00 42.92 42.11 2jk0 s ASP 221 CO -0.03 0.12 -0.03 -0.63 0.21 0.00 0.00 175.17 174.81 2jk0 s ILE 222 N -1.58 3.53 -0.12 0.77 1.01 -1.26 0.70 121.20 124.25 2jk0 s ILE 222 Ca 0.32 -0.44 -0.00 0.00 0.00 0.00 0.00 60.65 60.53 2jk0 s ILE 222 Cb -0.12 -2.60 -0.02 0.00 0.01 0.00 0.00 42.46 39.73 2jk0 s ILE 222 CO 0.25 0.42 -0.12 -0.63 0.00 0.00 0.00 174.94 174.87 2jk0 s ILE 223 N 1.33 3.18 0.19 2.92 1.01 -0.14 -4.98 121.20 124.71 2jk0 s ILE 223 Ca 0.04 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.82 2jk0 s ILE 223 Cb -0.14 -2.33 -0.08 0.00 0.01 0.00 0.00 42.46 39.91 2jk0 s ILE 223 CO -0.01 0.53 0.79 -0.47 0.00 0.00 0.00 174.94 175.78 2jk0 s TYR 224 N 0.19 3.87 -0.11 3.97 5.04 -1.26 -0.67 117.35 128.37 2jk0 s TYR 224 Ca -0.07 1.63 -0.11 0.00 -2.44 0.00 0.00 57.07 56.08 2jk0 s TYR 224 Cb -0.15 -2.77 -0.05 0.00 0.35 0.00 0.00 41.96 39.35 2jk0 s TYR 224 CO 0.05 0.47 0.23 0.20 -1.34 0.00 0.00 175.55 175.16 2jk0 s GLY 225 N -1.24 2.23 -0.14 8.97 0.00 -0.55 -4.89 107.32 111.69 2jk0 s GLY 225 Ca 0.38 -0.51 -0.31 0.00 0.00 0.00 0.00 44.72 44.28 2jk0 s GLY 225 CO 0.26 -0.02 1.06 -2.52 0.00 0.00 0.00 173.10 171.87 2jk0 s TYR 226 N -0.55 -0.28 -0.11 1.90 -0.85 -1.26 -4.46 117.35 111.75 2jk0 s TYR 226 Ca 0.16 0.35 -0.41 0.00 -0.52 0.00 0.00 57.07 56.66 2jk0 s TYR 226 Cb -0.13 0.49 -0.20 0.00 0.38 0.00 0.00 41.96 42.50 2jk0 s TYR 226 CO 0.05 -0.33 1.23 1.04 -1.52 0.00 0.00 175.55 176.03 2jk0 n GLN 227 N 0.30 0.14 -1.39 -3.49 6.02 -1.26 -0.46 117.38 117.25 2jk0 n GLN 227 Ca -0.06 0.05 -0.13 0.00 -0.01 0.00 0.00 57.00 56.85 2jk0 n GLN 227 Cb 0.59 -1.57 -0.06 0.00 1.02 0.00 0.00 30.24 30.22 2jk0 n GLN 227 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2jk0 n ASP 228 N 2.25 -4.57 -4.68 1.08 8.00 -1.26 -4.95 116.55 112.43 2jk0 n ASP 228 Ca 0.22 0.32 -0.46 0.00 0.71 0.00 0.00 54.79 55.59 2jk0 n ASP 228 Cb 0.06 -3.23 -0.04 0.00 -0.02 0.00 0.00 41.12 37.89 2jk0 n ASP 228 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2jk0 n ASP 229 N -0.12 3.26 -4.72 -2.24 5.75 0.39 -4.90 116.55 113.98 2jk0 n ASP 229 Ca -0.13 1.07 -0.42 0.00 -0.01 0.00 0.00 54.79 55.30 2jk0 n ASP 229 Cb 0.43 -1.44 -0.03 0.00 -1.03 0.00 0.00 41.12 39.05 2jk0 n ASP 229 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 2jk0 s PRO 230 N 1.31 4.45 0.36 0.11 0.04 -1.26 -4.69 135.00 135.31 2jk0 s PRO 230 Ca 0.80 1.78 0.12 0.00 0.04 0.00 0.00 61.00 63.74 2jk0 s PRO 230 Cb -0.65 -3.33 0.67 0.00 0.04 0.00 0.00 34.50 31.22 2jk0 s PRO 230 CO 0.38 -0.22 1.79 1.49 0.04 0.00 0.00 177.00 180.49 2jk0 h GLU 231 N 6.54 0.00 -0.08 4.56 4.81 -1.91 -3.11 114.58 125.39 2jk0 h GLU 231 Ca -0.42 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 58.83 2jk0 h GLU 231 Cb 1.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 2jk0 h GLU 231 CO 0.80 0.41 0.23 0.10 -0.73 0.00 0.00 179.01 179.82 2jk0 h TYR 232 N 0.00 0.00 -0.27 0.92 -0.00 -1.92 -1.26 116.97 114.44 2jk0 h TYR 232 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.70 2jk0 h TYR 232 Cb 0.72 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.44 2jk0 h TYR 232 CO 0.00 0.00 0.07 0.52 -0.00 0.00 0.00 178.16 178.75 2jk0 h MET 233 N 0.00 0.38 -0.21 0.10 2.86 -1.96 0.87 114.93 116.98 2jk0 h MET 233 Ca 0.04 -0.05 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 2jk0 h MET 233 Cb 0.50 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 2jk0 h MET 233 CO -0.00 0.35 -0.33 1.88 1.06 0.00 0.00 176.91 179.87 2jk0 h TYR 234 N 0.38 0.74 -0.95 -0.22 -1.99 -1.46 -2.44 116.97 111.03 2jk0 h TYR 234 Ca 0.09 -0.25 0.12 0.00 2.00 0.00 0.00 58.73 60.69 2jk0 h TYR 234 Cb 0.14 -0.14 -0.08 0.00 2.00 0.00 0.00 36.73 38.65 2jk0 h TYR 234 CO 0.00 0.99 0.61 -0.44 -0.00 0.00 0.00 178.16 179.32 2jk0 h ASP 235 N 0.28 0.83 0.18 3.88 3.45 -1.22 0.80 116.42 124.61 2jk0 h ASP 235 Ca 0.02 0.04 -0.01 0.00 0.43 0.00 0.00 57.03 57.51 2jk0 h ASP 235 Cb 0.92 -0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.57 2jk0 h ASP 235 CO 0.08 0.44 -0.09 0.00 -1.57 0.00 0.00 179.24 178.10 2jk0 h ALA 236 N 1.56 -0.24 -0.62 3.45 0.00 -0.85 -0.95 119.26 121.61 2jk0 h ALA 236 Ca 0.47 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.30 2jk0 h ALA 236 Cb 0.54 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2jk0 h ALA 236 CO -0.23 -0.45 0.42 0.77 0.00 0.00 0.00 179.25 179.76 2jk0 h SER 237 N -0.61 0.36 -0.09 0.00 0.02 -1.03 -2.00 113.55 110.20 2jk0 h SER 237 Ca -0.02 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 2jk0 h SER 237 Cb 0.45 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 2jk0 h SER 237 CO 0.04 0.21 -0.05 0.40 -1.14 0.00 0.00 176.83 176.30 2jk0 h ILE 238 N 0.40 1.33 -1.00 3.27 2.04 -0.73 -2.96 117.51 119.85 2jk0 h ILE 238 Ca 0.29 -1.08 0.13 0.00 1.00 0.00 0.00 64.86 65.20 2jk0 h ILE 238 Cb 0.61 1.86 -0.09 0.00 -0.74 0.00 0.00 36.82 38.46 2jk0 h ILE 238 CO -0.08 0.30 0.63 0.50 0.00 0.00 0.00 178.15 179.50 2jk0 h LYS 239 N -0.18 0.93 -0.47 2.37 3.64 -0.41 -0.21 116.57 122.24 2jk0 h LYS 239 Ca 0.02 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2jk0 h LYS 239 Cb 0.50 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2jk0 h LYS 239 CO 0.01 0.61 0.00 0.72 -2.27 0.00 0.00 179.45 178.53 2jk0 n HIS 240 N -4.64 0.59 -3.84 1.91 8.25 -1.08 -4.93 115.22 111.48 2jk0 n HIS 240 Ca 0.20 -0.25 -0.24 0.00 -0.26 0.00 0.00 57.72 57.17 2jk0 n HIS 240 Cb 0.39 -0.08 0.01 0.00 1.12 0.00 0.00 29.99 31.43 2jk0 n HIS 240 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jk0 n GLY 241 N 0.82 -0.27 3.74 -1.41 0.00 -0.09 -4.95 105.19 103.03 2jk0 n GLY 241 Ca 0.12 0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 2jk0 n GLY 241 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jk0 s VAL 242 N -3.77 2.22 -0.08 1.61 1.01 -1.12 -4.93 120.40 115.34 2jk0 s VAL 242 Ca 0.06 0.14 0.14 0.00 0.00 0.00 0.00 61.98 62.32 2jk0 s VAL 242 Cb -0.03 -3.06 -0.18 0.00 0.00 0.00 0.00 36.38 33.11 2jk0 s VAL 242 CO 0.85 -0.03 0.78 0.11 0.00 0.00 0.00 175.10 176.81 2jk0 h LYS 243 N 0.70 0.00 -3.24 2.72 1.57 -1.32 -3.45 116.57 113.55 2jk0 h LYS 243 Ca -0.51 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.13 2jk0 h LYS 243 Cb 1.32 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.42 2jk0 h LYS 243 CO 0.54 0.42 -0.39 0.20 -0.57 0.00 0.00 179.45 179.65 2jk0 s GLY 244 N -4.94 -0.08 -0.06 3.86 0.00 -1.05 -2.26 107.32 102.79 2jk0 s GLY 244 Ca -0.03 0.23 0.04 0.00 0.00 0.00 0.00 44.72 44.95 2jk0 s GLY 244 CO 0.82 0.07 -0.18 -0.42 0.00 0.00 0.00 173.10 173.39 2jk0 s ILE 245 N -1.04 1.50 -0.16 0.90 1.01 -0.36 -1.29 121.20 121.76 2jk0 s ILE 245 Ca -0.11 -0.74 -0.07 0.00 0.00 0.00 0.00 60.65 59.73 2jk0 s ILE 245 Cb -0.05 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 2jk0 s ILE 245 CO 0.02 0.43 0.08 -0.69 0.00 0.00 0.00 174.94 174.78 2jk0 s VAL 246 N 0.18 4.93 -0.29 2.92 1.01 0.22 -1.12 120.40 128.25 2jk0 s VAL 246 Ca -0.08 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 2jk0 s VAL 246 Cb -0.13 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 2jk0 s VAL 246 CO 0.03 0.51 0.12 -0.47 0.00 0.00 0.00 175.10 175.29 2jk0 s TYR 247 N -0.06 3.15 -1.28 5.22 5.04 0.15 -0.96 117.35 128.61 2jk0 s TYR 247 Ca 0.07 -0.52 -0.13 0.00 -2.44 0.00 0.00 57.07 54.05 2jk0 s TYR 247 Cb -0.12 -2.31 0.14 0.00 0.35 0.00 0.00 41.96 40.03 2jk0 s TYR 247 CO 0.01 -0.42 1.73 0.00 -1.34 0.00 0.00 175.55 175.53 2jk0 n ALA 248 N 4.96 4.60 -1.20 3.97 0.00 0.16 0.91 120.51 133.90 2jk0 n ALA 248 Ca -0.15 -4.19 -0.32 0.00 0.00 0.00 0.00 53.44 48.79 2jk0 n ALA 248 Cb 0.50 -3.14 0.10 0.00 0.00 0.00 0.00 19.45 16.90 2jk0 n ALA 248 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jk0 s GLY 249 N 2.26 1.86 0.17 0.00 0.00 0.40 -1.48 107.32 110.53 2jk0 s GLY 249 Ca 0.43 0.47 -0.30 0.00 0.00 0.00 0.00 44.72 45.32 2jk0 s GLY 249 CO 0.00 0.84 1.33 1.06 0.00 0.00 0.00 173.10 176.34 2jk0 s MET 250 N -4.56 4.37 4.15 2.90 -1.94 -1.22 -0.18 119.30 122.82 2jk0 s MET 250 Ca 0.65 2.06 0.00 0.00 -1.71 0.00 0.00 55.69 56.69 2jk0 s MET 250 Cb -0.21 -3.21 0.00 0.00 2.01 0.00 0.00 34.83 33.42 2jk0 s MET 250 CO 0.52 -0.31 0.00 0.41 -0.01 0.00 0.00 175.02 175.63 2jk0 n GLY 251 N 2.71 2.56 2.24 -0.03 0.00 -1.26 -0.44 105.19 110.96 2jk0 n GLY 251 Ca 0.08 -0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 2jk0 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jk0 n ALA 252 N 8.12 5.52 -1.86 4.61 0.00 -1.26 -4.38 120.51 131.26 2jk0 n ALA 252 Ca 0.00 -1.89 -0.07 0.00 0.00 0.00 0.00 53.44 51.48 2jk0 n ALA 252 Cb 0.00 -2.62 -0.01 0.00 0.00 0.00 0.00 19.45 16.82 2jk0 n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jk0 n GLY 253 N 2.99 0.32 3.73 0.00 0.00 -1.16 -4.59 105.19 106.49 2jk0 n GLY 253 Ca 0.43 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2jk0 n GLY 253 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jk0 s SER 254 N -2.76 7.32 -0.09 1.61 0.01 0.42 -4.81 113.70 115.40 2jk0 s SER 254 Ca 0.00 2.01 -0.04 0.00 1.31 0.00 0.00 55.95 59.23 2jk0 s SER 254 Cb 0.00 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 2jk0 s SER 254 CO 0.00 -0.19 0.10 0.68 0.41 0.00 0.00 173.24 174.24 2jk0 s VAL 255 N -0.12 5.08 0.98 3.43 -7.23 -1.26 -3.44 120.40 117.84 2jk0 s VAL 255 Ca 0.49 -0.03 -0.14 0.00 -1.81 0.00 0.00 61.98 60.50 2jk0 s VAL 255 Cb -0.28 -3.22 0.18 0.00 0.56 0.00 0.00 36.38 33.62 2jk0 s VAL 255 CO 0.33 0.56 1.15 -0.94 -0.31 0.00 0.00 175.10 175.89 2jk0 s SER 256 N -1.16 2.90 0.20 4.85 1.04 -1.26 -4.71 113.70 115.55 2jk0 s SER 256 Ca 0.17 0.85 -0.12 0.00 0.48 0.00 0.00 55.95 57.33 2jk0 s SER 256 Cb -0.12 -1.32 0.24 0.00 0.10 0.00 0.00 66.02 64.92 2jk0 s SER 256 CO 0.06 -2.92 1.70 0.11 0.98 0.00 0.00 173.24 173.16 2jk0 h LYS 257 N -1.76 0.19 -0.65 4.02 1.79 -1.98 0.78 116.57 118.97 2jk0 h LYS 257 Ca -0.49 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 57.93 2jk0 h LYS 257 Cb 1.31 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.89 2jk0 h LYS 257 CO 0.54 0.12 0.26 0.00 -1.08 0.00 0.00 179.45 179.29 2jk0 h ARG 258 N 0.19 0.95 -0.12 3.15 -0.00 -1.93 -0.52 114.38 116.10 2jk0 h ARG 258 Ca 0.28 -0.16 -0.11 0.00 -0.50 0.00 0.00 59.98 59.50 2jk0 h ARG 258 Cb 0.42 -0.16 0.00 0.00 0.00 0.00 0.00 29.97 30.23 2jk0 h ARG 258 CO -0.41 0.78 -0.36 0.78 0.00 0.00 0.00 179.97 180.76 2jk0 h GLY 259 N 1.03 0.51 0.11 0.04 0.00 -1.64 -2.90 103.07 100.21 2jk0 h GLY 259 Ca 0.22 -0.65 0.07 0.00 0.00 0.00 0.00 47.33 46.97 2jk0 h GLY 259 CO -0.02 0.58 -0.21 -1.80 0.00 0.00 0.00 176.54 175.09 2jk0 h ASP 260 N 0.06 -0.69 -0.06 0.19 1.82 0.81 -1.19 116.42 117.35 2jk0 h ASP 260 Ca -0.01 0.14 -0.16 0.00 -0.39 0.00 0.00 57.03 56.61 2jk0 h ASP 260 Cb 0.98 0.35 -0.01 0.00 0.68 0.00 0.00 39.33 41.33 2jk0 h ASP 260 CO 0.08 -0.24 -0.51 0.00 -1.61 0.00 0.00 179.24 176.95 2jk0 h ALA 261 N 0.98 0.68 -0.11 -0.78 0.00 -1.20 -2.18 119.26 116.65 2jk0 h ALA 261 Ca 0.16 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 2jk0 h ALA 261 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2jk0 h ALA 261 CO -0.42 0.68 -0.66 0.78 0.00 0.00 0.00 179.25 179.63 2jk0 h GLY 262 N 0.99 0.49 0.77 0.00 0.00 -1.37 0.15 103.07 104.10 2jk0 h GLY 262 Ca 0.02 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 46.68 2jk0 h GLY 262 CO 0.10 0.57 -0.01 -2.22 0.00 0.00 0.00 176.54 174.98 2jk0 h ILE 263 N 0.32 1.26 -0.50 2.60 2.04 -1.21 -1.84 117.51 120.17 2jk0 h ILE 263 Ca -0.02 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 2jk0 h ILE 263 Cb 1.22 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 38.83 2jk0 h ILE 263 CO 0.12 0.25 0.27 0.03 0.00 0.00 0.00 178.15 178.82 2jk0 h ARG 264 N -0.02 0.69 0.48 2.37 3.08 -1.28 0.16 114.38 119.86 2jk0 h ARG 264 Ca 0.04 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2jk0 h ARG 264 Cb 0.39 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2jk0 h ARG 264 CO 0.01 0.51 -0.43 -0.22 -1.07 0.00 0.00 179.97 178.77 2jk0 h LYS 265 N 0.69 -0.88 -0.26 0.04 3.64 -0.59 -2.23 116.57 116.97 2jk0 h LYS 265 Ca 0.18 0.06 0.04 0.00 -1.27 0.00 0.00 60.65 59.66 2jk0 h LYS 265 Cb 0.03 0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 2jk0 h LYS 265 CO -0.03 -0.59 0.03 0.00 -2.27 0.00 0.00 179.45 176.59 2jk0 h ALA 266 N -0.63 0.25 -0.72 5.00 0.00 -0.38 -2.16 119.26 120.63 2jk0 h ALA 266 Ca -0.05 0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.05 2jk0 h ALA 266 Cb 0.79 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 2jk0 h ALA 266 CO -0.03 -0.39 0.48 0.93 0.00 0.00 0.00 179.25 180.24 2jk0 h GLU 267 N 0.12 0.44 0.00 0.00 5.08 -0.68 0.30 114.58 119.84 2jk0 h GLU 267 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2jk0 h GLU 267 Cb 0.14 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2jk0 h GLU 267 CO -0.18 0.29 0.00 0.66 -1.00 0.00 0.00 179.01 178.77 2jk0 h SER 268 N 0.45 0.00 -0.48 1.42 4.64 -0.75 -2.39 113.55 116.44 2jk0 h SER 268 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2jk0 h SER 268 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 2jk0 h SER 268 CO -0.11 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.14 2jk0 n LYS 269 N -3.07 2.58 -0.15 4.77 4.76 0.08 -4.94 118.16 122.20 2jk0 n LYS 269 Ca 0.02 -1.92 0.00 0.00 -2.87 0.00 0.00 58.31 53.54 2jk0 n LYS 269 Cb 0.36 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 2jk0 n LYS 269 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jk0 n GLY 270 N 1.07 1.57 3.71 0.72 0.00 -0.90 -5.02 105.19 106.34 2jk0 n GLY 270 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2jk0 n GLY 270 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jk0 s ILE 271 N -2.75 3.34 -0.18 -0.61 1.01 -1.16 -4.99 121.20 115.85 2jk0 s ILE 271 Ca 0.00 0.91 -0.25 0.00 0.00 0.00 0.00 60.65 61.31 2jk0 s ILE 271 Cb 0.00 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 2jk0 s ILE 271 CO 0.00 0.05 0.81 -0.69 0.00 0.00 0.00 174.94 175.11 2jk0 s VAL 272 N 1.53 4.89 -0.20 2.92 1.01 -0.96 -3.80 120.40 125.79 2jk0 s VAL 272 Ca 0.66 1.58 -0.03 0.00 0.00 0.00 0.00 61.98 64.18 2jk0 s VAL 272 Cb -0.36 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 31.89 2jk0 s VAL 272 CO 0.30 0.02 -0.05 -0.69 0.00 0.00 0.00 175.10 174.68 2jk0 s VAL 273 N 2.20 3.41 -0.14 2.92 1.01 -1.26 -1.23 120.40 127.32 2jk0 s VAL 273 Ca 0.37 -0.49 -0.09 0.00 0.00 0.00 0.00 61.98 61.77 2jk0 s VAL 273 Cb -0.16 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 2jk0 s VAL 273 CO 0.12 0.44 0.18 -0.69 0.00 0.00 0.00 175.10 175.14 2jk0 s VAL 274 N 1.24 5.42 -0.37 2.92 1.01 -0.28 0.12 120.40 130.46 2jk0 s VAL 274 Ca 0.03 0.30 -0.15 0.00 0.00 0.00 0.00 61.98 62.15 2jk0 s VAL 274 Cb -0.14 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.76 2jk0 s VAL 274 CO -0.01 0.54 0.37 -0.13 0.00 0.00 0.00 175.10 175.86 2jk0 s ARG 275 N -0.49 3.41 0.00 2.72 0.52 0.17 0.31 118.95 125.60 2jk0 s ARG 275 Ca 0.14 -0.56 0.00 0.00 -0.52 0.00 0.00 55.73 54.79 2jk0 s ARG 275 Cb -0.12 -3.86 0.00 0.00 0.52 0.00 0.00 34.95 31.49 2jk0 s ARG 275 CO 0.03 -0.61 0.00 0.45 0.02 0.00 0.00 175.30 175.19 2jk0 n SER 276 N 5.40 1.47 -4.26 0.23 2.88 0.26 -1.27 113.62 118.34 2jk0 n SER 276 Ca -0.09 -0.84 -0.27 0.00 -1.33 0.00 0.00 58.87 56.33 2jk0 n SER 276 Cb 0.49 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.80 2jk0 n SER 276 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jk0 s SER 277 N -0.77 2.60 0.00 -3.46 0.15 -1.26 -0.45 113.70 110.51 2jk0 s SER 277 Ca 0.00 -0.49 0.29 0.00 0.70 0.00 0.00 55.95 56.45 2jk0 s SER 277 Cb 0.00 -0.24 1.29 0.00 -1.71 0.00 0.00 66.02 65.36 2jk0 s SER 277 CO 0.00 0.21 1.90 -2.11 1.20 0.00 0.00 173.24 174.44 2jk0 n ARG 278 N 2.08 0.77 -0.09 5.44 1.85 0.75 -4.19 116.66 123.27 2jk0 n ARG 278 Ca -0.16 -0.25 -0.13 0.00 -1.00 0.00 0.00 57.85 56.30 2jk0 n ARG 278 Cb 0.53 -1.49 -0.04 0.00 -1.05 0.00 0.00 32.46 30.40 2jk0 n ARG 278 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 2jk0 h THR 279 N 0.61 1.30 0.00 8.89 1.35 -1.83 -3.48 112.91 119.74 2jk0 h THR 279 Ca 0.00 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.37 2jk0 h THR 279 Cb 0.33 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 2jk0 h THR 279 CO 0.00 0.48 0.00 0.61 -0.25 0.00 0.00 175.52 176.36 2jk0 n GLY 280 N 0.18 1.40 3.56 5.82 0.00 -1.26 -5.09 105.19 109.81 2jk0 n GLY 280 Ca -0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.01 2jk0 n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jk0 s SER 281 N -1.42 -0.00 0.00 1.61 1.04 -1.26 -5.00 113.70 108.66 2jk0 s SER 281 Ca 0.00 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.43 2jk0 s SER 281 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.12 2jk0 s SER 281 CO 0.00 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 174.83 2jk0 n GLY 282 N -0.44 0.88 3.71 7.32 0.00 -1.26 -4.98 105.19 110.42 2jk0 n GLY 282 Ca -0.08 -1.97 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 2jk0 n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jk0 s ILE 283 N -1.82 5.20 -0.35 -0.61 -1.09 -1.26 -4.12 121.20 117.15 2jk0 s ILE 283 Ca 0.00 0.85 -0.23 0.00 -2.23 0.00 0.00 60.65 59.04 2jk0 s ILE 283 Cb 0.00 -3.77 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2jk0 s ILE 283 CO 0.00 0.31 0.77 -0.69 -1.23 0.00 0.00 174.94 174.10 2jk0 s VAL 284 N 0.78 4.76 0.52 2.92 1.01 -0.69 -4.89 120.40 124.81 2jk0 s VAL 284 Ca 0.23 0.91 -0.06 0.00 0.00 0.00 0.00 61.98 63.06 2jk0 s VAL 284 Cb -0.15 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 2jk0 s VAL 284 CO 0.09 -0.39 0.84 -2.16 0.00 0.00 0.00 175.10 173.48 2jk0 s PRO 285 N 3.04 3.40 0.82 2.72 0.04 -1.26 -3.86 135.00 139.89 2jk0 s PRO 285 Ca 0.31 0.22 -0.12 0.00 0.04 0.00 0.00 61.00 61.44 2jk0 s PRO 285 Cb -0.13 -2.31 0.09 0.00 0.04 0.00 0.00 34.50 32.18 2jk0 s PRO 285 CO 0.16 -0.37 1.17 -2.14 0.04 0.00 0.00 177.00 175.86 2jk0 s PRO 286 N -4.86 1.65 -0.30 0.56 0.02 -1.26 -4.98 135.00 125.84 2jk0 s PRO 286 Ca 0.50 1.60 -0.07 0.00 0.02 0.00 0.00 61.00 63.04 2jk0 s PRO 286 Cb -0.10 -1.79 0.15 0.00 0.02 0.00 0.00 34.50 32.77 2jk0 s PRO 286 CO 0.46 -2.17 0.64 0.34 -0.33 0.00 0.00 177.00 175.94 2jk0 s ASP 287 N -2.48 -1.21 0.44 2.53 -1.08 -1.26 -5.02 116.67 108.59 2jk0 s ASP 287 Ca 0.69 1.35 0.28 0.00 -0.52 0.00 0.00 52.55 54.36 2jk0 s ASP 287 Cb -0.25 2.25 0.97 0.00 -1.46 0.00 0.00 42.92 44.43 2jk0 s ASP 287 CO 0.52 -0.23 1.82 0.00 0.52 0.00 0.00 175.17 177.80 2jk0 h ALA 288 N 7.99 1.00 0.00 3.66 0.00 -1.97 -3.01 119.26 126.94 2jk0 h ALA 288 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2jk0 h ALA 288 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2jk0 h ALA 288 CO 0.15 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.81 2jk0 n GLY 289 N 0.45 -1.37 3.29 0.00 0.00 -1.26 -4.80 105.19 101.51 2jk0 n GLY 289 Ca 0.02 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 2jk0 n GLY 289 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jk0 s GLN 290 N -2.84 1.13 0.00 1.61 -0.21 -1.14 -5.16 119.66 113.06 2jk0 s GLN 290 Ca 0.18 -1.21 0.00 0.00 0.02 0.00 0.00 55.36 54.36 2jk0 s GLN 290 Cb 0.18 -1.33 0.00 0.00 1.00 0.00 0.00 33.01 32.87 2jk0 s GLN 290 CO 0.48 0.30 0.00 -0.35 -2.12 0.00 0.00 175.29 173.60 2jk0 n PRO 291 N 0.91 1.02 -1.45 2.91 -0.04 -1.26 -4.85 135.00 132.23 2jk0 n PRO 291 Ca -0.18 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.46 2jk0 n PRO 291 Cb 0.54 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.92 2jk0 n PRO 291 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jk0 n GLY 292 N 4.17 -3.07 2.33 0.55 0.00 -1.26 -4.92 105.19 102.98 2jk0 n GLY 292 Ca 0.00 -1.02 -0.16 0.00 0.00 0.00 0.00 46.02 44.85 2jk0 n GLY 292 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jk0 n LEU 293 N -4.34 0.00 -4.14 0.99 4.77 0.32 -4.85 117.00 109.75 2jk0 n LEU 293 Ca -0.08 -1.10 -0.22 0.00 -0.03 0.00 0.00 56.01 54.59 2jk0 n LEU 293 Cb 0.69 -0.49 -0.14 0.00 -2.33 0.00 0.00 43.42 41.14 2jk0 n LEU 293 CO 0.04 -0.92 -0.47 -0.69 -1.33 0.00 0.00 177.39 174.01 2jk0 s VAL 294 N -2.20 1.16 -1.81 4.08 1.01 -1.26 0.44 120.40 121.81 2jk0 s VAL 294 Ca 0.42 -0.82 0.17 0.00 0.00 0.00 0.00 61.98 61.75 2jk0 s VAL 294 Cb -0.02 -1.01 0.52 0.00 0.00 0.00 0.00 36.38 35.87 2jk0 s VAL 294 CO 0.29 0.18 1.43 0.00 0.00 0.00 0.00 175.10 176.99 2jk0 n ALA 295 N 2.30 2.55 -0.70 5.51 0.00 -0.39 -4.81 120.51 124.97 2jk0 n ALA 295 Ca -0.16 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.22 2jk0 n ALA 295 Cb 0.55 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.03 2jk0 n ALA 295 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jk0 n ASP 296 N 1.10 0.00 -0.89 0.00 -0.08 -1.25 -0.58 116.55 114.84 2jk0 n ASP 296 Ca 0.19 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.53 2jk0 n ASP 296 Cb 0.54 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.20 2jk0 n ASP 296 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2jk0 n SER 297 N 0.65 2.56 -4.73 1.67 3.41 -1.26 -1.71 113.62 114.21 2jk0 n SER 297 Ca 0.00 -2.12 -0.41 0.00 -0.26 0.00 0.00 58.87 56.07 2jk0 n SER 297 Cb 0.00 -0.35 -0.04 0.00 -0.26 0.00 0.00 64.21 63.56 2jk0 n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jk0 s LEU 298 N -1.13 4.44 1.13 1.04 1.43 0.25 -4.62 118.68 121.23 2jk0 s LEU 298 Ca 0.28 2.06 -0.12 0.00 -1.03 0.00 0.00 54.13 55.32 2jk0 s LEU 298 Cb 0.17 -3.59 0.26 0.00 0.03 0.00 0.00 46.19 43.05 2jk0 s LEU 298 CO 0.17 -0.32 1.05 -0.94 0.23 0.00 0.00 176.35 176.53 2jk0 s SER 299 N 0.33 1.23 0.08 2.29 1.04 -1.26 -4.51 113.70 112.89 2jk0 s SER 299 Ca 0.53 1.64 -0.24 0.00 0.48 0.00 0.00 55.95 58.36 2jk0 s SER 299 Cb -0.29 -2.36 -0.16 0.00 0.10 0.00 0.00 66.02 63.31 2jk0 s SER 299 CO 0.33 -4.06 1.68 -0.65 0.98 0.00 0.00 173.24 171.51 2jk0 h PRO 300 N -2.53 -0.04 -0.88 4.02 0.11 -1.94 -0.25 132.00 130.50 2jk0 h PRO 300 Ca -0.59 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.56 2jk0 h PRO 300 Cb 1.32 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.39 2jk0 h PRO 300 CO 0.49 0.03 0.58 0.00 -0.21 0.00 0.00 178.00 178.89 2jk0 h ALA 301 N 0.87 1.45 0.00 -0.75 0.00 -1.95 -1.28 119.26 117.61 2jk0 h ALA 301 Ca -0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 2jk0 h ALA 301 Cb 0.09 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2jk0 h ALA 301 CO 0.01 0.46 -0.79 0.87 0.00 0.00 0.00 179.25 179.79 2jk0 h LYS 302 N 1.09 0.00 -0.86 0.00 1.57 -1.83 -3.05 116.57 113.49 2jk0 h LYS 302 Ca 0.35 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 59.15 2jk0 h LYS 302 Cb 0.04 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 2jk0 h LYS 302 CO -0.11 0.79 0.57 0.77 -0.57 0.00 0.00 179.45 180.90 2jk0 h SER 303 N 0.00 0.97 -0.08 0.86 0.02 -0.18 -1.55 113.55 113.58 2jk0 h SER 303 Ca -0.01 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2jk0 h SER 303 Cb 1.47 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.73 2jk0 h SER 303 CO 0.10 0.69 -0.13 -0.09 -1.14 0.00 0.00 176.83 176.27 2jk0 h ARG 304 N 1.14 -0.17 -0.36 3.45 2.43 -1.16 0.28 114.38 119.99 2jk0 h ARG 304 Ca 0.32 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.51 2jk0 h ARG 304 Cb -0.09 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2jk0 h ARG 304 CO -0.08 -0.11 0.22 0.82 -1.51 0.00 0.00 179.97 179.31 2jk0 h ILE 305 N -0.17 1.07 -0.19 1.20 1.08 -1.40 0.16 117.51 119.25 2jk0 h ILE 305 Ca 0.07 -0.16 -0.01 0.00 -0.39 0.00 0.00 64.86 64.37 2jk0 h ILE 305 Cb 0.28 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 34.59 2jk0 h ILE 305 CO -0.19 0.08 0.06 0.25 -0.69 0.00 0.00 178.15 177.67 2jk0 h LEU 306 N 0.45 0.27 -0.51 1.44 5.85 -1.06 -2.21 115.31 119.55 2jk0 h LEU 306 Ca 0.14 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 2jk0 h LEU 306 Cb -0.03 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2jk0 h LEU 306 CO -0.05 0.39 0.22 0.25 -0.34 0.00 0.00 178.44 178.92 2jk0 h LEU 307 N 0.14 0.70 -1.14 2.25 5.85 -0.12 0.59 115.31 123.58 2jk0 h LEU 307 Ca 0.06 -0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 2jk0 h LEU 307 Cb 0.21 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2jk0 h LEU 307 CO -0.00 0.66 -0.39 0.00 -0.34 0.00 0.00 178.44 178.37 2jk0 h MET 308 N 0.69 0.08 -0.05 1.25 -0.00 -0.65 -0.16 114.93 116.09 2jk0 h MET 308 Ca 0.17 -0.03 -0.20 0.00 -0.00 0.00 0.00 59.70 59.64 2jk0 h MET 308 Cb 0.17 -0.00 0.01 0.00 -0.00 0.00 0.00 31.60 31.78 2jk0 h MET 308 CO -0.02 0.46 -0.75 -0.07 -0.00 0.00 0.00 176.91 176.53 2jk0 h LEU 309 N 0.07 0.75 -1.66 -0.10 3.38 -1.16 -3.22 115.31 113.36 2jk0 h LEU 309 Ca 0.01 -0.70 -0.01 0.00 0.09 0.00 0.00 57.88 57.27 2jk0 h LEU 309 Cb 0.72 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2jk0 h LEU 309 CO 0.05 1.34 0.12 0.00 0.09 0.00 0.00 178.44 180.05 2jk0 h ALA 310 N 0.42 1.74 0.00 1.53 0.00 -0.41 -0.28 119.26 122.27 2jk0 h ALA 310 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2jk0 h ALA 310 Cb 1.41 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2jk0 h ALA 310 CO 0.15 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.89 2jk0 n LEU 311 N -4.45 0.61 0.22 0.00 4.77 -0.11 -1.35 117.00 116.68 2jk0 n LEU 311 Ca 0.01 0.67 0.12 0.00 -0.03 0.00 0.00 56.01 56.78 2jk0 n LEU 311 Cb 0.11 -0.62 0.28 0.00 -2.33 0.00 0.00 43.42 40.86 2jk0 n LEU 311 CO 0.35 -0.62 0.81 0.71 -1.33 0.00 0.00 177.39 177.31 2jk0 h THR 312 N 0.00 0.15 0.00 -5.08 1.35 -1.10 -3.38 112.91 104.85 2jk0 h THR 312 Ca 0.00 -1.06 -0.39 0.00 -0.55 0.00 0.00 66.41 64.41 2jk0 h THR 312 Cb 0.29 1.93 -0.07 0.00 -1.73 0.00 0.00 68.15 68.58 2jk0 h THR 312 CO 0.00 0.08 -2.41 0.29 -0.25 0.00 0.00 175.52 173.23 2jk0 n LYS 313 N -3.14 0.58 -3.56 4.72 5.02 -0.49 -5.08 118.16 116.22 2jk0 n LYS 313 Ca 0.03 0.18 -0.13 0.00 -2.02 0.00 0.00 58.31 56.37 2jk0 n LYS 313 Cb 0.50 -1.46 -0.05 0.00 -0.02 0.00 0.00 35.03 34.01 2jk0 n LYS 313 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2jk0 s THR 314 N -2.48 0.03 -0.15 -0.18 -1.32 -0.46 -5.01 115.64 106.08 2jk0 s THR 314 Ca -0.34 -0.25 0.02 0.00 -1.21 0.00 0.00 61.69 59.91 2jk0 s THR 314 Cb 0.11 -1.01 0.04 0.00 -1.51 0.00 0.00 72.50 70.13 2jk0 s THR 314 CO 0.51 -0.14 0.99 1.07 -2.21 0.00 0.00 174.62 174.85 2jk0 n THR 315 N 0.18 0.90 -2.59 5.08 5.66 -1.26 -4.03 114.28 118.22 2jk0 n THR 315 Ca -0.18 -0.95 -0.43 0.00 -3.05 0.00 0.00 64.05 59.44 2jk0 n THR 315 Cb 0.62 0.55 -0.02 0.00 -1.55 0.00 0.00 70.33 69.93 2jk0 n THR 315 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2jk0 s ASN 316 N -0.91 6.83 0.19 1.09 3.84 -1.26 -4.95 114.94 119.76 2jk0 s ASN 316 Ca 0.03 0.97 -0.14 0.00 0.21 0.00 0.00 52.86 53.93 2jk0 s ASN 316 Cb 0.02 -2.54 0.18 0.00 -0.55 0.00 0.00 41.25 38.36 2jk0 s ASN 316 CO 0.02 -0.99 1.69 -0.65 -2.79 0.00 0.00 177.10 174.38 2jk0 h PRO 317 N 8.52 0.12 -0.14 0.43 0.11 -1.98 -0.51 132.00 138.54 2jk0 h PRO 317 Ca -0.22 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.83 2jk0 h PRO 317 Cb 1.07 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2jk0 h PRO 317 CO 1.05 0.08 -0.15 0.00 -0.21 0.00 0.00 178.00 178.77 2jk0 h ALA 318 N 1.43 1.51 0.03 -0.75 0.00 -1.98 0.59 119.26 120.09 2jk0 h ALA 318 Ca 0.25 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2jk0 h ALA 318 Cb 0.37 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2jk0 h ALA 318 CO -0.40 0.35 -0.24 0.28 0.00 0.00 0.00 179.25 179.24 2jk0 h VAL 319 N 0.20 1.66 -0.44 0.00 2.07 -1.83 -2.77 116.25 115.15 2jk0 h VAL 319 Ca 0.04 -2.25 0.06 0.00 0.82 0.00 0.00 66.70 65.37 2jk0 h VAL 319 Cb 0.39 3.16 -0.05 0.00 -1.52 0.00 0.00 31.29 33.26 2jk0 h VAL 319 CO 0.02 0.60 0.13 0.40 0.02 0.00 0.00 177.57 178.75 2jk0 h ILE 320 N -0.72 0.83 -0.64 4.57 2.04 -0.84 -1.53 117.51 121.22 2jk0 h ILE 320 Ca -0.04 -0.10 0.12 0.00 1.00 0.00 0.00 64.86 65.84 2jk0 h ILE 320 Cb 1.12 0.52 -0.09 0.00 -0.74 0.00 0.00 36.82 37.63 2jk0 h ILE 320 CO 0.05 0.05 0.18 -0.61 0.00 0.00 0.00 178.15 177.82 2jk0 h GLN 321 N 0.29 0.31 -0.63 2.37 5.75 0.14 -2.13 115.11 121.21 2jk0 h GLN 321 Ca 0.21 -0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.60 2jk0 h GLN 321 Cb 0.22 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 2jk0 h GLN 321 CO -0.23 0.20 0.05 0.22 -2.65 0.00 0.00 178.83 176.43 2jk0 h ASP 322 N 0.32 1.04 -0.74 -0.69 3.58 -1.04 -2.04 116.42 116.85 2jk0 h ASP 322 Ca 0.34 -0.28 0.17 0.00 0.42 0.00 0.00 57.03 57.68 2jk0 h ASP 322 Cb 0.51 -0.28 -0.13 0.00 1.72 0.00 0.00 39.33 41.15 2jk0 h ASP 322 CO -0.40 1.06 0.04 1.88 -2.88 0.00 0.00 179.24 178.95 2jk0 h TYR 323 N 0.98 0.02 0.00 0.28 0.99 -0.65 0.15 116.97 118.73 2jk0 h TYR 323 Ca 0.18 0.05 -0.01 0.00 2.00 0.00 0.00 58.73 60.96 2jk0 h TYR 323 Cb 0.50 0.11 -0.00 0.00 1.00 0.00 0.00 36.73 38.34 2jk0 h TYR 323 CO 0.04 -0.21 -0.04 0.74 -0.00 0.00 0.00 178.16 178.69 2jk0 h PHE 324 N 0.13 0.00 0.00 4.88 -1.00 -1.01 0.56 116.94 120.51 2jk0 h PHE 324 Ca 0.41 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.99 2jk0 h PHE 324 Cb 0.73 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.25 2jk0 h PHE 324 CO -0.38 0.04 -1.66 0.72 -1.61 0.00 0.00 178.31 175.42 2jk0 n HIS 325 N -3.37 0.74 -0.02 -0.55 8.25 0.32 -4.47 115.22 116.12 2jk0 n HIS 325 Ca -0.02 0.25 -0.17 0.00 -0.26 0.00 0.00 57.72 57.52 2jk0 n HIS 325 Cb 0.17 -1.03 -0.14 0.00 1.12 0.00 0.00 29.99 30.10 2jk0 n HIS 325 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jk0 n ALA 326 N -2.46 1.14 1.05 -1.41 0.00 -0.00 -5.03 120.51 113.80 2jk0 n ALA 326 Ca -0.14 -0.71 0.12 0.00 0.00 0.00 0.00 53.44 52.71 2jk0 n ALA 326 Cb 0.89 -0.68 0.14 0.00 0.00 0.00 0.00 19.45 19.80 2jk0 n ALA 326 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16