#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 4.19 0.76 -4.53 1.43 -1.26 -5.07 118.68 114.20 2jk0 s LEU 4 Ca 0.00 0.72 -0.15 0.00 -1.03 0.00 0.00 54.13 53.67 2jk0 s LEU 4 Cb 0.00 -3.48 0.04 0.00 0.03 0.00 0.00 46.19 42.78 2jk0 s LEU 4 CO 0.00 -0.05 1.09 -2.65 0.23 0.00 0.00 176.35 174.97 2jk0 n PRO 5 N -0.25 0.39 -3.71 1.29 -0.02 -1.26 -4.55 135.00 126.88 2jk0 n PRO 5 Ca -0.01 0.20 -0.38 0.00 -2.02 0.00 0.00 63.50 61.29 2jk0 n PRO 5 Cb 0.53 -2.34 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.85 5.38 -0.13 2.55 0.01 -1.26 0.32 114.94 119.96 2jk0 s ASN 6 Ca 0.74 -1.87 -0.03 0.00 -0.71 0.00 0.00 52.86 50.99 2jk0 s ASN 6 Cb -0.32 -1.88 -0.03 0.00 0.41 0.00 0.00 41.25 39.43 2jk0 s ASN 6 CO 0.50 -0.55 -0.02 -0.63 -1.51 0.00 0.00 177.10 174.89 2jk0 s ILE 7 N 1.24 4.09 -0.18 0.60 -1.09 -0.47 -0.30 121.20 125.08 2jk0 s ILE 7 Ca 0.06 -0.30 -0.07 0.00 -2.23 0.00 0.00 60.65 58.10 2jk0 s ILE 7 Cb -0.23 -2.77 -0.04 0.00 -1.58 0.00 0.00 42.46 37.84 2jk0 s ILE 7 CO -0.02 0.53 0.06 -0.69 -1.23 0.00 0.00 174.94 173.58 2jk0 s VAL 8 N -0.06 4.74 -0.41 2.92 1.01 -1.12 -2.25 120.40 125.23 2jk0 s VAL 8 Ca 0.03 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 2jk0 s VAL 8 Cb -0.13 -3.14 0.02 0.00 0.00 0.00 0.00 36.38 33.13 2jk0 s VAL 8 CO 0.02 0.45 0.29 -0.63 0.00 0.00 0.00 175.10 175.24 2jk0 s ILE 9 N 0.44 5.22 -0.40 2.22 1.01 0.14 -0.78 121.20 129.04 2jk0 s ILE 9 Ca 0.03 -0.67 -0.20 0.00 0.00 0.00 0.00 60.65 59.81 2jk0 s ILE 9 Cb -0.13 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.45 2jk0 s ILE 9 CO 0.01 -0.30 0.59 -0.76 0.00 0.00 0.00 174.94 174.48 2jk0 s LEU 10 N 1.67 4.45 0.16 2.97 1.02 -0.03 -0.11 118.68 128.81 2jk0 s LEU 10 Ca 0.05 -0.20 -0.19 0.00 0.02 0.00 0.00 54.13 53.80 2jk0 s LEU 10 Cb -0.19 -2.68 -0.08 0.00 0.02 0.00 0.00 46.19 43.27 2jk0 s LEU 10 CO 0.10 -0.66 0.65 0.00 0.02 0.00 0.00 176.35 176.46 2jk0 s ALA 11 N 2.64 3.50 0.00 4.21 0.00 0.18 -1.29 121.76 131.00 2jk0 s ALA 11 Ca 0.21 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.26 2jk0 s ALA 11 Cb -0.15 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2jk0 s ALA 11 CO 0.16 0.37 0.04 0.25 0.00 0.00 0.00 175.76 176.59 2jk0 n THR 12 N 1.07 0.00 0.00 0.00 -2.24 -0.01 -0.70 114.28 112.41 2jk0 n THR 12 Ca -0.05 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2jk0 n THR 12 Cb 0.51 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 2jk0 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jk0 n GLY 13 N 0.67 0.21 0.00 3.38 0.00 -1.22 -1.81 105.19 106.42 2jk0 n GLY 13 Ca 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.41 0.24 -0.02 0.00 -0.89 -3.67 105.19 100.44 2jk0 n GLY 14 Ca 0.00 -1.80 0.11 0.00 0.00 0.00 0.00 46.02 44.33 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 0.65 -0.00 2.61 2.02 -1.83 0.12 112.91 116.47 2jk0 h THR 15 Ca 0.00 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.41 2jk0 h THR 15 Cb 0.00 1.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.90 2jk0 h THR 15 CO 0.00 0.17 0.11 -0.29 0.37 0.00 0.00 175.52 175.89 2jk0 h ILE 16 N 0.00 0.01 -0.11 3.11 2.10 -1.81 -2.60 117.51 118.21 2jk0 h ILE 16 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2jk0 h ILE 16 Cb 0.48 0.89 0.00 0.00 -1.09 0.00 0.00 36.82 37.10 2jk0 h ILE 16 CO 0.02 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.09 2jk0 n ALA 17 N -2.02 2.26 -2.55 0.18 0.00 0.40 -4.47 120.51 114.30 2jk0 n ALA 17 Ca -0.03 -1.65 -0.20 0.00 0.00 0.00 0.00 53.44 51.56 2jk0 n ALA 17 Cb 0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 19.45 19.32 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 -1.63 1.51 0.11 0.00 0.00 -0.98 0.15 107.32 106.49 2jk0 s GLY 18 Ca 0.20 -1.35 -0.00 0.00 0.00 0.00 0.00 44.72 43.56 2jk0 s GLY 18 CO 0.05 -1.28 0.01 -0.56 0.00 0.00 0.00 173.10 171.33 2jk0 s SER 19 N -4.14 0.56 0.00 1.64 0.01 -1.26 -2.77 113.70 107.73 2jk0 s SER 19 Ca 0.43 -1.13 0.00 0.00 1.31 0.00 0.00 55.95 56.56 2jk0 s SER 19 Cb -0.09 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.36 2jk0 s SER 19 CO 0.32 -0.65 0.00 0.00 0.41 0.00 0.00 173.24 173.32 2jk0 n ALA 20 N -0.05 0.00 -2.75 1.44 0.00 -1.26 -5.03 120.51 112.85 2jk0 n ALA 20 Ca -0.09 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.10 2jk0 n ALA 20 Cb 0.63 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.06 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 0.00 4.58 -0.01 0.00 0.00 -1.26 -4.94 120.51 118.87 2jk0 n ALA 21 Ca 0.00 -4.37 -0.01 0.00 0.00 0.00 0.00 53.44 49.06 2jk0 n ALA 21 Cb 0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.29 0.11 0.00 0.00 0.00 -1.26 -5.16 120.51 113.91 2jk0 n ALA 22 Ca 0.32 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2jk0 n ALA 22 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2jk0 n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jk0 n ALA 33 N -2.66 0.00 -2.69 0.00 0.00 -1.10 -4.83 120.51 109.22 2jk0 n ALA 33 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.04 2jk0 n ALA 33 Cb 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.45 2jk0 n ALA 33 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2jk0 s LEU 34 N 0.00 4.20 1.03 0.00 -0.00 0.41 -5.01 118.68 119.30 2jk0 s LEU 34 Ca 0.00 0.60 -0.15 0.00 -0.00 0.00 0.00 54.13 54.59 2jk0 s LEU 34 Cb 0.00 -2.55 0.20 0.00 -0.00 0.00 0.00 46.19 43.84 2jk0 s LEU 34 CO 0.00 -0.04 1.14 -0.83 -0.00 0.00 0.00 176.35 176.62 2jk0 s GLY 35 N 0.84 1.59 0.10 -3.48 0.00 -1.26 -4.76 107.32 100.36 2jk0 s GLY 35 Ca 0.21 -0.67 -0.22 0.00 0.00 0.00 0.00 44.72 44.03 2jk0 s GLY 35 CO 0.08 0.02 1.73 -0.24 0.00 0.00 0.00 173.10 174.69 2jk0 h VAL 36 N -1.94 0.95 -0.31 1.40 3.04 -1.97 -2.86 116.25 114.56 2jk0 h VAL 36 Ca -0.50 -0.00 0.09 0.00 -1.01 0.00 0.00 66.70 65.28 2jk0 h VAL 36 Cb 1.31 0.94 -0.01 0.00 -2.01 0.00 0.00 31.29 31.52 2jk0 h VAL 36 CO 0.51 0.00 0.30 -0.08 -1.01 0.00 0.00 177.57 177.29 2jk0 h GLU 37 N 0.00 0.00 0.14 4.17 4.57 -1.94 -0.76 114.58 120.76 2jk0 h GLU 37 Ca 0.03 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.02 2jk0 h GLU 37 Cb 0.04 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2jk0 h GLU 37 CO -0.06 0.00 -0.82 1.15 -1.18 0.00 0.00 179.01 178.11 2jk0 h THR 38 N 0.00 1.51 -0.27 0.32 2.02 -1.88 -2.00 112.91 112.61 2jk0 h THR 38 Ca 0.15 -2.52 0.06 0.00 0.77 0.00 0.00 66.41 64.87 2jk0 h THR 38 Cb 0.74 3.17 -0.08 0.00 -1.74 0.00 0.00 68.15 70.25 2jk0 h THR 38 CO -0.00 0.71 -0.28 -0.07 0.37 0.00 0.00 175.52 176.25 2jk0 h LEU 39 N -0.35 -0.90 -0.79 2.58 4.07 -1.01 0.23 115.31 119.15 2jk0 h LEU 39 Ca -0.14 0.16 0.13 0.00 0.08 0.00 0.00 57.88 58.10 2jk0 h LEU 39 Cb 1.64 0.42 -0.09 0.00 1.08 0.00 0.00 40.66 43.71 2jk0 h LEU 39 CO 0.15 -0.31 0.38 0.40 -1.08 0.00 0.00 178.44 177.99 2jk0 h ILE 40 N -0.28 0.75 -0.00 1.22 2.04 -1.52 -2.78 117.51 116.94 2jk0 h ILE 40 Ca 0.14 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.72 2jk0 h ILE 40 Cb 0.50 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2jk0 h ILE 40 CO -0.43 0.11 -0.41 1.56 0.00 0.00 0.00 178.15 178.97 2jk0 h GLN 41 N 0.58 0.00 0.00 2.37 4.20 -0.16 -2.91 115.11 119.19 2jk0 h GLN 41 Ca 0.42 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.13 2jk0 h GLN 41 Cb 0.56 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2jk0 h GLN 41 CO -0.34 0.42 0.00 0.00 -0.67 0.00 0.00 178.83 178.23 2jk0 n ALA 42 N -2.46 1.77 -3.59 3.87 0.00 0.61 -3.85 120.51 116.85 2jk0 n ALA 42 Ca -0.02 -0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 2jk0 n ALA 42 Cb 0.44 -1.29 -0.12 0.00 0.00 0.00 0.00 19.45 18.48 2jk0 n ALA 42 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jk0 s VAL 43 N -3.05 1.02 -0.41 0.00 1.01 -1.10 -4.95 120.40 112.92 2jk0 s VAL 43 Ca 0.08 -2.61 0.22 0.00 0.00 0.00 0.00 61.98 59.67 2jk0 s VAL 43 Cb 0.11 -1.71 0.23 0.00 0.00 0.00 0.00 36.38 35.01 2jk0 s VAL 43 CO 0.33 -1.02 1.68 -0.81 0.00 0.00 0.00 175.10 175.27 2jk0 n PRO 44 N 3.27 0.17 0.25 2.72 -0.04 -1.25 -2.73 135.00 137.39 2jk0 n PRO 44 Ca 0.16 0.49 0.17 0.00 -0.04 0.00 0.00 63.50 64.28 2jk0 n PRO 44 Cb 0.39 -1.89 0.81 0.00 -0.04 0.00 0.00 33.50 32.77 2jk0 n PRO 44 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2jk0 h GLU 45 N 0.00 0.00 -0.18 0.54 3.07 -1.92 -2.16 114.58 113.92 2jk0 h GLU 45 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jk0 h GLU 45 Cb 0.25 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 2jk0 h GLU 45 CO 0.00 0.00 0.11 -0.07 -1.40 0.00 0.00 179.01 177.65 2jk0 h LEU 46 N 0.00 0.21 -0.99 1.33 3.38 -1.86 -2.51 115.31 114.86 2jk0 h LEU 46 Ca 0.00 -0.01 0.36 0.00 0.09 0.00 0.00 57.88 58.32 2jk0 h LEU 46 Cb 0.21 -0.05 -0.17 0.00 0.09 0.00 0.00 40.66 40.74 2jk0 h LEU 46 CO 0.00 0.16 0.45 0.11 0.09 0.00 0.00 178.44 179.25 2jk0 h LYS 47 N 0.24 0.09 -0.00 1.13 1.57 -1.60 -0.73 116.57 117.28 2jk0 h LYS 47 Ca 0.07 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2jk0 h LYS 47 Cb -0.01 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2jk0 h LYS 47 CO -0.01 0.06 -0.01 0.25 -0.57 0.00 0.00 179.45 179.17 2jk0 n THR 48 N -5.24 0.00 -0.05 -0.16 -2.24 -0.95 -3.87 114.28 101.77 2jk0 n THR 48 Ca 0.33 -0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 62.04 2jk0 n THR 48 Cb 1.09 -0.47 -0.05 0.00 -2.10 0.00 0.00 70.33 68.80 2jk0 n THR 48 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jk0 n LEU 49 N -1.20 2.42 -3.67 3.22 4.77 -0.31 -5.09 117.00 117.14 2jk0 n LEU 49 Ca 0.16 -0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 2jk0 n LEU 49 Cb 0.22 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 2jk0 n LEU 49 CO 0.22 0.60 0.28 0.00 -1.33 0.00 0.00 177.39 177.16 2jk0 s ALA 50 N -2.22 -1.06 -0.30 -1.18 0.00 -1.03 -4.30 121.76 111.66 2jk0 s ALA 50 Ca -0.13 -0.07 -0.23 0.00 0.00 0.00 0.00 51.96 51.52 2jk0 s ALA 50 Cb 0.04 0.83 -0.00 0.00 0.00 0.00 0.00 23.12 23.99 2jk0 s ALA 50 CO 0.28 -0.78 0.78 -0.80 0.00 0.00 0.00 175.76 175.24 2jk0 s ASN 51 N -2.84 6.66 -0.15 0.00 0.01 0.15 -4.42 114.94 114.34 2jk0 s ASN 51 Ca 0.07 0.66 -0.04 0.00 -0.71 0.00 0.00 52.86 52.84 2jk0 s ASN 51 Cb -0.01 -2.40 -0.03 0.00 0.41 0.00 0.00 41.25 39.22 2jk0 s ASN 51 CO -0.06 -0.60 -0.01 -0.63 -1.51 0.00 0.00 177.10 174.29 2jk0 s ILE 52 N 2.93 4.12 -0.06 0.60 1.01 -1.26 -1.37 121.20 127.17 2jk0 s ILE 52 Ca 0.32 -0.28 0.04 0.00 0.00 0.00 0.00 60.65 60.73 2jk0 s ILE 52 Cb -0.14 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 2jk0 s ILE 52 CO 0.12 0.50 -0.19 -0.54 0.00 0.00 0.00 174.94 174.83 2jk0 s LYS 53 N 0.24 2.65 -0.03 2.79 1.02 -0.95 -5.02 119.74 120.43 2jk0 s LYS 53 Ca -0.01 -0.79 0.04 0.00 0.02 0.00 0.00 55.97 55.23 2jk0 s LYS 53 Cb -0.13 -2.32 -0.03 0.00 -0.52 0.00 0.00 37.83 34.83 2jk0 s LYS 53 CO 0.02 0.46 -0.13 0.20 -0.92 0.00 0.00 175.35 174.98 2jk0 s GLY 54 N -0.33 1.58 -0.07 -3.33 0.00 -1.26 -0.68 107.32 103.23 2jk0 s GLY 54 Ca 0.02 -1.00 -0.04 0.00 0.00 0.00 0.00 44.72 43.70 2jk0 s GLY 54 CO 0.02 -0.81 0.17 1.85 0.00 0.00 0.00 173.10 174.33 2jk0 s GLU 55 N -0.90 0.15 -0.67 2.90 2.12 0.84 -4.94 118.70 118.20 2jk0 s GLU 55 Ca 0.13 0.33 -0.11 0.00 0.36 0.00 0.00 54.97 55.67 2jk0 s GLU 55 Cb -0.11 -0.05 0.17 0.00 0.26 0.00 0.00 34.13 34.41 2jk0 s GLU 55 CO 0.02 -0.10 0.58 -1.14 -0.54 0.00 0.00 175.26 174.07 2jk0 s GLN 56 N 0.70 3.07 0.13 4.30 2.00 -1.26 0.50 119.66 129.10 2jk0 s GLN 56 Ca -0.05 -2.24 -0.13 0.00 -2.00 0.00 0.00 55.36 50.94 2jk0 s GLN 56 Cb -0.07 -4.16 -0.02 0.00 0.80 0.00 0.00 33.01 29.56 2jk0 s GLN 56 CO -0.04 -1.25 1.53 0.28 -0.50 0.00 0.00 175.29 175.31 2jk0 h VAL 57 N 5.31 1.28 -2.96 1.34 2.07 -1.25 -3.48 116.25 118.56 2jk0 h VAL 57 Ca -0.04 -1.25 0.03 0.00 0.82 0.00 0.00 66.70 66.25 2jk0 h VAL 57 Cb 1.04 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 2jk0 h VAL 57 CO 0.81 0.42 0.28 0.00 0.02 0.00 0.00 177.57 179.10 2jk0 s ALA 58 N -4.74 -0.97 -0.40 1.67 0.00 -1.12 -5.02 121.76 111.19 2jk0 s ALA 58 Ca -0.12 -0.56 0.11 0.00 0.00 0.00 0.00 51.96 51.38 2jk0 s ALA 58 Cb 0.11 0.73 0.34 0.00 0.00 0.00 0.00 23.12 24.30 2jk0 s ALA 58 CO 0.83 -1.01 0.74 0.43 0.00 0.00 0.00 175.76 176.75 2jk0 n SER 59 N -1.07 1.29 -4.49 0.00 7.64 -1.19 -3.38 113.62 112.42 2jk0 n SER 59 Ca -0.07 -3.07 -0.24 0.00 1.01 0.00 0.00 58.87 56.50 2jk0 n SER 59 Cb 0.60 -0.61 -0.10 0.00 -1.01 0.00 0.00 64.21 63.08 2jk0 n SER 59 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2jk0 s ILE 60 N -2.58 2.64 0.29 0.44 -4.36 -0.75 -4.58 121.20 112.29 2jk0 s ILE 60 Ca 0.41 -2.25 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 2jk0 s ILE 60 Cb 0.32 -2.37 -0.10 0.00 1.25 0.00 0.00 42.46 41.56 2jk0 s ILE 60 CO -0.09 -0.34 1.39 -0.83 0.24 0.00 0.00 174.94 175.31 2jk0 s GLY 61 N -3.39 2.63 0.60 6.27 0.00 -1.26 -2.10 107.32 110.07 2jk0 s GLY 61 Ca 0.29 1.32 0.38 0.00 0.00 0.00 0.00 44.72 46.70 2jk0 s GLY 61 CO 0.15 2.13 2.16 1.48 0.00 0.00 0.00 173.10 179.03 2jk0 h SER 62 N 4.26 0.00 -0.58 1.64 4.64 -1.92 0.20 113.55 121.80 2jk0 h SER 62 Ca -0.47 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.01 2jk0 h SER 62 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 2jk0 h SER 62 CO 0.72 0.01 0.45 -0.33 -0.87 0.00 0.00 176.83 176.81 2jk0 h GLU 63 N 0.00 0.00 -0.56 4.77 3.07 -1.90 -0.78 114.58 119.18 2jk0 h GLU 63 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jk0 h GLU 63 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 2jk0 h GLU 63 CO 0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 2jk0 n ASN 64 N -4.22 3.18 -4.75 1.42 3.02 0.72 -4.93 115.26 109.70 2jk0 n ASN 64 Ca 0.11 -1.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.26 2jk0 n ASN 64 Cb 0.68 -0.37 -0.02 0.00 -0.61 0.00 0.00 39.78 39.45 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 -1.25 4.32 0.09 3.52 1.75 -0.30 -4.99 119.30 122.44 2jk0 s MET 65 Ca 0.40 2.22 0.01 0.00 -1.25 0.00 0.00 55.69 57.08 2jk0 s MET 65 Cb 0.21 -3.12 -0.04 0.00 2.84 0.00 0.00 34.83 34.72 2jk0 s MET 65 CO 0.28 -0.32 -0.06 0.95 -0.65 0.00 0.00 175.02 175.22 2jk0 s THR 66 N -0.29 0.63 0.47 10.11 -4.23 -1.26 -5.04 115.64 116.03 2jk0 s THR 66 Ca 0.56 -1.86 0.22 0.00 -1.18 0.00 0.00 61.69 59.43 2jk0 s THR 66 Cb -0.40 -1.58 0.40 0.00 1.34 0.00 0.00 72.50 72.26 2jk0 s THR 66 CO 0.45 -0.85 1.90 0.77 -0.54 0.00 0.00 174.62 176.35 2jk0 h SER 67 N 3.10 0.23 -0.38 3.99 4.64 -1.99 -1.06 113.55 122.08 2jk0 h SER 67 Ca -0.35 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 60.96 2jk0 h SER 67 Cb 1.17 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 2jk0 h SER 67 CO 0.63 0.10 0.14 0.44 -0.87 0.00 0.00 176.83 177.28 2jk0 h ASP 68 N 0.24 0.54 0.26 4.97 3.32 -1.96 -0.68 116.42 123.11 2jk0 h ASP 68 Ca 0.40 -0.18 -0.14 0.00 0.02 0.00 0.00 57.03 57.13 2jk0 h ASP 68 Cb 1.20 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 2jk0 h ASP 68 CO -0.09 0.57 -0.54 0.58 -1.72 0.00 0.00 179.24 178.04 2jk0 h VAL 69 N 0.47 1.35 -0.30 -1.35 2.07 -1.64 -2.55 116.25 114.32 2jk0 h VAL 69 Ca 0.13 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 65.78 2jk0 h VAL 69 Cb 0.21 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 2jk0 h VAL 69 CO -0.01 0.55 -0.01 -0.07 0.02 0.00 0.00 177.57 178.05 2jk0 h LEU 70 N 0.23 0.42 -0.45 2.57 3.38 -1.04 -0.86 115.31 119.56 2jk0 h LEU 70 Ca 0.00 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2jk0 h LEU 70 Cb 1.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 2jk0 h LEU 70 CO 0.09 0.49 0.10 -0.07 0.09 0.00 0.00 178.44 179.14 2jk0 h LEU 71 N 0.44 0.69 -0.46 1.67 3.38 -0.72 -0.56 115.31 119.74 2jk0 h LEU 71 Ca 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2jk0 h LEU 71 Cb 0.30 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2jk0 h LEU 71 CO 0.01 0.75 0.20 0.74 0.09 0.00 0.00 178.44 180.22 2jk0 h THR 72 N 0.60 1.20 0.37 0.22 2.02 -1.24 -1.75 112.91 114.32 2jk0 h THR 72 Ca 0.14 -0.59 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 2jk0 h THR 72 Cb 0.33 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2jk0 h THR 72 CO 0.00 0.22 -0.18 0.25 0.37 0.00 0.00 175.52 176.19 2jk0 h LEU 73 N 0.60 -0.42 -0.54 2.58 5.85 -1.05 -1.25 115.31 121.08 2jk0 h LEU 73 Ca 0.15 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.88 2jk0 h LEU 73 Cb 0.17 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 2jk0 h LEU 73 CO -0.02 -0.17 0.17 -1.28 -0.34 0.00 0.00 178.44 176.81 2jk0 h SER 74 N -0.66 0.14 -0.75 1.25 0.87 -1.12 0.11 113.55 113.39 2jk0 h SER 74 Ca -0.05 0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 2jk0 h SER 74 Cb 0.47 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.47 2jk0 h SER 74 CO 0.08 0.10 0.30 0.11 -0.53 0.00 0.00 176.83 176.89 2jk0 h LYS 75 N 0.34 1.12 -0.18 2.24 1.57 -1.18 -1.63 116.57 118.86 2jk0 h LYS 75 Ca 0.27 -0.20 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 2jk0 h LYS 75 Cb 0.33 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2jk0 h LYS 75 CO -0.29 0.92 -0.50 -0.09 -0.57 0.00 0.00 179.45 178.91 2jk0 h ARG 76 N 1.08 0.48 0.71 3.15 9.65 -0.58 -0.62 114.38 128.26 2jk0 h ARG 76 Ca 0.25 -0.28 -0.03 0.00 -1.10 0.00 0.00 59.98 58.81 2jk0 h ARG 76 Cb 0.21 0.02 0.01 0.00 -1.39 0.00 0.00 29.97 28.82 2jk0 h ARG 76 CO -0.02 0.87 -0.34 0.28 2.80 0.00 0.00 179.97 183.56 2jk0 h VAL 77 N 0.38 0.28 -0.81 0.20 2.07 -0.48 -0.85 116.25 117.04 2jk0 h VAL 77 Ca 0.02 -0.06 0.05 0.00 0.82 0.00 0.00 66.70 67.53 2jk0 h VAL 77 Cb 1.01 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 2jk0 h VAL 77 CO 0.09 0.01 0.53 0.78 0.02 0.00 0.00 177.57 179.00 2jk0 h ASN 78 N -1.00 0.81 -0.77 0.57 2.35 -1.26 0.59 115.58 116.87 2jk0 h ASN 78 Ca -0.10 -0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2jk0 h ASN 78 Cb 0.74 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.90 2jk0 h ASN 78 CO 0.16 0.54 0.50 -0.08 -1.65 0.00 0.00 177.43 176.90 2jk0 h GLU 79 N 0.93 1.02 0.04 0.81 4.81 -0.98 -2.07 114.58 119.15 2jk0 h GLU 79 Ca 0.33 -0.07 -0.23 0.00 -0.13 0.00 0.00 59.36 59.27 2jk0 h GLU 79 Cb 0.14 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 2jk0 h GLU 79 CO -0.11 0.68 -1.01 -0.07 -0.73 0.00 0.00 179.01 177.77 2jk0 h LEU 80 N 1.05 0.39 -0.49 1.64 3.38 0.05 -3.23 115.31 118.10 2jk0 h LEU 80 Ca 0.28 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2jk0 h LEU 80 Cb -0.11 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.52 2jk0 h LEU 80 CO -0.06 1.19 0.00 -0.07 0.09 0.00 0.00 178.44 179.59 2jk0 h LEU 81 N 0.14 0.00 -1.92 1.67 3.38 -0.83 -2.13 115.31 115.62 2jk0 h LEU 81 Ca -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2jk0 h LEU 81 Cb 1.68 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.43 2jk0 h LEU 81 CO 0.16 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.64 2jk0 h ALA 82 N 2.12 1.08 -2.37 1.53 0.00 -1.38 -3.45 119.26 116.79 2jk0 h ALA 82 Ca 0.00 -0.05 -0.47 0.00 0.00 0.00 0.00 54.91 54.40 2jk0 h ALA 82 Cb 0.75 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2jk0 h ALA 82 CO 0.00 0.07 0.36 1.03 0.00 0.00 0.00 179.25 180.71 2jk0 s ARG 83 N -3.92 4.38 0.46 0.00 1.81 -0.80 -4.97 118.95 115.90 2jk0 s ARG 83 Ca -0.01 1.33 0.26 0.00 -1.72 0.00 0.00 55.73 55.58 2jk0 s ARG 83 Cb 0.11 -2.57 0.62 0.00 -0.45 0.00 0.00 34.95 32.66 2jk0 s ARG 83 CO 0.53 0.08 1.71 0.66 -0.68 0.00 0.00 175.30 177.61 2jk0 h SER 84 N 2.67 0.00 -0.55 0.23 4.64 -1.87 -3.28 113.55 115.39 2jk0 h SER 84 Ca -0.48 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.58 2jk0 h SER 84 Cb 1.20 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.13 2jk0 h SER 84 CO 0.63 0.00 0.15 -0.90 -0.87 0.00 0.00 176.83 175.84 2jk0 n ASP 85 N -3.06 3.05 -3.72 4.97 5.75 -1.26 -4.83 116.55 117.44 2jk0 n ASP 85 Ca 0.03 -3.66 -0.27 0.00 -0.01 0.00 0.00 54.79 50.89 2jk0 n ASP 85 Cb 0.47 -0.69 -0.17 0.00 -1.03 0.00 0.00 41.12 39.70 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 -3.22 0.43 -0.02 2.12 1.01 -1.24 -4.81 120.40 114.67 2jk0 s VAL 86 Ca 0.49 -0.42 -0.09 0.00 0.00 0.00 0.00 61.98 61.96 2jk0 s VAL 86 Cb 0.43 -0.91 -0.30 0.00 0.00 0.00 0.00 36.38 35.59 2jk0 s VAL 86 CO 0.04 -0.15 0.79 0.44 0.00 0.00 0.00 175.10 176.22 2jk0 h ASP 87 N 8.28 0.56 -3.49 3.32 3.32 -0.98 -3.46 116.42 123.97 2jk0 h ASP 87 Ca -0.16 -0.78 -0.17 0.00 0.02 0.00 0.00 57.03 55.93 2jk0 h ASP 87 Cb 1.12 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.46 2jk0 h ASP 87 CO 0.32 1.65 0.02 0.61 -1.72 0.00 0.00 179.24 180.11 2jk0 n GLY 88 N 1.77 1.72 2.85 2.75 0.00 -1.25 -4.29 105.19 108.73 2jk0 n GLY 88 Ca -0.20 -1.46 -0.16 0.00 0.00 0.00 0.00 46.02 44.19 2jk0 n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jk0 s VAL 89 N -2.55 0.17 -0.13 1.61 1.01 0.11 -2.79 120.40 117.83 2jk0 s VAL 89 Ca 0.23 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.24 2jk0 s VAL 89 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 36.38 36.11 2jk0 s VAL 89 CO 0.16 0.12 -0.15 -0.69 0.00 0.00 0.00 175.10 174.54 2jk0 s VAL 90 N 0.69 2.83 -0.29 2.92 1.01 0.03 -0.81 120.40 126.78 2jk0 s VAL 90 Ca -0.07 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 2jk0 s VAL 90 Cb -0.10 -2.17 0.04 0.00 0.00 0.00 0.00 36.38 34.15 2jk0 s VAL 90 CO -0.01 0.53 -0.01 -0.63 0.00 0.00 0.00 175.10 174.98 2jk0 s ILE 91 N 0.42 3.01 0.11 2.22 1.01 0.13 -0.85 121.20 127.25 2jk0 s ILE 91 Ca -0.11 -1.30 -0.31 0.00 0.00 0.00 0.00 60.65 58.93 2jk0 s ILE 91 Cb -0.16 -2.69 -0.07 0.00 0.01 0.00 0.00 42.46 39.54 2jk0 s ILE 91 CO 0.05 -0.05 1.29 -0.89 0.00 0.00 0.00 174.94 175.34 2jk0 s THR 92 N 1.27 3.57 0.00 2.92 2.01 -0.41 -0.60 115.64 124.41 2jk0 s THR 92 Ca -0.04 1.17 -0.27 0.00 0.31 0.00 0.00 61.69 62.85 2jk0 s THR 92 Cb -0.19 -3.75 0.06 0.00 0.01 0.00 0.00 72.50 68.64 2jk0 s THR 92 CO -0.01 0.11 0.62 -2.28 -0.69 0.00 0.00 174.62 172.37 2jk0 s HIS 93 N 0.84 -0.58 1.27 4.92 5.04 -0.75 -0.83 115.29 125.21 2jk0 s HIS 93 Ca 0.60 0.85 -0.20 0.00 -1.54 0.00 0.00 55.06 54.77 2jk0 s HIS 93 Cb -0.34 0.41 0.31 0.00 0.04 0.00 0.00 32.58 33.00 2jk0 s HIS 93 CO 0.32 -0.64 1.04 0.20 -2.34 0.00 0.00 174.74 173.32 2jk0 s GLY 94 N -1.58 1.52 -0.04 1.59 0.00 -1.24 -4.29 107.32 103.27 2jk0 s GLY 94 Ca -0.08 -0.86 0.15 0.00 0.00 0.00 0.00 44.72 43.93 2jk0 s GLY 94 CO 0.04 0.06 0.29 -1.30 0.00 0.00 0.00 173.10 172.18 2jk0 n THR 95 N -5.06 0.17 0.28 0.90 -2.24 -1.26 -4.02 114.28 103.04 2jk0 n THR 95 Ca 0.12 -0.39 0.16 0.00 -2.27 0.00 0.00 64.05 61.67 2jk0 n THR 95 Cb 0.59 0.02 0.79 0.00 -2.10 0.00 0.00 70.33 69.63 2jk0 n THR 95 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2jk0 h ASP 96 N 0.00 0.00 0.00 3.42 3.32 -1.95 -3.01 116.42 118.21 2jk0 h ASP 96 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2jk0 h ASP 96 Cb 0.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.45 2jk0 h ASP 96 CO 0.00 0.00 0.00 0.41 -1.72 0.00 0.00 179.24 177.93 2jk0 n THR 97 N -2.66 0.02 0.08 0.35 -1.04 -1.26 -4.73 114.28 105.05 2jk0 n THR 97 Ca -0.01 -0.04 0.01 0.00 -2.04 0.00 0.00 64.05 61.97 2jk0 n THR 97 Cb 0.13 1.53 0.04 0.00 -1.82 0.00 0.00 70.33 70.21 2jk0 n THR 97 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2jk0 n LEU 98 N -0.01 0.00 -0.16 -4.42 0.00 -1.14 -0.70 117.00 110.57 2jk0 n LEU 98 Ca 0.00 0.32 -0.09 0.00 0.00 0.00 0.00 56.01 56.24 2jk0 n LEU 98 Cb 0.34 -0.32 0.04 0.00 0.00 0.00 0.00 43.42 43.49 2jk0 n LEU 98 CO 0.00 -0.30 0.76 0.44 0.00 0.00 0.00 177.39 178.28 2jk0 h ASP 99 N 0.00 0.97 0.00 1.96 5.19 -1.85 -3.39 116.42 119.30 2jk0 h ASP 99 Ca 0.00 -0.32 -0.43 0.00 -0.62 0.00 0.00 57.03 55.67 2jk0 h ASP 99 Cb 0.02 -0.26 -0.07 0.00 0.18 0.00 0.00 39.33 39.20 2jk0 h ASP 99 CO 0.00 1.09 -2.44 -1.84 -3.12 0.00 0.00 179.24 172.93 2jk0 n GLU 100 N -4.14 0.61 -0.26 3.56 0.00 0.12 -4.26 120.64 116.27 2jk0 n GLU 100 Ca 0.01 0.25 -0.01 0.00 0.00 0.00 0.00 57.16 57.41 2jk0 n GLU 100 Cb 0.40 -1.52 0.11 0.00 0.00 0.00 0.00 31.44 30.42 2jk0 n GLU 100 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 2jk0 h SER 101 N -0.67 0.69 -0.17 -1.84 0.02 -1.75 0.92 113.55 110.75 2jk0 h SER 101 Ca -0.64 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.22 2jk0 h SER 101 Cb 1.70 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 64.10 2jk0 h SER 101 CO -0.30 0.45 -0.27 -0.65 -1.14 0.00 0.00 176.83 174.92 2jk0 h PRO 102 N 0.83 0.64 -0.65 3.45 0.11 -1.81 -2.04 132.00 132.52 2jk0 h PRO 102 Ca 0.32 -0.27 -0.05 0.00 0.11 0.00 0.00 66.00 66.12 2jk0 h PRO 102 Cb 0.15 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.20 2jk0 h PRO 102 CO -0.16 0.84 0.22 -0.92 -0.21 0.00 0.00 178.00 177.77 2jk0 h TYR 103 N 0.56 1.01 0.13 0.65 3.20 -1.51 0.27 116.97 121.29 2jk0 h TYR 103 Ca 0.07 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2jk0 h TYR 103 Cb 0.75 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 2jk0 h TYR 103 CO 0.03 0.80 -0.32 0.35 -1.64 0.00 0.00 178.16 177.39 2jk0 h PHE 104 N 0.96 -0.87 -0.05 -3.82 3.57 -0.55 -2.31 116.94 113.87 2jk0 h PHE 104 Ca 0.22 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.64 2jk0 h PHE 104 Cb 0.26 0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2jk0 h PHE 104 CO 0.02 -0.43 -0.43 -0.07 -2.23 0.00 0.00 178.31 175.17 2jk0 h LEU 105 N -0.55 0.11 -1.97 0.59 3.38 -1.03 -1.53 115.31 114.31 2jk0 h LEU 105 Ca 0.03 -0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.07 2jk0 h LEU 105 Cb 0.58 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2jk0 h LEU 105 CO -0.18 0.53 0.30 -1.13 0.09 0.00 0.00 178.44 178.04 2jk0 h ASN 106 N 0.09 0.03 0.50 -0.43 -1.24 -0.07 0.62 115.58 115.08 2jk0 h ASN 106 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.02 2jk0 h ASN 106 Cb 0.80 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.84 2jk0 h ASN 106 CO 0.06 0.02 -0.62 0.18 -1.29 0.00 0.00 177.43 175.78 2jk0 n LEU 107 N -4.42 0.58 0.00 0.34 4.77 -0.60 -0.92 117.00 116.75 2jk0 n LEU 107 Ca 0.07 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2jk0 n LEU 107 Cb 0.47 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2jk0 n LEU 107 CO 0.36 0.10 -0.12 1.07 -1.33 0.00 0.00 177.39 177.47 2jk0 n THR 108 N -1.64 0.00 -2.78 -5.08 5.66 -0.50 -4.27 114.28 105.67 2jk0 n THR 108 Ca 0.05 -0.09 -0.41 0.00 -3.05 0.00 0.00 64.05 60.55 2jk0 n THR 108 Cb 0.36 0.53 -0.04 0.00 -1.55 0.00 0.00 70.33 69.63 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 -0.66 4.59 -1.94 1.08 1.01 0.09 -4.68 120.40 119.90 2jk0 s VAL 109 Ca 0.00 1.97 0.26 0.00 0.00 0.00 0.00 61.98 64.21 2jk0 s VAL 109 Cb 0.00 -4.28 0.28 0.00 0.00 0.00 0.00 36.38 32.39 2jk0 s VAL 109 CO 0.00 0.31 1.54 0.29 0.00 0.00 0.00 175.10 177.24 2jk0 n LYS 110 N 2.93 1.05 -3.37 2.72 4.76 -1.26 -3.91 118.16 121.08 2jk0 n LYS 110 Ca 0.02 -0.66 -0.19 0.00 -2.87 0.00 0.00 58.31 54.61 2jk0 n LYS 110 Cb 0.50 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 32.19 2jk0 n LYS 110 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2jk0 s SER 111 N -2.40 5.54 -0.01 4.39 0.15 -1.26 -4.35 113.70 115.75 2jk0 s SER 111 Ca 0.26 -0.45 0.22 0.00 0.70 0.00 0.00 55.95 56.68 2jk0 s SER 111 Cb 0.19 -0.83 -0.28 0.00 -1.71 0.00 0.00 66.02 63.40 2jk0 s SER 111 CO 0.49 -0.59 0.65 -0.67 1.20 0.00 0.00 173.24 174.32 2jk0 n ASP 112 N -1.66 0.38 -4.74 5.45 2.03 -1.26 -4.04 116.55 112.71 2jk0 n ASP 112 Ca 0.04 -0.35 -0.34 0.00 0.52 0.00 0.00 54.79 54.66 2jk0 n ASP 112 Cb 0.60 1.59 0.07 0.00 -0.72 0.00 0.00 41.12 42.65 2jk0 n ASP 112 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2jk0 s LYS 113 N -3.33 2.45 -0.10 -0.67 1.02 -1.26 -1.85 119.74 116.01 2jk0 s LYS 113 Ca -0.02 1.66 -0.30 0.00 0.02 0.00 0.00 55.97 57.33 2jk0 s LYS 113 Cb 0.15 -1.88 -0.04 0.00 -0.52 0.00 0.00 37.83 35.54 2jk0 s LYS 113 CO 0.89 -1.57 1.43 -2.14 -0.92 0.00 0.00 175.35 173.04 2jk0 s PRO 114 N -3.88 4.22 -0.24 -1.68 0.02 -1.26 -4.83 135.00 127.35 2jk0 s PRO 114 Ca 0.73 1.91 -0.09 0.00 0.02 0.00 0.00 61.00 63.56 2jk0 s PRO 114 Cb -0.27 -3.83 -0.04 0.00 0.02 0.00 0.00 34.50 30.38 2jk0 s PRO 114 CO 0.42 -0.74 0.13 0.08 -0.33 0.00 0.00 177.00 176.55 2jk0 s VAL 115 N 3.57 4.96 -0.09 3.83 1.01 -1.26 -0.71 120.40 131.71 2jk0 s VAL 115 Ca 0.63 0.04 -0.00 0.00 0.00 0.00 0.00 61.98 62.65 2jk0 s VAL 115 Cb -0.27 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.81 2jk0 s VAL 115 CO 0.22 0.34 -0.05 -0.69 0.00 0.00 0.00 175.10 174.92 2jk0 s VAL 116 N 1.27 0.75 -0.05 2.92 1.01 0.01 -1.14 120.40 125.17 2jk0 s VAL 116 Ca 0.06 -0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.71 2jk0 s VAL 116 Cb -0.14 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 2jk0 s VAL 116 CO 0.05 0.32 0.57 -0.36 0.00 0.00 0.00 175.10 175.68 2jk0 s PHE 117 N 1.68 3.61 0.10 5.22 0.40 0.60 0.19 117.98 129.78 2jk0 s PHE 117 Ca 0.03 1.10 0.08 0.00 -0.60 0.00 0.00 56.93 57.54 2jk0 s PHE 117 Cb -0.13 -2.62 -0.03 0.00 0.51 0.00 0.00 43.02 40.75 2jk0 s PHE 117 CO -0.06 0.25 -0.22 0.54 0.70 0.00 0.00 175.22 176.43 2jk0 s VAL 118 N 0.24 1.79 0.32 -0.44 0.11 0.23 -1.41 120.40 121.26 2jk0 s VAL 118 Ca 0.30 -1.52 -0.17 0.00 -2.93 0.00 0.00 61.98 57.66 2jk0 s VAL 118 Cb -0.17 -1.61 0.03 0.00 -1.53 0.00 0.00 36.38 33.10 2jk0 s VAL 118 CO 0.15 0.01 0.71 0.00 -3.33 0.00 0.00 175.10 172.63 2jk0 s ALA 119 N -1.09 -0.80 -0.08 1.54 0.00 -1.25 -1.81 121.76 118.27 2jk0 s ALA 119 Ca 0.08 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.26 2jk0 s ALA 119 Cb -0.10 0.82 0.03 0.00 0.00 0.00 0.00 23.12 23.88 2jk0 s ALA 119 CO 0.04 -0.98 0.37 0.00 0.00 0.00 0.00 175.76 175.19 2jk0 s ALA 120 N -3.22 -0.94 -0.00 0.00 0.00 -1.26 -4.75 121.76 111.58 2jk0 s ALA 120 Ca 0.15 0.76 0.06 0.00 0.00 0.00 0.00 51.96 52.93 2jk0 s ALA 120 Cb -0.05 -0.26 -0.24 0.00 0.00 0.00 0.00 23.12 22.57 2jk0 s ALA 120 CO 0.10 -0.23 0.81 0.52 0.00 0.00 0.00 175.76 176.96 2jk0 h MET 121 N 4.57 0.09 -5.63 0.00 2.86 -1.92 -3.33 114.93 111.57 2jk0 h MET 121 Ca -0.28 -0.15 -0.66 0.00 -2.06 0.00 0.00 59.70 56.55 2jk0 h MET 121 Cb 1.18 0.06 -0.09 0.00 0.06 0.00 0.00 31.60 32.80 2jk0 h MET 121 CO 0.33 0.82 -0.51 1.03 1.06 0.00 0.00 176.91 179.65 2jk0 s ARG 122 N -2.62 3.48 0.76 1.72 0.52 -1.26 -5.00 118.95 116.55 2jk0 s ARG 122 Ca -0.06 -0.19 -0.11 0.00 -0.52 0.00 0.00 55.73 54.84 2jk0 s ARG 122 Cb 0.08 -3.16 0.05 0.00 0.52 0.00 0.00 34.95 32.45 2jk0 s ARG 122 CO 0.83 0.69 1.10 -1.25 0.02 0.00 0.00 175.30 176.69 2jk0 s PRO 123 N -0.79 2.24 0.54 3.54 0.04 -1.26 -4.40 135.00 134.92 2jk0 s PRO 123 Ca 0.13 1.27 0.37 0.00 0.04 0.00 0.00 61.00 62.81 2jk0 s PRO 123 Cb -0.12 -1.89 1.56 0.00 0.04 0.00 0.00 34.50 34.09 2jk0 s PRO 123 CO 0.03 -1.66 1.79 0.00 0.04 0.00 0.00 177.00 177.20 2jk0 h ALA 124 N -0.94 3.15 -0.96 8.56 0.00 -1.66 -1.19 119.26 126.22 2jk0 h ALA 124 Ca -0.44 -0.04 -0.48 0.00 0.00 0.00 0.00 54.91 53.95 2jk0 h ALA 124 Cb 1.24 0.09 -0.29 0.00 0.00 0.00 0.00 17.79 18.83 2jk0 h ALA 124 CO 0.51 -1.50 0.60 2.41 0.00 0.00 0.00 179.25 181.27 2jk0 n THR 125 N -4.17 3.17 -4.04 0.00 -1.04 -1.26 -4.85 114.28 102.09 2jk0 n THR 125 Ca 0.26 -1.90 -0.27 0.00 -2.04 0.00 0.00 64.05 60.11 2jk0 n THR 125 Cb 1.28 -0.45 -0.05 0.00 -1.82 0.00 0.00 70.33 69.29 2jk0 n THR 125 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jk0 s ALA 126 N -3.26 3.70 -0.04 2.41 0.00 -0.45 -4.44 121.76 119.67 2jk0 s ALA 126 Ca 0.57 -1.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.09 2jk0 s ALA 126 Cb 0.47 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.04 2jk0 s ALA 126 CO 0.11 0.54 1.45 -1.50 0.00 0.00 0.00 175.76 176.37 2jk0 s ILE 127 N -1.71 3.76 -1.13 0.00 2.07 -1.26 -2.76 121.20 120.16 2jk0 s ILE 127 Ca 0.32 1.05 -0.01 0.00 -1.41 0.00 0.00 60.65 60.60 2jk0 s ILE 127 Cb -0.11 -3.68 0.00 0.00 0.13 0.00 0.00 42.46 38.81 2jk0 s ILE 127 CO 0.25 -0.04 0.95 -1.20 -1.91 0.00 0.00 174.94 172.98 2jk0 n SER 128 N 6.09 -2.30 -4.73 4.50 7.64 -1.26 -4.95 113.62 118.60 2jk0 n SER 128 Ca 0.14 -0.58 -0.42 0.00 1.01 0.00 0.00 58.87 59.03 2jk0 n SER 128 Cb 0.43 -4.83 -0.03 0.00 -1.01 0.00 0.00 64.21 58.77 2jk0 n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jk0 s ALA 129 N -3.33 3.58 -0.61 -0.43 0.00 -1.11 -4.92 121.76 114.93 2jk0 s ALA 129 Ca 0.04 1.17 0.25 0.00 0.00 0.00 0.00 51.96 53.41 2jk0 s ALA 129 Cb -0.02 -3.52 0.60 0.00 0.00 0.00 0.00 23.12 20.18 2jk0 s ALA 129 CO 0.68 -0.61 1.68 0.38 0.00 0.00 0.00 175.76 177.90 2jk0 h ASP 130 N 5.91 0.00 -0.08 0.00 2.03 -1.89 -3.38 116.42 119.02 2jk0 h ASP 130 Ca -0.44 -0.01 0.04 0.00 -0.73 0.00 0.00 57.03 55.89 2jk0 h ASP 130 Cb 1.21 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.66 2jk0 h ASP 130 CO 0.81 0.00 -0.27 1.23 -1.03 0.00 0.00 179.24 179.99 2jk0 h GLY 131 N 4.31 -0.36 0.08 7.15 0.00 -1.85 -0.31 103.07 112.08 2jk0 h GLY 131 Ca 0.00 0.33 0.10 0.00 0.00 0.00 0.00 47.33 47.76 2jk0 h GLY 131 CO 0.00 -0.21 -0.06 -2.55 0.00 0.00 0.00 176.54 173.72 2jk0 h PRO 132 N -0.37 0.05 -0.25 4.80 0.11 -1.96 0.19 132.00 134.58 2jk0 h PRO 132 Ca 0.08 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.03 2jk0 h PRO 132 Cb 0.49 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.59 2jk0 h PRO 132 CO -0.29 0.04 -0.47 1.98 -0.21 0.00 0.00 178.00 179.05 2jk0 h MET 133 N 0.05 0.75 -0.49 1.05 1.85 -1.79 -2.15 114.93 114.22 2jk0 h MET 133 Ca 0.25 -0.48 0.06 0.00 -0.61 0.00 0.00 59.70 58.92 2jk0 h MET 133 Cb 0.38 0.06 -0.05 0.00 0.43 0.00 0.00 31.60 32.42 2jk0 h MET 133 CO -0.47 1.10 0.20 -0.91 -0.40 0.00 0.00 176.91 176.43 2jk0 h ASN 134 N 0.49 0.24 -0.64 1.39 2.35 -0.47 0.42 115.58 119.35 2jk0 h ASN 134 Ca 0.01 0.05 0.01 0.00 -0.55 0.00 0.00 56.30 55.82 2jk0 h ASN 134 Cb 1.07 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.42 2jk0 h ASN 134 CO 0.10 0.17 0.43 0.25 -1.65 0.00 0.00 177.43 176.73 2jk0 h LEU 135 N 0.40 0.74 0.10 1.61 5.85 -0.55 0.82 115.31 124.28 2jk0 h LEU 135 Ca 0.23 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 2jk0 h LEU 135 Cb 0.21 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2jk0 h LEU 135 CO -0.21 0.53 -0.05 0.22 -0.34 0.00 0.00 178.44 178.60 2jk0 h TYR 136 N 0.87 -0.13 -0.73 1.25 3.20 -0.76 -1.42 116.97 119.25 2jk0 h TYR 136 Ca 0.24 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.19 2jk0 h TYR 136 Cb -0.10 0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.14 2jk0 h TYR 136 CO -0.03 0.01 0.38 0.78 -1.64 0.00 0.00 178.16 177.66 2jk0 h GLY 137 N -0.24 1.11 1.29 1.82 0.00 -0.69 -1.18 103.07 105.18 2jk0 h GLY 137 Ca -0.01 -0.25 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 2jk0 h GLY 137 CO 0.02 0.09 0.07 0.00 0.00 0.00 0.00 176.54 176.72 2jk0 h ALA 138 N 1.43 1.11 -0.06 3.60 0.00 -0.54 0.49 119.26 125.27 2jk0 h ALA 138 Ca 0.35 -0.24 -0.23 0.00 0.00 0.00 0.00 54.91 54.79 2jk0 h ALA 138 Cb 0.34 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.93 2jk0 h ALA 138 CO -0.25 0.58 -0.89 0.28 0.00 0.00 0.00 179.25 178.97 2jk0 h VAL 139 N 0.83 1.31 -0.08 0.00 2.07 -1.00 -1.39 116.25 118.00 2jk0 h VAL 139 Ca 0.17 -2.17 -0.00 0.00 0.82 0.00 0.00 66.70 65.51 2jk0 h VAL 139 Cb 0.39 2.21 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 2jk0 h VAL 139 CO 0.01 0.67 0.04 0.50 0.02 0.00 0.00 177.57 178.81 2jk0 h LYS 140 N 0.40 0.11 -0.13 1.57 3.64 -0.99 0.16 116.57 121.34 2jk0 h LYS 140 Ca -0.08 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2jk0 h LYS 140 Cb 1.52 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.30 2jk0 h LYS 140 CO 0.17 0.20 -0.04 0.28 -2.27 0.00 0.00 179.45 177.79 2jk0 h VAL 141 N -0.00 0.85 -0.53 2.00 2.07 -0.94 -1.99 116.25 117.71 2jk0 h VAL 141 Ca 0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.57 2jk0 h VAL 141 Cb 0.12 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2jk0 h VAL 141 CO -0.00 0.00 0.35 0.00 0.02 0.00 0.00 177.57 177.94 2jk0 h ALA 142 N 1.11 1.68 0.00 1.67 0.00 -0.95 -2.53 119.26 120.24 2jk0 h ALA 142 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jk0 h ALA 142 Cb 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2jk0 h ALA 142 CO -0.14 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.38 2jk0 n ALA 143 N -2.46 2.17 -2.60 0.00 0.00 0.54 -4.44 120.51 113.72 2jk0 n ALA 143 Ca 0.05 -0.03 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 2jk0 n ALA 143 Cb 0.10 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.07 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 -4.01 7.23 0.22 0.00 -1.08 -0.88 -4.85 116.67 113.30 2jk0 s ASP 144 Ca 0.10 1.74 0.09 0.00 -0.52 0.00 0.00 52.55 53.96 2jk0 s ASP 144 Cb 0.13 -2.57 0.17 0.00 -1.46 0.00 0.00 42.92 39.20 2jk0 s ASP 144 CO 0.53 -0.40 1.50 0.11 0.52 0.00 0.00 175.17 177.44 2jk0 h LYS 145 N 6.96 0.03 0.00 4.34 1.57 -1.87 -2.62 116.57 124.98 2jk0 h LYS 145 Ca -0.38 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2jk0 h LYS 145 Cb 1.19 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2jk0 h LYS 145 CO 0.81 0.75 0.00 -1.71 -0.57 0.00 0.00 179.45 178.73 2jk0 n ASN 146 N -3.68 0.00 -0.08 0.86 5.15 -1.26 -2.02 115.26 114.24 2jk0 n ASN 146 Ca -0.01 0.32 0.14 0.00 -0.60 0.00 0.00 54.58 54.43 2jk0 n ASN 146 Cb 0.72 -0.36 0.56 0.00 -0.53 0.00 0.00 39.78 40.16 2jk0 n ASN 146 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2jk0 n SER 147 N -1.36 0.39 -4.83 1.20 7.64 -0.99 -4.93 113.62 110.75 2jk0 n SER 147 Ca 0.02 -0.33 -0.31 0.00 1.01 0.00 0.00 58.87 59.26 2jk0 n SER 147 Cb 0.04 -0.10 0.05 0.00 -1.01 0.00 0.00 64.21 63.19 2jk0 n SER 147 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2jk0 s ARG 148 N -2.65 2.89 -1.18 1.43 0.52 -0.86 -3.98 118.95 115.13 2jk0 s ARG 148 Ca 0.23 0.85 0.00 0.00 -0.52 0.00 0.00 55.73 56.29 2jk0 s ARG 148 Cb 0.19 -1.99 0.00 0.00 0.52 0.00 0.00 34.95 33.67 2jk0 s ARG 148 CO 0.52 -1.10 0.00 0.41 0.02 0.00 0.00 175.30 175.15 2jk0 n GLY 149 N -2.17 1.21 0.37 -3.53 0.00 -0.77 -4.86 105.19 95.44 2jk0 n GLY 149 Ca 0.07 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.35 1.68 0.00 1.61 1.74 -1.26 -5.00 116.66 113.08 2jk0 n ARG 150 Ca -0.11 -0.85 0.00 0.00 -0.77 0.00 0.00 57.85 56.12 2jk0 n ARG 150 Cb 0.40 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 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 1.05 -0.93 3.77 -0.13 0.00 -1.26 -4.63 105.19 103.07 2jk0 n GLY 151 Ca 0.06 -1.67 -0.39 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.43 3.09 0.09 1.61 1.01 -1.26 -4.75 120.40 118.77 2jk0 s VAL 152 Ca 0.00 0.94 0.06 0.00 0.00 0.00 0.00 61.98 62.98 2jk0 s VAL 152 Cb 0.00 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2jk0 s VAL 152 CO 0.00 0.10 -0.06 -0.76 0.00 0.00 0.00 175.10 174.38 2jk0 s LEU 153 N -2.41 3.20 -0.18 3.92 1.43 -0.29 -2.22 118.68 122.12 2jk0 s LEU 153 Ca 0.56 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 2jk0 s LEU 153 Cb -0.32 -1.95 0.04 0.00 0.03 0.00 0.00 46.19 43.99 2jk0 s LEU 153 CO 0.40 0.19 -0.09 -0.69 0.23 0.00 0.00 176.35 176.39 2jk0 s VAL 154 N -1.22 1.44 -0.23 -1.59 1.01 0.86 -0.29 120.40 120.38 2jk0 s VAL 154 Ca 0.22 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2jk0 s VAL 154 Cb -0.11 -1.54 0.02 0.00 0.00 0.00 0.00 36.38 34.75 2jk0 s VAL 154 CO 0.14 0.18 -0.10 -0.69 0.00 0.00 0.00 175.10 174.64 2jk0 s VAL 155 N 1.49 2.70 0.05 2.92 1.01 -0.50 0.08 120.40 128.16 2jk0 s VAL 155 Ca 0.00 -0.95 -0.20 0.00 0.00 0.00 0.00 61.98 60.82 2jk0 s VAL 155 Cb -0.16 -2.31 0.05 0.00 0.00 0.00 0.00 36.38 33.96 2jk0 s VAL 155 CO -0.08 0.31 0.47 -0.76 0.00 0.00 0.00 175.10 175.04 2jk0 s LEU 156 N 1.33 0.13 -1.39 3.92 1.02 -1.10 -3.95 118.68 118.63 2jk0 s LEU 156 Ca 0.02 0.07 -0.08 0.00 0.02 0.00 0.00 54.13 54.16 2jk0 s LEU 156 Cb -0.15 1.97 0.05 0.00 0.02 0.00 0.00 46.19 48.07 2jk0 s LEU 156 CO -0.06 -0.71 0.56 -3.20 0.02 0.00 0.00 176.35 172.95 2jk0 n ASN 157 N 0.38 -4.68 0.00 2.29 5.15 -1.26 -1.52 115.26 115.62 2jk0 n ASN 157 Ca -0.18 -0.36 0.00 0.00 -0.60 0.00 0.00 54.58 53.44 2jk0 n ASN 157 Cb 0.60 -3.82 0.00 0.00 -0.53 0.00 0.00 39.78 36.03 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 -2.40 -3.38 -4.47 1.20 8.00 -1.26 -5.01 116.55 109.23 2jk0 n ASP 158 Ca -0.05 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.14 2jk0 n ASP 158 Cb 0.57 -1.09 -0.13 0.00 -0.02 0.00 0.00 41.12 40.46 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 -0.41 2.19 -0.36 -1.24 1.81 -0.58 -0.69 118.95 119.67 2jk0 s ARG 159 Ca 0.00 -0.91 -0.02 0.00 -1.72 0.00 0.00 55.73 53.08 2jk0 s ARG 159 Cb 0.00 -2.24 0.09 0.00 -0.45 0.00 0.00 34.95 32.34 2jk0 s ARG 159 CO 0.00 0.56 0.11 0.42 -0.68 0.00 0.00 175.30 175.71 2jk0 s ILE 160 N -0.89 3.07 0.11 1.52 1.01 0.24 -2.71 121.20 123.55 2jk0 s ILE 160 Ca 0.14 -1.85 0.02 0.00 0.00 0.00 0.00 60.65 58.97 2jk0 s ILE 160 Cb -0.11 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 2jk0 s ILE 160 CO 0.05 -0.47 0.19 -0.83 0.00 0.00 0.00 174.94 173.88 2jk0 s GLY 161 N 1.51 1.94 0.27 6.18 0.00 0.11 -0.79 107.32 116.54 2jk0 s GLY 161 Ca 0.04 -0.99 -0.29 0.00 0.00 0.00 0.00 44.72 43.48 2jk0 s GLY 161 CO -0.03 -0.98 0.95 -0.45 0.00 0.00 0.00 173.10 172.59 2jk0 s SER 162 N -2.79 7.51 0.56 1.64 0.15 -1.26 -0.10 113.70 119.41 2jk0 s SER 162 Ca 0.33 1.94 0.25 0.00 0.70 0.00 0.00 55.95 59.17 2jk0 s SER 162 Cb -0.12 -2.60 1.53 0.00 -1.71 0.00 0.00 66.02 63.12 2jk0 s SER 162 CO 0.26 0.06 2.12 0.00 1.20 0.00 0.00 173.24 176.87 2jk0 h ALA 163 N 3.79 1.95 0.00 5.45 0.00 -1.78 -0.58 119.26 128.09 2jk0 h ALA 163 Ca -0.46 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 2jk0 h ALA 163 Cb 1.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2jk0 h ALA 163 CO 0.67 -0.25 -0.28 -0.09 0.00 0.00 0.00 179.25 179.30 2jk0 h ARG 164 N 0.00 0.00 0.00 0.00 9.65 -1.91 -3.37 114.38 118.75 2jk0 h ARG 164 Ca 0.08 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.95 2jk0 h ARG 164 Cb 0.39 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.97 2jk0 h ARG 164 CO -0.00 0.28 -1.07 1.19 2.80 0.00 0.00 179.97 183.17 2jk0 n PHE 165 N -3.32 0.00 -2.52 2.20 0.99 -0.63 -4.95 117.46 109.23 2jk0 n PHE 165 Ca 0.01 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.04 2jk0 n PHE 165 Cb 0.52 -0.05 -0.03 0.00 -1.00 0.00 0.00 39.48 38.92 2jk0 n PHE 165 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2jk0 s ILE 166 N -2.02 4.20 0.18 4.37 -1.09 -0.32 -4.64 121.20 121.88 2jk0 s ILE 166 Ca -0.01 1.66 -0.04 0.00 -2.23 0.00 0.00 60.65 60.03 2jk0 s ILE 166 Cb 0.00 -4.06 -0.03 0.00 -1.58 0.00 0.00 42.46 36.79 2jk0 s ILE 166 CO 0.03 0.17 0.18 -0.94 -1.23 0.00 0.00 174.94 173.16 2jk0 s SER 167 N 0.73 0.14 -0.39 3.58 1.04 -1.14 -4.76 113.70 112.90 2jk0 s SER 167 Ca 0.54 -1.20 -0.29 0.00 0.48 0.00 0.00 55.95 55.49 2jk0 s SER 167 Cb -0.27 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.25 2jk0 s SER 167 CO 0.30 -0.86 1.32 -0.75 0.98 0.00 0.00 173.24 174.24 2jk0 s LYS 168 N -4.08 3.71 -0.02 4.02 2.20 -1.26 -2.57 119.74 121.75 2jk0 s LYS 168 Ca 0.29 0.96 0.17 0.00 -0.36 0.00 0.00 55.97 57.03 2jk0 s LYS 168 Cb 0.06 -3.96 -0.24 0.00 -1.51 0.00 0.00 37.83 32.18 2jk0 s LYS 168 CO 0.07 -1.39 0.49 0.25 -0.36 0.00 0.00 175.35 174.41 2jk0 n THR 169 N 6.76 0.00 -4.98 3.43 -2.24 -0.65 -4.94 114.28 111.66 2jk0 n THR 169 Ca 0.15 -0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.36 2jk0 n THR 169 Cb 0.48 0.40 -0.16 0.00 -2.10 0.00 0.00 70.33 68.95 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 -3.53 2.36 0.28 3.42 3.84 -1.24 -5.05 114.94 115.02 2jk0 s ASN 170 Ca -0.02 -0.36 -0.03 0.00 0.21 0.00 0.00 52.86 52.66 2jk0 s ASN 170 Cb 0.12 -0.28 0.40 0.00 -0.55 0.00 0.00 41.25 40.93 2jk0 s ASN 170 CO 0.71 0.24 1.92 0.00 -2.79 0.00 0.00 177.10 177.18 2jk0 h ALA 171 N 5.67 1.33 0.00 1.71 0.00 -1.96 -3.38 119.26 122.63 2jk0 h ALA 171 Ca -0.38 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2jk0 h ALA 171 Cb 1.14 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2jk0 h ALA 171 CO 0.48 0.56 0.00 0.43 0.00 0.00 0.00 179.25 180.72 2jk0 n SER 172 N -4.37 0.69 -4.91 0.00 7.64 -1.26 -5.10 113.62 106.31 2jk0 n SER 172 Ca 0.08 -1.23 -0.28 0.00 1.01 0.00 0.00 58.87 58.46 2jk0 n SER 172 Cb 0.08 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 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 -0.23 5.04 0.30 0.44 -4.23 -1.26 -4.99 115.64 110.72 2jk0 s THR 173 Ca 0.00 -0.01 0.23 0.00 -1.18 0.00 0.00 61.69 60.73 2jk0 s THR 173 Cb 0.00 -3.75 0.23 0.00 1.34 0.00 0.00 72.50 70.32 2jk0 s THR 173 CO 0.00 -0.35 1.93 -0.07 -0.54 0.00 0.00 174.62 175.58 2jk0 h LEU 174 N 1.57 0.00 -3.15 4.79 3.38 -1.98 -2.95 115.31 116.97 2jk0 h LEU 174 Ca -0.48 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 2jk0 h LEU 174 Cb 1.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2jk0 h LEU 174 CO 0.66 0.22 0.01 -0.90 0.09 0.00 0.00 178.44 178.51 2jk0 n ASP 175 N -3.62 4.97 -0.27 -0.43 5.75 -1.26 -4.63 116.55 117.05 2jk0 n ASP 175 Ca -0.01 -2.79 0.09 0.00 -0.01 0.00 0.00 54.79 52.07 2jk0 n ASP 175 Cb 0.35 -0.66 0.23 0.00 -1.03 0.00 0.00 41.12 40.01 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 3.32 0.44 -3.54 2.12 2.02 -1.82 -3.40 112.91 112.05 2jk0 h THR 176 Ca 0.01 -0.09 -0.56 0.00 0.77 0.00 0.00 66.41 66.53 2jk0 h THR 176 Cb 1.76 0.15 -0.06 0.00 -1.74 0.00 0.00 68.15 68.26 2jk0 h THR 176 CO 0.42 0.05 0.95 -0.36 0.37 0.00 0.00 175.52 176.95 2jk0 s PHE 177 N -6.00 2.77 0.11 3.16 0.40 -1.26 -1.64 117.98 115.53 2jk0 s PHE 177 Ca -0.12 0.78 -0.05 0.00 -0.60 0.00 0.00 56.93 56.94 2jk0 s PHE 177 Cb 0.23 -4.28 -0.02 0.00 0.51 0.00 0.00 43.02 39.46 2jk0 s PHE 177 CO 0.76 -1.37 0.12 0.15 0.70 0.00 0.00 175.22 175.58 2jk0 s LYS 178 N 4.42 0.89 -0.43 0.44 1.02 -1.06 -4.94 119.74 120.08 2jk0 s LYS 178 Ca 0.51 -1.22 0.05 0.00 0.02 0.00 0.00 55.97 55.32 2jk0 s LYS 178 Cb -0.10 0.29 0.17 0.00 -0.52 0.00 0.00 37.83 37.68 2jk0 s LYS 178 CO 0.29 -0.27 0.45 0.00 -0.92 0.00 0.00 175.35 174.91 2jk0 s ALA 179 N -3.96 0.07 0.24 5.17 0.00 -1.26 -2.88 121.76 119.14 2jk0 s ALA 179 Ca 0.14 -1.60 -0.10 0.00 0.00 0.00 0.00 51.96 50.40 2jk0 s ALA 179 Cb 0.06 -1.99 0.35 0.00 0.00 0.00 0.00 23.12 21.54 2jk0 s ALA 179 CO -0.04 -2.08 1.61 -1.35 0.00 0.00 0.00 175.76 173.90 2jk0 h PRO 180 N 5.75 0.02 0.00 0.00 0.11 -1.91 0.24 132.00 136.21 2jk0 h PRO 180 Ca 0.17 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 2jk0 h PRO 180 Cb 0.99 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 2jk0 h PRO 180 CO 0.23 0.01 -0.04 0.93 -0.21 0.00 0.00 178.00 178.93 2jk0 h GLU 181 N 0.02 0.00 0.00 1.05 4.39 -1.98 -3.36 114.58 114.71 2jk0 h GLU 181 Ca 0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.08 2jk0 h GLU 181 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 2jk0 h GLU 181 CO -0.75 0.04 0.00 0.39 -1.16 0.00 0.00 179.01 177.53 2jk0 n GLU 182 N -3.12 -0.56 0.00 2.33 4.71 -0.30 -5.12 120.64 118.58 2jk0 n GLU 182 Ca 0.03 -0.38 0.00 0.00 -0.01 0.00 0.00 57.16 56.80 2jk0 n GLU 182 Cb 0.47 -0.84 0.00 0.00 -1.01 0.00 0.00 31.44 30.06 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 -0.02 0.78 3.60 0.62 0.00 0.68 -4.75 105.19 106.10 2jk0 n GLY 183 Ca 0.00 -0.84 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 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 2.86 0.36 1.61 1.51 -1.26 -4.45 117.35 117.99 2jk0 s TYR 184 Ca 0.00 -0.06 0.05 0.00 -1.01 0.00 0.00 57.07 56.04 2jk0 s TYR 184 Cb 0.00 -1.57 0.72 0.00 -0.11 0.00 0.00 41.96 41.00 2jk0 s TYR 184 CO 0.00 0.39 1.99 -0.07 -1.11 0.00 0.00 175.55 176.75 2jk0 h LEU 185 N 4.25 0.66 0.00 -1.29 3.38 -1.22 -3.41 115.31 117.69 2jk0 h LEU 185 Ca -0.48 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2jk0 h LEU 185 Cb 1.17 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2jk0 h LEU 185 CO 0.54 0.45 0.00 0.61 0.09 0.00 0.00 178.44 180.13 2jk0 n GLY 186 N -1.45 1.19 3.25 0.83 0.00 -0.82 -0.86 105.19 107.33 2jk0 n GLY 186 Ca 0.08 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.34 0.02 -0.27 1.61 1.01 -0.17 -0.59 120.40 119.68 2jk0 s VAL 187 Ca 0.00 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2jk0 s VAL 187 Cb 0.00 -0.55 0.05 0.00 0.00 0.00 0.00 36.38 35.89 2jk0 s VAL 187 CO 0.00 -0.09 -0.08 -0.63 0.00 0.00 0.00 175.10 174.30 2jk0 s ILE 188 N -0.34 2.43 -0.02 2.22 1.01 0.13 0.62 121.20 127.25 2jk0 s ILE 188 Ca -0.05 -1.51 -0.00 0.00 0.00 0.00 0.00 60.65 59.09 2jk0 s ILE 188 Cb -0.03 -2.39 0.03 0.00 0.01 0.00 0.00 42.46 40.07 2jk0 s ILE 188 CO 0.02 -0.02 0.03 -0.63 0.00 0.00 0.00 174.94 174.34 2jk0 s ILE 189 N 1.16 -0.06 -1.45 2.92 -1.09 -0.58 -4.71 121.20 117.40 2jk0 s ILE 189 Ca -0.07 0.23 -0.08 0.00 -2.23 0.00 0.00 60.65 58.49 2jk0 s ILE 189 Cb -0.19 -0.08 0.02 0.00 -1.58 0.00 0.00 42.46 40.63 2jk0 s ILE 189 CO -0.04 0.09 0.95 0.61 -1.23 0.00 0.00 174.94 175.32 2jk0 n GLY 190 N 4.22 -0.53 3.58 6.18 0.00 -1.26 -2.17 105.19 115.20 2jk0 n GLY 190 Ca -0.27 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.81 -4.16 -3.86 1.61 2.03 -1.26 -5.00 116.55 103.10 2jk0 n ASP 191 Ca -0.02 -0.62 -0.12 0.00 0.52 0.00 0.00 54.79 54.55 2jk0 n ASP 191 Cb 0.57 -4.88 -0.13 0.00 -0.72 0.00 0.00 41.12 35.96 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 -5.96 0.08 -0.02 -0.67 -0.14 -0.92 -5.15 119.74 106.96 2jk0 s LYS 192 Ca 0.32 0.02 -0.18 0.00 -1.36 0.00 0.00 55.97 54.77 2jk0 s LYS 192 Cb -0.15 0.04 -0.05 0.00 -1.68 0.00 0.00 37.83 35.99 2jk0 s LYS 192 CO 0.75 -0.01 0.52 0.42 -0.76 0.00 0.00 175.35 176.26 2jk0 s ILE 193 N -0.10 4.98 -0.39 2.17 1.01 -1.26 -1.53 121.20 126.08 2jk0 s ILE 193 Ca -0.01 1.08 0.01 0.00 0.00 0.00 0.00 60.65 61.73 2jk0 s ILE 193 Cb -0.01 -3.85 0.12 0.00 0.01 0.00 0.00 42.46 38.73 2jk0 s ILE 193 CO 0.00 0.45 0.18 -0.31 0.00 0.00 0.00 174.94 175.26 2jk0 s TYR 194 N -0.34 2.04 0.14 3.97 1.51 0.20 -4.98 117.35 119.89 2jk0 s TYR 194 Ca 0.28 -2.25 -0.29 0.00 -1.01 0.00 0.00 57.07 53.80 2jk0 s TYR 194 Cb -0.17 -1.92 -0.07 0.00 -0.11 0.00 0.00 41.96 39.69 2jk0 s TYR 194 CO 0.15 -0.83 0.93 0.71 -1.11 0.00 0.00 175.55 175.40 2jk0 s TYR 195 N 0.82 3.86 0.00 2.71 1.51 -1.26 -0.99 117.35 123.99 2jk0 s TYR 195 Ca 0.14 1.79 0.00 0.00 -1.01 0.00 0.00 57.07 58.00 2jk0 s TYR 195 Cb -0.22 -3.00 0.00 0.00 -0.11 0.00 0.00 41.96 38.63 2jk0 s TYR 195 CO -0.09 0.30 0.00 1.04 -1.11 0.00 0.00 175.55 175.69 2jk0 n GLN 196 N 2.39 2.39 -3.83 -0.62 6.02 -0.04 -4.98 117.38 118.71 2jk0 n GLN 196 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2jk0 n GLN 196 Cb 0.49 -0.81 -0.11 0.00 1.02 0.00 0.00 30.24 30.83 2jk0 n GLN 196 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2jk0 s THR 197 N -1.45 0.04 -0.06 5.09 -1.32 -0.58 -5.05 115.64 112.31 2jk0 s THR 197 Ca 0.00 -0.30 0.06 0.00 -1.21 0.00 0.00 61.69 60.24 2jk0 s THR 197 Cb 0.00 -0.37 -0.01 0.00 -1.51 0.00 0.00 72.50 70.61 2jk0 s THR 197 CO 0.00 -0.17 -0.25 -0.13 -2.21 0.00 0.00 174.62 171.87 2jk0 s ARG 198 N -0.58 2.57 0.25 7.08 0.52 -1.26 -4.61 118.95 122.92 2jk0 s ARG 198 Ca -0.07 -0.90 -0.31 0.00 -0.52 0.00 0.00 55.73 53.93 2jk0 s ARG 198 Cb -0.04 -2.17 -0.12 0.00 0.52 0.00 0.00 34.95 33.13 2jk0 s ARG 198 CO 0.01 0.38 1.62 -0.11 0.02 0.00 0.00 175.30 177.22 2jk0 n LEU 199 N 2.96 4.00 -2.98 2.53 0.00 -1.26 -4.92 117.00 117.32 2jk0 n LEU 199 Ca -0.17 1.11 -0.33 0.00 0.00 0.00 0.00 56.01 56.61 2jk0 n LEU 199 Cb 0.52 -1.56 0.00 0.00 0.00 0.00 0.00 43.42 42.39 2jk0 n LEU 199 CO 0.25 0.06 0.80 -0.67 0.00 0.00 0.00 177.39 177.84 2jk0 n ASP 200 N 2.90 5.97 -4.17 1.96 2.03 -1.26 -4.99 116.55 118.99 2jk0 n ASP 200 Ca 0.12 -3.73 -0.11 0.00 0.52 0.00 0.00 54.79 51.59 2jk0 n ASP 200 Cb 0.35 -0.80 -0.10 0.00 -0.72 0.00 0.00 41.12 39.85 2jk0 n ASP 200 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2jk0 s LYS 201 N -3.84 0.99 0.27 -0.67 -0.14 -1.26 -5.05 119.74 110.03 2jk0 s LYS 201 Ca 0.47 -1.48 -0.29 0.00 -1.36 0.00 0.00 55.97 53.31 2jk0 s LYS 201 Cb 0.33 0.17 -0.10 0.00 -1.68 0.00 0.00 37.83 36.55 2jk0 s LYS 201 CO -0.22 -0.26 1.30 0.08 -0.76 0.00 0.00 175.35 175.50 2jk0 s VAL 202 N -4.01 2.95 0.09 3.17 1.01 -0.57 -5.02 120.40 118.02 2jk0 s VAL 202 Ca 0.26 0.87 -0.26 0.00 0.00 0.00 0.00 61.98 62.86 2jk0 s VAL 202 Cb 0.07 -3.56 0.08 0.00 0.00 0.00 0.00 36.38 32.98 2jk0 s VAL 202 CO 0.03 0.17 0.77 -1.38 0.00 0.00 0.00 175.10 174.70 2jk0 s HIS 203 N -0.58 -0.40 0.00 5.22 -3.43 -1.26 -4.68 115.29 110.16 2jk0 s HIS 203 Ca 0.52 0.20 0.00 0.00 -0.80 0.00 0.00 55.06 54.98 2jk0 s HIS 203 Cb -0.38 0.56 0.00 0.00 -1.43 0.00 0.00 32.58 31.33 2jk0 s HIS 203 CO 0.46 -0.73 0.00 0.25 -2.00 0.00 0.00 174.74 172.72 2jk0 n THR 204 N -0.33 0.00 0.16 -5.38 -2.24 -0.09 -1.94 114.28 104.46 2jk0 n THR 204 Ca -0.12 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.71 2jk0 n THR 204 Cb 0.63 0.00 0.47 0.00 -2.10 0.00 0.00 70.33 69.33 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 1.13 0.00 4.28 1.35 -1.70 -2.64 112.91 115.33 2jk0 h THR 205 Ca 0.00 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2jk0 h THR 205 Cb 0.00 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 2jk0 h THR 205 CO 0.00 0.17 -0.50 0.54 -0.25 0.00 0.00 175.52 175.48 2jk0 n ARG 206 N -4.35 0.19 -2.27 4.72 3.00 -0.82 -4.92 116.66 112.21 2jk0 n ARG 206 Ca -0.01 0.06 -0.41 0.00 -0.01 0.00 0.00 57.85 57.48 2jk0 n ARG 206 Cb 0.21 -1.63 -0.03 0.00 0.00 0.00 0.00 32.46 31.01 2jk0 n ARG 206 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2jk0 s SER 207 N -3.81 6.98 0.00 0.55 0.15 -1.00 -4.81 113.70 111.76 2jk0 s SER 207 Ca 0.08 2.46 0.28 0.00 0.70 0.00 0.00 55.95 59.47 2jk0 s SER 207 Cb 0.15 -2.63 1.03 0.00 -1.71 0.00 0.00 66.02 62.86 2jk0 s SER 207 CO 0.69 -0.40 1.78 1.33 1.20 0.00 0.00 173.24 177.84 2jk0 n VAL 208 N 1.49 0.00 -2.66 4.45 0.24 -1.26 -4.87 118.33 115.71 2jk0 n VAL 208 Ca 0.01 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.34 61.89 2jk0 n VAL 208 Cb 0.43 -0.24 -0.03 0.00 -1.47 0.00 0.00 33.84 32.53 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 -2.92 3.65 -0.13 6.34 0.40 -1.26 -5.04 117.98 119.02 2jk0 s PHE 209 Ca 0.15 1.65 -0.04 0.00 -0.60 0.00 0.00 56.93 58.10 2jk0 s PHE 209 Cb 0.19 -3.16 0.05 0.00 0.51 0.00 0.00 43.02 40.60 2jk0 s PHE 209 CO 0.57 -0.20 0.07 0.34 0.70 0.00 0.00 175.22 176.70 2jk0 s ASP 210 N 0.83 1.98 -0.00 1.36 2.15 -1.26 -4.59 116.67 117.12 2jk0 s ASP 210 Ca 0.52 -0.38 0.19 0.00 0.43 0.00 0.00 52.55 53.31 2jk0 s ASP 210 Cb -0.23 -0.26 0.54 0.00 -0.30 0.00 0.00 42.92 42.67 2jk0 s ASP 210 CO 0.29 -0.30 1.45 1.33 -0.17 0.00 0.00 175.17 177.76 2jk0 n VAL 211 N 5.25 1.03 -0.17 1.11 0.24 -1.26 -4.55 118.33 119.99 2jk0 n VAL 211 Ca -0.06 -1.01 0.09 0.00 -2.04 0.00 0.00 64.34 61.32 2jk0 n VAL 211 Cb 0.49 0.48 0.41 0.00 -1.47 0.00 0.00 33.84 33.75 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 3.54 0.94 -0.32 3.34 2.02 -1.94 -2.59 112.91 117.89 2jk0 h THR 212 Ca 0.00 -0.22 -0.20 0.00 0.77 0.00 0.00 66.41 66.76 2jk0 h THR 212 Cb 0.92 0.26 -0.13 0.00 -1.74 0.00 0.00 68.15 67.46 2jk0 h THR 212 CO 0.01 0.11 -0.30 0.59 0.37 0.00 0.00 175.52 176.30 2jk0 n ASN 213 N -4.49 2.80 -4.36 4.18 4.13 -1.26 -4.98 115.26 111.28 2jk0 n ASN 213 Ca 0.12 -3.83 -0.34 0.00 1.68 0.00 0.00 54.58 52.21 2jk0 n ASN 213 Cb 0.33 -0.57 -0.14 0.00 -1.54 0.00 0.00 39.78 37.86 2jk0 n ASN 213 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2jk0 s VAL 214 N -3.53 3.18 -0.07 2.41 1.01 -0.98 -5.00 120.40 117.43 2jk0 s VAL 214 Ca 0.44 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.92 2jk0 s VAL 214 Cb 0.40 -2.37 -0.24 0.00 0.00 0.00 0.00 36.38 34.17 2jk0 s VAL 214 CO -0.02 0.50 0.56 0.47 0.00 0.00 0.00 175.10 176.61 2jk0 n ASP 215 N 3.89 1.05 -3.72 3.32 8.00 -1.26 -4.95 116.55 122.88 2jk0 n ASP 215 Ca -0.18 0.35 -0.12 0.00 0.71 0.00 0.00 54.79 55.55 2jk0 n ASP 215 Cb 0.52 -0.14 -0.12 0.00 -0.02 0.00 0.00 41.12 41.35 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 -2.58 0.25 0.35 -1.24 2.20 -1.26 -5.01 119.74 112.46 2jk0 s LYS 216 Ca -0.08 0.59 -0.10 0.00 -0.36 0.00 0.00 55.97 56.02 2jk0 s LYS 216 Cb 0.08 -0.10 -0.07 0.00 -1.51 0.00 0.00 37.83 36.23 2jk0 s LYS 216 CO 0.81 -0.16 0.70 -0.51 -0.36 0.00 0.00 175.35 175.83 2jk0 s LEU 217 N 1.29 3.94 0.50 5.43 1.43 -1.26 -5.05 118.68 124.96 2jk0 s LEU 217 Ca -0.09 1.04 -0.23 0.00 -1.03 0.00 0.00 54.13 53.82 2jk0 s LEU 217 Cb -0.10 -3.89 -0.06 0.00 0.03 0.00 0.00 46.19 42.17 2jk0 s LEU 217 CO -0.10 -0.30 1.29 -2.84 0.23 0.00 0.00 176.35 174.63 2jk0 s PRO 218 N -3.59 3.43 0.18 1.29 0.02 -1.26 -4.97 135.00 130.10 2jk0 s PRO 218 Ca 0.50 2.07 -0.30 0.00 0.02 0.00 0.00 61.00 63.28 2jk0 s PRO 218 Cb -0.10 -2.35 -0.07 0.00 0.02 0.00 0.00 34.50 31.99 2jk0 s PRO 218 CO 0.28 -0.91 1.01 0.00 -0.33 0.00 0.00 177.00 177.05 2jk0 s ALA 219 N -1.39 3.32 -0.02 -1.55 0.00 -1.26 -4.88 121.76 115.98 2jk0 s ALA 219 Ca 0.67 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 53.31 2jk0 s ALA 219 Cb -0.36 -3.29 0.03 0.00 0.00 0.00 0.00 23.12 19.50 2jk0 s ALA 219 CO 0.43 -0.03 0.02 0.08 0.00 0.00 0.00 175.76 176.27 2jk0 s VAL 220 N -0.47 -0.00 0.35 0.00 1.01 -1.26 -1.41 120.40 118.62 2jk0 s VAL 220 Ca 0.46 0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.72 2jk0 s VAL 220 Cb -0.26 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 2jk0 s VAL 220 CO 0.33 0.11 0.36 -1.81 0.00 0.00 0.00 175.10 174.09 2jk0 s ASP 221 N 1.17 5.40 -0.11 3.32 1.01 -1.02 -4.98 116.67 121.45 2jk0 s ASP 221 Ca -0.08 -0.47 0.00 0.00 0.71 0.00 0.00 52.55 52.71 2jk0 s ASP 221 Cb -0.13 -0.93 0.02 0.00 1.01 0.00 0.00 42.92 42.89 2jk0 s ASP 221 CO -0.03 -0.44 -0.11 -0.63 0.21 0.00 0.00 175.17 174.17 2jk0 s ILE 222 N -2.31 1.23 -0.17 0.77 1.01 -1.26 -1.21 121.20 119.26 2jk0 s ILE 222 Ca 0.44 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.60 2jk0 s ILE 222 Cb -0.06 -1.19 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 2jk0 s ILE 222 CO 0.28 0.40 -0.02 -0.63 0.00 0.00 0.00 174.94 174.96 2jk0 s ILE 223 N 1.40 3.95 0.47 2.92 1.09 -0.61 -4.97 121.20 125.46 2jk0 s ILE 223 Ca 0.01 -0.33 -0.21 0.00 -1.10 0.00 0.00 60.65 59.01 2jk0 s ILE 223 Cb -0.13 -2.75 -0.08 0.00 -1.06 0.00 0.00 42.46 38.44 2jk0 s ILE 223 CO -0.06 0.48 1.07 -0.47 -0.10 0.00 0.00 174.94 175.86 2jk0 s TYR 224 N 0.49 2.99 -0.16 3.97 5.04 -1.26 -0.01 117.35 128.41 2jk0 s TYR 224 Ca -0.03 1.58 -0.06 0.00 -2.44 0.00 0.00 57.07 56.13 2jk0 s TYR 224 Cb -0.14 -3.16 -0.04 0.00 0.35 0.00 0.00 41.96 38.98 2jk0 s TYR 224 CO 0.03 -0.99 0.03 0.20 -1.34 0.00 0.00 175.55 173.47 2jk0 s GLY 225 N -1.77 1.86 -0.05 8.97 0.00 -0.37 -4.81 107.32 111.15 2jk0 s GLY 225 Ca 0.66 -0.77 -0.31 0.00 0.00 0.00 0.00 44.72 44.31 2jk0 s GLY 225 CO 0.25 -0.09 1.01 -2.52 0.00 0.00 0.00 173.10 171.75 2jk0 s TYR 226 N 0.12 -0.25 0.23 1.90 -0.85 -1.26 -4.36 117.35 112.87 2jk0 s TYR 226 Ca 0.03 0.13 -0.31 0.00 -0.52 0.00 0.00 57.07 56.40 2jk0 s TYR 226 Cb -0.13 0.54 -0.14 0.00 0.38 0.00 0.00 41.96 42.61 2jk0 s TYR 226 CO 0.01 -0.45 1.24 1.04 -1.52 0.00 0.00 175.55 175.88 2jk0 n GLN 227 N -0.22 1.59 -2.76 -3.49 6.02 -1.26 -1.77 117.38 115.48 2jk0 n GLN 227 Ca -0.06 0.56 -0.21 0.00 -0.01 0.00 0.00 57.00 57.28 2jk0 n GLN 227 Cb 0.61 -2.11 0.02 0.00 1.02 0.00 0.00 30.24 29.78 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 1.89 -5.95 -4.69 1.08 8.00 -1.26 -4.94 116.55 110.69 2jk0 n ASP 228 Ca 0.12 -0.18 -0.42 0.00 0.71 0.00 0.00 54.79 55.02 2jk0 n ASP 228 Cb 0.29 -4.84 -0.03 0.00 -0.02 0.00 0.00 41.12 36.52 2jk0 n ASP 228 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2jk0 s ASP 229 N -2.47 6.81 0.34 -2.24 -4.77 -0.73 -4.97 116.67 108.65 2jk0 s ASP 229 Ca 0.18 2.16 -0.29 0.00 -3.30 0.00 0.00 52.55 51.30 2jk0 s ASP 229 Cb -0.08 -2.56 -0.11 0.00 -1.09 0.00 0.00 42.92 39.08 2jk0 s ASP 229 CO 0.23 -0.75 1.50 -2.16 0.70 0.00 0.00 175.17 174.69 2jk0 s PRO 230 N 2.53 4.14 0.46 2.11 0.04 -1.26 -4.68 135.00 138.35 2jk0 s PRO 230 Ca 0.65 2.53 0.26 0.00 0.04 0.00 0.00 61.00 64.48 2jk0 s PRO 230 Cb -0.32 -3.00 0.63 0.00 0.04 0.00 0.00 34.50 31.84 2jk0 s PRO 230 CO 0.27 -0.53 1.71 1.49 0.04 0.00 0.00 177.00 179.98 2jk0 h GLU 231 N 3.71 0.00 0.00 4.56 4.81 -1.93 -3.32 114.58 122.40 2jk0 h GLU 231 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2jk0 h GLU 231 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2jk0 h GLU 231 CO 0.70 0.03 0.00 2.48 -0.73 0.00 0.00 179.01 181.49 2jk0 n TYR 232 N -3.11 0.61 -0.08 0.92 0.18 -1.26 -2.70 117.16 111.71 2jk0 n TYR 232 Ca 0.03 0.22 -0.02 0.00 1.88 0.00 0.00 57.90 60.00 2jk0 n TYR 232 Cb 0.48 -0.85 0.23 0.00 -0.38 0.00 0.00 39.34 38.81 2jk0 n TYR 232 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 2jk0 h MET 233 N 0.00 0.71 -0.22 -3.48 2.86 -1.99 -2.45 114.93 110.37 2jk0 h MET 233 Ca 0.00 -0.15 -0.17 0.00 -2.06 0.00 0.00 59.70 57.32 2jk0 h MET 233 Cb 0.45 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 2jk0 h MET 233 CO 0.00 0.68 -0.54 1.88 1.06 0.00 0.00 176.91 179.99 2jk0 h TYR 234 N 0.68 0.80 -0.63 -0.22 -1.99 -1.78 -2.82 116.97 111.02 2jk0 h TYR 234 Ca 0.15 -0.28 0.05 0.00 2.00 0.00 0.00 58.73 60.64 2jk0 h TYR 234 Cb 0.32 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 38.86 2jk0 h TYR 234 CO 0.02 1.03 0.41 -0.44 -0.00 0.00 0.00 178.16 179.18 2jk0 h ASP 235 N 0.49 0.59 0.62 3.88 3.45 -1.51 0.52 116.42 124.47 2jk0 h ASP 235 Ca 0.01 -0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.44 2jk0 h ASP 235 Cb 1.10 -0.13 0.01 0.00 -0.56 0.00 0.00 39.33 39.74 2jk0 h ASP 235 CO 0.11 0.40 -0.30 0.00 -1.57 0.00 0.00 179.24 177.88 2jk0 h ALA 236 N 1.65 -1.10 -0.83 3.45 0.00 -1.20 0.15 119.26 121.38 2jk0 h ALA 236 Ca 0.26 -0.18 0.20 0.00 0.00 0.00 0.00 54.91 55.19 2jk0 h ALA 236 Cb 0.17 0.32 -0.14 0.00 0.00 0.00 0.00 17.79 18.14 2jk0 h ALA 236 CO -0.08 -1.04 0.08 0.77 0.00 0.00 0.00 179.25 178.98 2jk0 h SER 237 N -0.92 -0.26 -0.81 0.00 0.02 -1.40 0.14 113.55 110.33 2jk0 h SER 237 Ca -0.09 0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2jk0 h SER 237 Cb 0.64 0.34 -0.04 0.00 0.14 0.00 0.00 62.40 63.48 2jk0 h SER 237 CO 0.14 -0.19 0.43 0.40 -1.14 0.00 0.00 176.83 176.47 2jk0 h ILE 238 N 0.13 1.24 0.07 3.27 2.04 -0.74 -1.69 117.51 121.84 2jk0 h ILE 238 Ca 0.48 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 2jk0 h ILE 238 Cb 0.90 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 2jk0 h ILE 238 CO -0.70 0.28 -0.03 0.50 0.00 0.00 0.00 178.15 178.20 2jk0 h LYS 239 N 1.15 -0.09 0.00 2.37 3.64 0.11 -3.10 116.57 120.65 2jk0 h LYS 239 Ca 0.29 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2jk0 h LYS 239 Cb 0.05 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2jk0 h LYS 239 CO -0.04 0.38 0.00 0.72 -2.27 0.00 0.00 179.45 178.24 2jk0 n HIS 240 N -4.89 0.00 -2.25 1.91 8.25 0.32 -4.83 115.22 113.72 2jk0 n HIS 240 Ca -0.09 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.18 2jk0 n HIS 240 Cb 0.26 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.35 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 0.23 -0.08 3.41 -1.41 0.00 -0.92 -4.96 105.19 101.46 2jk0 n GLY 241 Ca 0.03 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2jk0 n GLY 241 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2jk0 n VAL 242 N -3.77 1.28 -0.09 1.61 3.14 -0.68 -4.94 118.33 114.88 2jk0 n VAL 242 Ca -0.23 -0.38 -0.12 0.00 -2.96 0.00 0.00 64.34 60.64 2jk0 n VAL 242 Cb 0.68 -0.62 -0.15 0.00 -1.06 0.00 0.00 33.84 32.69 2jk0 n VAL 242 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2jk0 n LYS 243 N -0.49 0.68 -4.04 1.45 4.01 -0.50 -4.89 118.16 114.38 2jk0 n LYS 243 Ca 0.09 0.08 -0.11 0.00 -0.51 0.00 0.00 58.31 57.86 2jk0 n LYS 243 Cb 0.51 -1.57 -0.11 0.00 -0.51 0.00 0.00 35.03 33.35 2jk0 n LYS 243 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2jk0 s GLY 244 N -5.68 0.41 -0.05 0.72 0.00 -1.04 -2.76 107.32 98.93 2jk0 s GLY 244 Ca -0.16 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 43.83 2jk0 s GLY 244 CO 0.77 -0.82 -0.11 -0.42 0.00 0.00 0.00 173.10 172.53 2jk0 s ILE 245 N -1.69 0.96 -0.36 0.90 1.01 -0.79 -2.45 121.20 118.78 2jk0 s ILE 245 Ca -0.10 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 2jk0 s ILE 245 Cb -0.08 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.54 2jk0 s ILE 245 CO -0.01 0.30 0.19 -0.69 0.00 0.00 0.00 174.94 174.73 2jk0 s VAL 246 N 0.46 4.53 -0.14 2.92 1.01 -0.35 -1.77 120.40 127.06 2jk0 s VAL 246 Ca -0.09 -0.78 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 2jk0 s VAL 246 Cb -0.13 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 2jk0 s VAL 246 CO 0.02 -0.16 1.10 -0.47 0.00 0.00 0.00 175.10 175.59 2jk0 s TYR 247 N 1.56 3.28 -1.16 5.22 5.04 -0.82 -1.57 117.35 128.90 2jk0 s TYR 247 Ca 0.02 1.38 -0.14 0.00 -2.44 0.00 0.00 57.07 55.90 2jk0 s TYR 247 Cb -0.19 -3.31 0.18 0.00 0.35 0.00 0.00 41.96 38.99 2jk0 s TYR 247 CO 0.06 -0.77 1.35 0.00 -1.34 0.00 0.00 175.55 174.85 2jk0 s ALA 248 N 2.66 4.03 0.69 3.97 0.00 0.98 -0.84 121.76 133.24 2jk0 s ALA 248 Ca 0.50 -3.36 -0.16 0.00 0.00 0.00 0.00 51.96 48.94 2jk0 s ALA 248 Cb -0.19 -4.04 0.01 0.00 0.00 0.00 0.00 23.12 18.90 2jk0 s ALA 248 CO 0.15 -2.72 1.22 0.20 0.00 0.00 0.00 175.76 174.61 2jk0 s GLY 249 N 2.72 2.52 0.07 0.00 0.00 -0.32 -1.23 107.32 111.08 2jk0 s GLY 249 Ca 0.40 0.96 -0.31 0.00 0.00 0.00 0.00 44.72 45.77 2jk0 s GLY 249 CO -0.02 1.37 1.56 1.06 0.00 0.00 0.00 173.10 177.07 2jk0 s MET 250 N -3.70 4.23 5.03 2.90 -1.94 -1.17 -0.24 119.30 124.40 2jk0 s MET 250 Ca 0.76 2.23 0.00 0.00 -1.71 0.00 0.00 55.69 56.98 2jk0 s MET 250 Cb -0.31 -3.50 0.00 0.00 2.01 0.00 0.00 34.83 33.04 2jk0 s MET 250 CO 0.42 -0.65 0.00 0.41 -0.01 0.00 0.00 175.02 175.18 2jk0 n GLY 251 N 3.84 3.02 2.91 -0.03 0.00 -1.26 -1.08 105.19 112.59 2jk0 n GLY 251 Ca 0.15 0.29 -0.43 0.00 0.00 0.00 0.00 46.02 46.03 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 11.24 5.36 -1.70 4.61 0.00 -1.26 -4.39 120.51 134.37 2jk0 n ALA 252 Ca 0.00 -4.59 -0.18 0.00 0.00 0.00 0.00 53.44 48.67 2jk0 n ALA 252 Cb 0.00 -2.60 -0.07 0.00 0.00 0.00 0.00 19.45 16.79 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 1.82 1.32 3.73 0.00 0.00 -1.19 -4.76 105.19 106.11 2jk0 n GLY 253 Ca 0.33 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.46 6.85 -0.03 1.61 0.01 -0.24 -4.77 113.70 114.67 2jk0 s SER 254 Ca 0.00 2.41 -0.01 0.00 1.31 0.00 0.00 55.95 59.66 2jk0 s SER 254 Cb 0.00 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 2jk0 s SER 254 CO 0.00 -0.58 0.05 0.68 0.41 0.00 0.00 173.24 173.80 2jk0 s VAL 255 N 0.36 4.60 0.70 3.43 -7.23 -1.26 -3.05 120.40 117.95 2jk0 s VAL 255 Ca 0.59 -0.36 -0.12 0.00 -1.81 0.00 0.00 61.98 60.28 2jk0 s VAL 255 Cb -0.37 -3.05 0.17 0.00 0.56 0.00 0.00 36.38 33.68 2jk0 s VAL 255 CO 0.37 0.43 0.81 -1.54 -0.31 0.00 0.00 175.10 174.86 2jk0 n SER 256 N 1.49 -0.58 0.08 4.85 3.41 -1.26 -4.79 113.62 116.81 2jk0 n SER 256 Ca -0.15 -1.18 0.12 0.00 -0.26 0.00 0.00 58.87 57.41 2jk0 n SER 256 Cb 0.53 -0.66 0.46 0.00 -0.26 0.00 0.00 64.21 64.28 2jk0 n SER 256 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 2jk0 n LYS 257 N -3.14 0.16 0.08 4.33 2.85 -1.26 -0.69 118.16 120.49 2jk0 n LYS 257 Ca 0.10 0.22 -0.20 0.00 -1.05 0.00 0.00 58.31 57.39 2jk0 n LYS 257 Cb 0.38 -1.72 -0.15 0.00 -0.65 0.00 0.00 35.03 32.89 2jk0 n LYS 257 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jk0 h ARG 258 N 0.00 0.34 -0.15 -1.58 -0.00 -1.93 -2.41 114.38 108.65 2jk0 h ARG 258 Ca 0.00 -0.58 -0.00 0.00 -0.50 0.00 0.00 59.98 58.90 2jk0 h ARG 258 Cb 0.54 0.22 -0.01 0.00 0.00 0.00 0.00 29.97 30.72 2jk0 h ARG 258 CO 0.00 1.23 0.09 0.78 0.00 0.00 0.00 179.97 182.07 2jk0 h GLY 259 N 1.14 0.22 0.38 0.04 0.00 -1.74 -0.56 103.07 102.55 2jk0 h GLY 259 Ca -0.27 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 46.99 2jk0 h GLY 259 CO 0.19 0.10 -0.36 -1.80 0.00 0.00 0.00 176.54 174.67 2jk0 h ASP 260 N 0.15 -1.04 0.25 0.19 1.82 -1.01 0.21 116.42 117.00 2jk0 h ASP 260 Ca 0.05 0.12 -0.00 0.00 -0.39 0.00 0.00 57.03 56.81 2jk0 h ASP 260 Cb 0.06 0.39 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 2jk0 h ASP 260 CO -0.01 -0.44 -0.40 0.00 -1.61 0.00 0.00 179.24 176.78 2jk0 h ALA 261 N -0.00 -0.99 -0.60 -0.78 0.00 -1.43 -1.50 119.26 113.96 2jk0 h ALA 261 Ca 0.03 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 54.94 2jk0 h ALA 261 Cb 0.62 0.71 -0.10 0.00 0.00 0.00 0.00 17.79 19.02 2jk0 h ALA 261 CO -0.21 -1.05 0.01 0.78 0.00 0.00 0.00 179.25 178.79 2jk0 h GLY 262 N -0.69 0.65 0.84 0.00 0.00 -0.93 0.13 103.07 103.08 2jk0 h GLY 262 Ca -0.03 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2jk0 h GLY 262 CO -0.13 -0.19 0.03 -2.22 0.00 0.00 0.00 176.54 174.03 2jk0 h ILE 263 N 0.13 1.16 -0.51 2.60 2.04 -0.56 -1.60 117.51 120.78 2jk0 h ILE 263 Ca 0.31 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 2jk0 h ILE 263 Cb 0.50 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2jk0 h ILE 263 CO -0.50 0.13 0.21 0.03 0.00 0.00 0.00 178.15 178.01 2jk0 h ARG 264 N -0.06 0.72 0.40 2.37 3.08 -0.75 -0.73 114.38 119.43 2jk0 h ARG 264 Ca 0.02 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 2jk0 h ARG 264 Cb 0.19 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 2jk0 h ARG 264 CO -0.00 0.59 -0.22 -0.22 -1.07 0.00 0.00 179.97 179.06 2jk0 h LYS 265 N 0.72 -0.56 -0.74 0.04 3.64 -0.60 -2.70 116.57 116.37 2jk0 h LYS 265 Ca 0.17 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.69 2jk0 h LYS 265 Cb 0.14 0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 2jk0 h LYS 265 CO -0.02 -0.37 0.49 0.00 -2.27 0.00 0.00 179.45 177.28 2jk0 h ALA 266 N 0.01 1.83 0.00 5.00 0.00 -0.72 -2.28 119.26 123.10 2jk0 h ALA 266 Ca -0.05 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2jk0 h ALA 266 Cb 0.46 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2jk0 h ALA 266 CO 0.07 0.02 -0.41 0.93 0.00 0.00 0.00 179.25 179.86 2jk0 h GLU 267 N 0.65 0.00 0.00 0.00 5.08 -0.86 -1.89 114.58 117.55 2jk0 h GLU 267 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2jk0 h GLU 267 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2jk0 h GLU 267 CO -0.12 0.41 0.00 0.66 -1.00 0.00 0.00 179.01 178.96 2jk0 h SER 268 N 0.00 0.00 0.04 1.42 4.64 -1.10 -2.78 113.55 115.76 2jk0 h SER 268 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jk0 h SER 268 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2jk0 h SER 268 CO 0.05 0.00 -0.08 0.29 -0.87 0.00 0.00 176.83 176.23 2jk0 n LYS 269 N -2.81 1.55 -0.82 4.77 4.76 -0.90 -4.93 118.16 119.79 2jk0 n LYS 269 Ca 0.03 -0.99 0.00 0.00 -2.87 0.00 0.00 58.31 54.48 2jk0 n LYS 269 Cb 0.43 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 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 1.25 0.79 3.47 0.72 0.00 -1.05 -5.05 105.19 105.32 2jk0 n GLY 270 Ca 0.16 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.00 5.06 -0.08 -0.61 1.01 -0.76 -4.99 121.20 118.84 2jk0 s ILE 271 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 60.65 59.91 2jk0 s ILE 271 Cb 0.00 -4.10 -0.07 0.00 0.01 0.00 0.00 42.46 38.31 2jk0 s ILE 271 CO 0.00 -0.51 1.96 -0.69 0.00 0.00 0.00 174.94 175.69 2jk0 s VAL 272 N 2.18 3.17 -0.15 2.92 1.01 -1.11 -4.17 120.40 124.23 2jk0 s VAL 272 Ca 0.12 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.28 2jk0 s VAL 272 Cb -0.18 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.03 2jk0 s VAL 272 CO 0.13 -0.05 -0.10 -0.69 0.00 0.00 0.00 175.10 174.38 2jk0 s VAL 273 N 5.54 3.19 -0.20 2.92 1.01 -1.26 -1.89 120.40 129.72 2jk0 s VAL 273 Ca 0.88 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 62.25 2jk0 s VAL 273 Cb -0.37 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.65 2jk0 s VAL 273 CO 0.37 0.50 -0.14 -0.69 0.00 0.00 0.00 175.10 175.14 2jk0 s VAL 274 N 0.63 2.56 -0.52 2.92 1.01 -0.73 0.77 120.40 127.04 2jk0 s VAL 274 Ca -0.06 -0.81 -0.23 0.00 0.00 0.00 0.00 61.98 60.88 2jk0 s VAL 274 Cb -0.15 -2.13 0.04 0.00 0.00 0.00 0.00 36.38 34.13 2jk0 s VAL 274 CO 0.03 0.47 0.86 -0.13 0.00 0.00 0.00 175.10 176.33 2jk0 s ARG 275 N 1.35 3.32 0.00 2.72 0.52 0.21 -1.94 118.95 125.13 2jk0 s ARG 275 Ca 0.05 -0.32 0.00 0.00 -0.52 0.00 0.00 55.73 54.94 2jk0 s ARG 275 Cb -0.14 -4.03 0.00 0.00 0.52 0.00 0.00 34.95 31.30 2jk0 s ARG 275 CO -0.09 -1.37 0.00 0.45 0.02 0.00 0.00 175.30 174.31 2jk0 n SER 276 N 7.11 0.00 -4.16 0.23 2.88 -0.02 -1.23 113.62 118.43 2jk0 n SER 276 Ca 0.01 -0.09 -0.15 0.00 -1.33 0.00 0.00 58.87 57.31 2jk0 n SER 276 Cb 0.47 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.82 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 -1.00 1.40 0.00 -3.46 0.15 -1.26 -1.18 113.70 108.35 2jk0 s SER 277 Ca 0.00 -0.77 0.21 0.00 0.70 0.00 0.00 55.95 56.09 2jk0 s SER 277 Cb 0.00 0.01 0.56 0.00 -1.71 0.00 0.00 66.02 64.88 2jk0 s SER 277 CO 0.00 -0.24 1.47 -2.11 1.20 0.00 0.00 173.24 173.56 2jk0 n ARG 278 N 0.71 2.49 0.10 5.44 1.85 0.66 -4.25 116.66 123.66 2jk0 n ARG 278 Ca -0.17 -2.31 -0.21 0.00 -1.00 0.00 0.00 57.85 54.16 2jk0 n ARG 278 Cb 0.57 -1.51 -0.13 0.00 -1.05 0.00 0.00 32.46 30.35 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 3.88 1.31 0.00 8.89 1.35 -1.83 -3.49 112.91 123.02 2jk0 h THR 279 Ca 0.00 -2.53 0.00 0.00 -0.55 0.00 0.00 66.41 63.33 2jk0 h THR 279 Cb 0.88 2.72 0.00 0.00 -1.73 0.00 0.00 68.15 70.02 2jk0 h THR 279 CO 0.00 0.77 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 2jk0 n GLY 280 N 1.39 1.82 3.62 5.82 0.00 -1.26 -5.09 105.19 111.49 2jk0 n GLY 280 Ca -0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.66 -0.07 0.00 1.61 1.04 -1.26 -5.00 113.70 108.36 2jk0 s SER 281 Ca 0.00 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.44 2jk0 s SER 281 Cb 0.00 0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.19 2jk0 s SER 281 CO 0.00 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.72 2jk0 n GLY 282 N 0.04 2.03 3.66 7.32 0.00 -1.26 -4.99 105.19 112.00 2jk0 n GLY 282 Ca 0.03 -2.01 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 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 -2.32 4.82 -0.28 -0.61 1.09 -1.26 -4.15 121.20 118.50 2jk0 s ILE 283 Ca 0.00 1.75 -0.28 0.00 -1.10 0.00 0.00 60.65 61.02 2jk0 s ILE 283 Cb 0.00 -4.19 0.01 0.00 -1.06 0.00 0.00 42.46 37.22 2jk0 s ILE 283 CO 0.00 -0.04 1.00 -0.69 -0.10 0.00 0.00 174.94 175.11 2jk0 s VAL 284 N 2.48 4.64 0.43 2.92 1.01 -0.09 -4.95 120.40 126.84 2jk0 s VAL 284 Ca 0.40 1.75 -0.14 0.00 0.00 0.00 0.00 61.98 63.98 2jk0 s VAL 284 Cb -0.16 -4.31 -0.08 0.00 0.00 0.00 0.00 36.38 31.83 2jk0 s VAL 284 CO 0.11 -0.30 0.85 -2.16 0.00 0.00 0.00 175.10 173.60 2jk0 s PRO 285 N 3.31 3.92 0.85 2.72 0.04 -1.26 -3.54 135.00 141.04 2jk0 s PRO 285 Ca 0.42 0.73 -0.12 0.00 0.04 0.00 0.00 61.00 62.07 2jk0 s PRO 285 Cb -0.14 -2.29 0.11 0.00 0.04 0.00 0.00 34.50 32.22 2jk0 s PRO 285 CO 0.11 -0.08 1.17 -2.14 0.04 0.00 0.00 177.00 176.09 2jk0 s PRO 286 N -3.71 1.42 -0.30 0.56 0.02 -1.26 -4.96 135.00 126.78 2jk0 s PRO 286 Ca 0.55 1.61 -0.10 0.00 0.02 0.00 0.00 61.00 63.09 2jk0 s PRO 286 Cb -0.10 -1.77 0.18 0.00 0.02 0.00 0.00 34.50 32.84 2jk0 s PRO 286 CO 0.27 -2.35 0.96 0.34 -0.33 0.00 0.00 177.00 175.90 2jk0 s ASP 287 N -2.50 -0.64 0.54 2.53 2.15 -1.26 -5.00 116.67 112.48 2jk0 s ASP 287 Ca 0.69 0.26 0.23 0.00 0.43 0.00 0.00 52.55 54.16 2jk0 s ASP 287 Cb -0.25 1.48 1.50 0.00 -0.30 0.00 0.00 42.92 45.35 2jk0 s ASP 287 CO 0.54 -0.12 2.17 0.00 -0.17 0.00 0.00 175.17 177.59 2jk0 h ALA 288 N 7.77 1.68 0.00 3.66 0.00 -1.98 -2.68 119.26 127.71 2jk0 h ALA 288 Ca -0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2jk0 h ALA 288 Cb 1.17 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2jk0 h ALA 288 CO -0.04 0.05 -0.08 0.78 0.00 0.00 0.00 179.25 179.96 2jk0 h GLY 289 N 0.16 0.00 -3.71 0.00 0.00 -2.02 -3.44 103.07 94.07 2jk0 h GLY 289 Ca -0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 2jk0 h GLY 289 CO 0.00 0.00 -0.85 1.20 0.00 0.00 0.00 176.54 176.90 2jk0 s GLN 290 N -4.08 1.40 0.73 4.80 -0.21 -1.01 -5.14 119.66 116.14 2jk0 s GLN 290 Ca -0.02 -1.38 -0.10 0.00 0.02 0.00 0.00 55.36 53.87 2jk0 s GLN 290 Cb 0.12 -1.80 0.05 0.00 1.00 0.00 0.00 33.01 32.38 2jk0 s GLN 290 CO 0.55 0.41 1.09 -1.25 -2.12 0.00 0.00 175.29 173.97 2jk0 s PRO 291 N -2.25 2.36 0.00 2.91 0.04 -1.26 -4.86 135.00 131.94 2jk0 s PRO 291 Ca 0.15 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.30 2jk0 s PRO 291 Cb -0.09 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2jk0 s PRO 291 CO 0.07 -1.27 0.00 0.41 0.04 0.00 0.00 177.00 176.25 2jk0 n GLY 292 N -3.06 -1.53 3.76 0.56 0.00 -1.26 -4.87 105.19 98.78 2jk0 n GLY 292 Ca 0.07 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.27 2jk0 n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jk0 s LEU 293 N -2.98 2.29 -0.04 0.99 1.43 0.23 -4.81 118.68 115.79 2jk0 s LEU 293 Ca 0.00 1.32 0.01 0.00 -1.03 0.00 0.00 54.13 54.43 2jk0 s LEU 293 Cb 0.00 -3.78 -0.03 0.00 0.03 0.00 0.00 46.19 42.40 2jk0 s LEU 293 CO 0.00 -2.42 -0.05 0.54 0.23 0.00 0.00 176.35 174.66 2jk0 s VAL 294 N -3.07 3.87 -1.80 -1.59 0.11 -1.26 0.68 120.40 117.34 2jk0 s VAL 294 Ca 0.63 -0.53 0.28 0.00 -2.93 0.00 0.00 61.98 59.43 2jk0 s VAL 294 Cb -0.16 -2.64 0.46 0.00 -1.53 0.00 0.00 36.38 32.51 2jk0 s VAL 294 CO 0.55 0.51 1.81 0.00 -3.33 0.00 0.00 175.10 174.65 2jk0 n ALA 295 N 1.91 2.80 -0.79 1.54 0.00 -0.36 -4.80 120.51 120.81 2jk0 n ALA 295 Ca -0.17 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 52.96 2jk0 n ALA 295 Cb 0.53 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.70 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 -0.75 0.00 -1.51 0.00 -0.08 -1.23 -1.50 116.55 111.48 2jk0 n ASP 296 Ca 0.15 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.50 2jk0 n ASP 296 Cb 0.29 0.00 0.32 0.00 2.34 0.00 0.00 41.12 44.07 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 3.41 4.47 -4.70 1.67 3.41 -1.26 -0.92 113.62 119.70 2jk0 n SER 297 Ca 0.00 -2.57 -0.42 0.00 -0.26 0.00 0.00 58.87 55.62 2jk0 n SER 297 Cb 0.00 -0.59 -0.03 0.00 -0.26 0.00 0.00 64.21 63.33 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 -1.94 4.30 0.99 1.04 1.43 -0.56 -4.63 118.68 119.31 2jk0 s LEU 298 Ca 0.43 1.53 -0.12 0.00 -1.03 0.00 0.00 54.13 54.95 2jk0 s LEU 298 Cb 0.31 -3.50 0.15 0.00 0.03 0.00 0.00 46.19 43.18 2jk0 s LEU 298 CO 0.17 -0.34 0.88 -1.54 0.23 0.00 0.00 176.35 175.75 2jk0 n SER 299 N 4.45 -0.80 -0.09 2.29 3.41 -1.26 -4.50 113.62 117.12 2jk0 n SER 299 Ca 0.06 0.25 -0.07 0.00 -0.26 0.00 0.00 58.87 58.85 2jk0 n SER 299 Cb 0.50 -1.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 2jk0 n SER 299 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2jk0 h PRO 300 N -2.00 0.26 -0.50 4.33 0.11 -1.93 0.35 132.00 132.61 2jk0 h PRO 300 Ca -0.48 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 2jk0 h PRO 300 Cb 1.29 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2jk0 h PRO 300 CO 0.41 0.17 0.06 0.00 -0.21 0.00 0.00 178.00 178.43 2jk0 h ALA 301 N 1.20 1.16 0.03 -0.75 0.00 -1.95 -1.91 119.26 117.04 2jk0 h ALA 301 Ca 0.14 -0.24 -0.22 0.00 0.00 0.00 0.00 54.91 54.60 2jk0 h ALA 301 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2jk0 h ALA 301 CO -0.14 0.56 -1.00 0.87 0.00 0.00 0.00 179.25 179.54 2jk0 h LYS 302 N 0.76 0.16 -0.91 0.00 1.57 -1.84 -3.18 116.57 113.14 2jk0 h LYS 302 Ca 0.16 -0.22 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2jk0 h LYS 302 Cb 0.38 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.71 2jk0 h LYS 302 CO 0.01 1.03 0.60 0.77 -0.57 0.00 0.00 179.45 181.29 2jk0 h SER 303 N 0.07 1.00 -0.71 0.86 0.02 -0.57 -1.53 113.55 112.68 2jk0 h SER 303 Ca -0.06 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 60.92 2jk0 h SER 303 Cb 1.69 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 63.94 2jk0 h SER 303 CO 0.15 0.69 0.43 -0.09 -1.14 0.00 0.00 176.83 176.88 2jk0 h ARG 304 N 1.16 0.80 -0.10 3.45 2.43 -1.34 0.33 114.38 121.12 2jk0 h ARG 304 Ca 0.35 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.46 2jk0 h ARG 304 Cb -0.02 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.34 2jk0 h ARG 304 CO -0.10 0.53 -0.01 0.82 -1.51 0.00 0.00 179.97 179.70 2jk0 h ILE 305 N 0.83 1.27 -0.43 1.20 1.08 -1.45 0.21 117.51 120.21 2jk0 h ILE 305 Ca 0.30 -0.87 -0.02 0.00 -0.39 0.00 0.00 64.86 63.88 2jk0 h ILE 305 Cb 0.08 1.65 -0.02 0.00 -3.07 0.00 0.00 36.82 35.46 2jk0 h ILE 305 CO -0.14 0.25 0.20 0.25 -0.69 0.00 0.00 178.15 178.02 2jk0 h LEU 306 N -0.11 0.57 -0.72 1.44 5.85 -0.98 -0.97 115.31 120.39 2jk0 h LEU 306 Ca 0.03 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 2jk0 h LEU 306 Cb 0.39 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2jk0 h LEU 306 CO 0.01 0.55 0.29 0.25 -0.34 0.00 0.00 178.44 179.20 2jk0 h LEU 307 N 0.56 1.00 -0.71 2.25 5.85 -0.21 0.39 115.31 124.44 2jk0 h LEU 307 Ca 0.15 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 2jk0 h LEU 307 Cb 0.14 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2jk0 h LEU 307 CO -0.02 0.90 0.31 -0.03 -0.34 0.00 0.00 178.44 179.26 2jk0 h MET 308 N 1.04 1.04 0.15 1.25 4.05 -0.32 0.93 114.93 123.08 2jk0 h MET 308 Ca 0.24 -0.17 -0.29 0.00 -0.28 0.00 0.00 59.70 59.19 2jk0 h MET 308 Cb 0.21 -0.18 0.01 0.00 -0.80 0.00 0.00 31.60 30.85 2jk0 h MET 308 CO -0.02 0.84 -1.36 -0.07 0.23 0.00 0.00 176.91 176.54 2jk0 h LEU 309 N 1.00 0.51 -1.61 3.39 3.38 -0.90 -3.15 115.31 117.93 2jk0 h LEU 309 Ca 0.24 -0.57 0.03 0.00 0.09 0.00 0.00 57.88 57.66 2jk0 h LEU 309 Cb 0.17 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2jk0 h LEU 309 CO -0.02 1.45 0.30 0.00 0.09 0.00 0.00 178.44 180.26 2jk0 h ALA 310 N 0.47 1.78 0.00 1.53 0.00 0.21 -2.25 119.26 121.00 2jk0 h ALA 310 Ca -0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2jk0 h ALA 310 Cb 2.02 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.67 2jk0 h ALA 310 CO 0.21 0.17 0.00 1.28 0.00 0.00 0.00 179.25 180.91 2jk0 n LEU 311 N -4.48 0.00 -0.00 0.00 4.77 0.29 -2.03 117.00 115.54 2jk0 n LEU 311 Ca 0.05 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.13 2jk0 n LEU 311 Cb 0.13 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.10 2jk0 n LEU 311 CO 0.35 0.00 -0.14 0.35 -1.33 0.00 0.00 177.39 176.62 2jk0 n THR 312 N -0.62 0.00 -0.08 -5.08 -2.24 -0.84 -4.50 114.28 100.92 2jk0 n THR 312 Ca 0.05 -0.07 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 2jk0 n THR 312 Cb 0.02 0.87 -0.08 0.00 -2.10 0.00 0.00 70.33 69.04 2jk0 n THR 312 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2jk0 n LYS 313 N -1.59 0.59 -3.49 -0.78 5.02 -0.86 -5.10 118.16 111.93 2jk0 n LYS 313 Ca 0.03 0.09 -0.10 0.00 -2.02 0.00 0.00 58.31 56.30 2jk0 n LYS 313 Cb 0.36 -1.34 -0.02 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 -2.33 0.00 -0.58 -0.18 -1.32 -0.99 -5.03 115.64 105.20 2jk0 s THR 314 Ca -0.21 -0.10 0.05 0.00 -1.21 0.00 0.00 61.69 60.22 2jk0 s THR 314 Cb 0.06 -1.12 0.04 0.00 -1.51 0.00 0.00 72.50 69.97 2jk0 s THR 314 CO 0.41 0.00 0.64 1.07 -2.21 0.00 0.00 174.62 174.52 2jk0 n THR 315 N -0.34 0.00 -2.34 5.08 5.66 -1.26 -4.13 114.28 116.94 2jk0 n THR 315 Ca -0.13 -0.50 -0.43 0.00 -3.05 0.00 0.00 64.05 59.95 2jk0 n THR 315 Cb 0.63 1.10 -0.02 0.00 -1.55 0.00 0.00 70.33 70.49 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 -0.42 6.89 0.15 1.09 3.84 -1.26 -4.92 114.94 120.32 2jk0 s ASN 316 Ca 0.05 1.81 -0.16 0.00 0.21 0.00 0.00 52.86 54.77 2jk0 s ASN 316 Cb 0.04 -2.54 0.03 0.00 -0.55 0.00 0.00 41.25 38.23 2jk0 s ASN 316 CO 0.06 -0.78 1.79 -0.65 -2.79 0.00 0.00 177.10 174.72 2jk0 h PRO 317 N 8.42 0.40 -0.59 0.43 0.11 -1.98 -0.55 132.00 138.22 2jk0 h PRO 317 Ca -0.30 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.71 2jk0 h PRO 317 Cb 1.12 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 2jk0 h PRO 317 CO 0.96 0.26 0.04 0.00 -0.21 0.00 0.00 178.00 179.05 2jk0 h ALA 318 N 1.17 0.79 0.29 -0.75 0.00 -1.98 0.88 119.26 119.66 2jk0 h ALA 318 Ca 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2jk0 h ALA 318 Cb 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2jk0 h ALA 318 CO -0.08 0.59 -0.14 0.28 0.00 0.00 0.00 179.25 179.90 2jk0 h VAL 319 N 0.91 0.71 -0.48 0.00 2.07 -1.92 -0.08 116.25 117.46 2jk0 h VAL 319 Ca 0.17 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 2jk0 h VAL 319 Cb 0.50 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2jk0 h VAL 319 CO 0.02 0.00 0.25 0.40 0.02 0.00 0.00 177.57 178.27 2jk0 h ILE 320 N -0.40 1.17 -0.73 4.57 2.04 -0.99 0.05 117.51 123.22 2jk0 h ILE 320 Ca -0.04 -0.46 0.12 0.00 1.00 0.00 0.00 64.86 65.49 2jk0 h ILE 320 Cb 0.31 0.60 -0.09 0.00 -0.74 0.00 0.00 36.82 36.90 2jk0 h ILE 320 CO 0.06 0.19 0.31 -0.61 0.00 0.00 0.00 178.15 178.10 2jk0 h GLN 321 N 0.63 0.48 -0.83 2.37 5.75 -0.75 0.18 115.11 122.94 2jk0 h GLN 321 Ca 0.17 -0.03 0.12 0.00 -0.15 0.00 0.00 58.65 58.76 2jk0 h GLN 321 Cb 0.07 -0.11 -0.08 0.00 1.07 0.00 0.00 27.48 28.43 2jk0 h GLN 321 CO -0.03 0.32 0.45 -0.44 -2.65 0.00 0.00 178.83 176.48 2jk0 h ASP 322 N 0.49 0.59 -0.80 -0.69 3.32 0.89 -0.25 116.42 119.98 2jk0 h ASP 322 Ca 0.39 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.51 2jk0 h ASP 322 Cb 0.53 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.01 2jk0 h ASP 322 CO -0.35 0.30 0.51 1.88 -1.72 0.00 0.00 179.24 179.86 2jk0 h TYR 323 N 0.70 1.03 0.00 4.55 0.99 0.34 -2.57 116.97 122.01 2jk0 h TYR 323 Ca 0.42 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 61.15 2jk0 h TYR 323 Cb 0.49 -0.34 -0.00 0.00 1.00 0.00 0.00 36.73 37.87 2jk0 h TYR 323 CO -0.08 0.67 -0.08 0.74 -0.00 0.00 0.00 178.16 179.42 2jk0 h PHE 324 N 1.09 0.00 0.00 4.88 -1.00 0.41 0.46 116.94 122.79 2jk0 h PHE 324 Ca 0.29 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.05 2jk0 h PHE 324 Cb -0.09 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.47 2jk0 h PHE 324 CO -0.01 0.08 -1.06 0.72 -1.61 0.00 0.00 178.31 176.43 2jk0 n HIS 325 N -3.43 0.97 -0.03 -0.55 8.25 -0.99 -4.42 115.22 115.02 2jk0 n HIS 325 Ca -0.02 0.29 0.04 0.00 -0.26 0.00 0.00 57.72 57.77 2jk0 n HIS 325 Cb 0.22 -0.97 -0.13 0.00 1.12 0.00 0.00 29.99 30.23 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 -2.20 2.32 0.82 -1.41 0.00 -0.71 -5.05 120.51 114.28 2jk0 n ALA 326 Ca -0.01 -0.58 0.10 0.00 0.00 0.00 0.00 53.44 52.94 2jk0 n ALA 326 Cb 0.58 -0.43 0.08 0.00 0.00 0.00 0.00 19.45 19.69 2jk0 n ALA 326 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16