#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajc n PRO 2 N 0.00 0.46 -2.63 -2.82 -0.04 -1.26 -4.89 135.00 123.81 1ajc n PRO 2 Ca 0.00 -0.89 -0.43 0.00 -0.04 0.00 0.00 63.50 62.14 1ajc n PRO 2 Cb 0.00 -3.52 -0.02 0.00 -0.04 0.00 0.00 33.50 29.92 1ajc n PRO 2 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ajc s GLU 3 N 8.72 3.84 0.00 0.54 2.56 -1.26 -4.91 118.70 128.19 1ajc s GLU 3 Ca 0.94 0.73 0.00 0.00 0.00 0.00 0.00 54.97 56.63 1ajc s GLU 3 Cb -0.17 -3.84 0.00 0.00 2.00 0.00 0.00 34.13 32.11 1ajc s GLU 3 CO 0.13 -1.19 0.00 -1.33 -0.56 0.00 0.00 175.26 172.31 1ajc n MET 4 N 7.43 0.00 -4.06 4.30 2.81 -1.22 -4.99 117.12 121.39 1ajc n MET 4 Ca 0.12 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.76 1ajc n MET 4 Cb 0.48 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.95 1ajc n MET 4 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1ajc s PRO 5 N 0.00 3.04 0.21 0.03 0.04 -1.26 -4.99 135.00 132.07 1ajc s PRO 5 Ca 0.00 -0.87 0.03 0.00 0.04 0.00 0.00 61.00 60.20 1ajc s PRO 5 Cb 0.00 -2.69 -0.03 0.00 0.04 0.00 0.00 34.50 31.81 1ajc s PRO 5 CO 0.00 0.46 0.35 0.08 0.04 0.00 0.00 177.00 177.93 1ajc s VAL 6 N -1.89 5.27 -0.97 -0.36 1.01 -1.26 -4.78 120.40 117.42 1ajc s VAL 6 Ca 0.32 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 61.27 1ajc s VAL 6 Cb -0.09 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1ajc s VAL 6 CO 0.25 -0.25 1.93 -0.76 0.00 0.00 0.00 175.10 176.27 1ajc s LEU 7 N -3.70 3.16 0.02 3.92 1.43 -0.21 -4.86 118.68 118.44 1ajc s LEU 7 Ca 0.35 -0.91 -0.04 0.00 -1.03 0.00 0.00 54.13 52.49 1ajc s LEU 7 Cb -0.10 -2.57 -0.01 0.00 0.03 0.00 0.00 46.19 43.54 1ajc s LEU 7 CO 0.29 -2.77 0.71 -1.84 0.23 0.00 0.00 176.35 172.98 1ajc n GLU 8 N 8.73 -0.06 -3.62 1.70 -0.00 -1.26 -4.44 120.64 121.70 1ajc n GLU 8 Ca 0.41 0.70 -0.19 0.00 -0.00 0.00 0.00 57.16 58.08 1ajc n GLU 8 Cb 0.47 -1.05 -0.16 0.00 -0.00 0.00 0.00 31.44 30.70 1ajc n GLU 8 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1ajc s ASN 9 N -3.53 1.26 -0.34 -1.84 2.47 -1.26 -4.99 114.94 106.71 1ajc s ASN 9 Ca -0.02 -0.01 0.07 0.00 0.42 0.00 0.00 52.86 53.32 1ajc s ASN 9 Cb 0.02 0.14 0.48 0.00 -1.45 0.00 0.00 41.25 40.44 1ajc s ASN 9 CO 0.09 -0.28 1.46 0.54 -3.72 0.00 0.00 177.10 175.18 1ajc n ARG 10 N 5.31 2.41 -3.07 0.43 5.12 -1.26 -4.87 116.66 120.73 1ajc n ARG 10 Ca -0.05 -3.48 -0.26 0.00 -1.93 0.00 0.00 57.85 52.13 1ajc n ARG 10 Cb 0.50 -2.00 -0.01 0.00 -1.16 0.00 0.00 32.46 29.79 1ajc n ARG 10 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ajc s ALA 11 N -3.43 3.56 0.11 7.54 0.00 -1.26 -4.76 121.76 123.51 1ajc s ALA 11 Ca 0.49 -0.67 -0.35 0.00 0.00 0.00 0.00 51.96 51.43 1ajc s ALA 11 Cb 0.42 -2.35 -0.14 0.00 0.00 0.00 0.00 23.12 21.05 1ajc s ALA 11 CO 0.00 -0.11 1.55 0.00 0.00 0.00 0.00 175.76 177.20 1ajc n ALA 12 N -1.81 0.66 -0.16 0.00 0.00 0.08 -4.41 120.51 114.87 1ajc n ALA 12 Ca -0.02 0.45 -0.00 0.00 0.00 0.00 0.00 53.44 53.87 1ajc n ALA 12 Cb 0.55 -2.29 0.25 0.00 0.00 0.00 0.00 19.45 17.97 1ajc n ALA 12 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1ajc h GLN 13 N 5.88 0.88 0.00 0.00 7.50 -0.17 -3.48 115.11 125.72 1ajc h GLN 13 Ca -0.46 -0.09 0.00 0.00 0.50 0.00 0.00 58.65 58.60 1ajc h GLN 13 Cb 1.28 -0.18 0.00 0.00 0.05 0.00 0.00 27.48 28.63 1ajc h GLN 13 CO 0.87 0.65 0.00 0.41 -1.50 0.00 0.00 178.83 179.25 1ajc n GLY 14 N -1.24 3.06 3.56 3.46 0.00 0.06 -5.06 105.19 109.03 1ajc n GLY 14 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1ajc n GLY 14 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ajc s ASP 15 N 1.86 6.12 0.17 1.61 2.15 -1.26 -4.76 116.67 122.56 1ajc s ASP 15 Ca 0.00 -0.05 0.08 0.00 0.43 0.00 0.00 52.55 53.01 1ajc s ASP 15 Cb 0.00 -2.55 0.45 0.00 -0.30 0.00 0.00 42.92 40.52 1ajc s ASP 15 CO 0.00 -1.79 1.16 2.30 -0.17 0.00 0.00 175.17 176.67 1ajc n ILE 16 N 6.66 1.12 1.04 4.11 -5.35 -1.25 -0.92 119.36 124.76 1ajc n ILE 16 Ca 0.08 0.62 0.12 0.00 -0.27 0.00 0.00 62.75 63.31 1ajc n ILE 16 Cb 0.49 -1.62 0.20 0.00 -1.74 0.00 0.00 39.64 36.96 1ajc n ILE 16 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1ajc n THR 17 N -1.76 0.00 -4.00 7.28 -2.24 -1.26 -4.36 114.28 107.94 1ajc n THR 17 Ca -0.01 -0.03 -0.21 0.00 -2.27 0.00 0.00 64.05 61.53 1ajc n THR 17 Cb 0.17 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 68.81 1ajc n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajc s ALA 18 N -2.91 3.83 0.28 6.98 0.00 -0.10 -5.01 121.76 124.83 1ajc s ALA 18 Ca 0.13 -1.31 -0.30 0.00 0.00 0.00 0.00 51.96 50.48 1ajc s ALA 18 Cb 0.18 -1.58 -0.13 0.00 0.00 0.00 0.00 23.12 21.58 1ajc s ALA 18 CO 0.70 0.23 1.30 -2.30 0.00 0.00 0.00 175.76 175.69 1ajc n PRO 19 N -1.34 1.94 -1.11 0.00 -0.02 -1.26 -0.82 135.00 132.39 1ajc n PRO 19 Ca -0.08 0.68 -0.04 0.00 -2.02 0.00 0.00 63.50 62.04 1ajc n PRO 19 Cb 0.57 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.77 1ajc n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ajc n GLY 20 N 1.50 0.37 0.16 -1.23 0.00 -1.26 -4.83 105.19 99.91 1ajc n GLY 20 Ca 0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 1ajc n GLY 20 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ajc h GLY 21 N 0.00 0.29 -1.19 -0.02 0.00 -1.10 -3.11 103.07 97.94 1ajc h GLY 21 Ca -0.08 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1ajc h GLY 21 CO 0.11 0.36 0.00 0.00 0.00 0.00 0.00 176.54 177.01 1ajc n ALA 22 N -2.48 2.49 -1.64 3.60 0.00 -1.26 -0.76 120.51 120.45 1ajc n ALA 22 Ca -0.03 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.41 1ajc n ALA 22 Cb 0.67 -1.03 0.06 0.00 0.00 0.00 0.00 19.45 19.15 1ajc n ALA 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ajc n ARG 23 N 0.59 0.94 -0.04 0.00 1.74 -1.18 -4.54 116.66 114.17 1ajc n ARG 23 Ca 0.16 0.37 -0.03 0.00 -0.77 0.00 0.00 57.85 57.58 1ajc n ARG 23 Cb 0.38 -2.33 -0.08 0.00 -1.02 0.00 0.00 32.46 29.42 1ajc n ARG 23 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1ajc n ARG 24 N -1.50 2.07 -3.41 5.56 1.74 -1.26 0.25 116.66 120.11 1ajc n ARG 24 Ca 0.15 -0.02 -0.35 0.00 -0.77 0.00 0.00 57.85 56.86 1ajc n ARG 24 Cb 0.48 -1.24 -0.06 0.00 -1.02 0.00 0.00 32.46 30.62 1ajc n ARG 24 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ajc s LEU 25 N -4.52 4.31 -0.18 0.55 1.43 -1.26 -4.48 118.68 114.53 1ajc s LEU 25 Ca -0.05 1.00 0.10 0.00 -1.03 0.00 0.00 54.13 54.16 1ajc s LEU 25 Cb 0.03 -3.30 -0.18 0.00 0.03 0.00 0.00 46.19 42.78 1ajc s LEU 25 CO 0.40 0.08 -0.03 0.35 0.23 0.00 0.00 176.35 177.38 1ajc n THR 26 N 0.65 1.18 -2.66 5.49 -2.24 -1.26 -4.99 114.28 110.44 1ajc n THR 26 Ca -0.05 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1ajc n THR 26 Cb 0.52 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1ajc n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ajc n GLY 27 N 2.14 3.91 3.74 3.38 0.00 -1.26 -5.14 105.19 111.95 1ajc n GLY 27 Ca -0.31 -1.13 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 1ajc n GLY 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ajc s ASP 28 N 1.08 7.25 0.11 1.61 2.15 -1.26 -4.97 116.67 122.65 1ajc s ASP 28 Ca 0.00 2.07 0.24 0.00 0.43 0.00 0.00 52.55 55.29 1ajc s ASP 28 Cb 0.00 -2.60 0.28 0.00 -0.30 0.00 0.00 42.92 40.30 1ajc s ASP 28 CO 0.00 -0.24 1.26 0.00 -0.17 0.00 0.00 175.17 176.02 1ajc n GLN 29 N 2.54 0.30 -0.39 4.34 3.00 -1.26 -4.55 117.38 121.36 1ajc n GLN 29 Ca 0.03 0.07 -0.10 0.00 -0.01 0.00 0.00 57.00 56.99 1ajc n GLN 29 Cb 0.46 -1.67 -0.09 0.00 0.00 0.00 0.00 30.24 28.94 1ajc n GLN 29 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 1ajc h THR 30 N 0.00 0.00 -0.90 5.09 2.02 -1.99 0.17 112.91 117.31 1ajc h THR 30 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1ajc h THR 30 Cb 0.75 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 1ajc h THR 30 CO 0.00 0.00 0.51 0.00 0.37 0.00 0.00 175.52 176.40 1ajc h ALA 31 N 0.40 1.15 -0.92 6.16 0.00 -2.00 -0.96 119.26 123.07 1ajc h ALA 31 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ajc h ALA 31 Cb 0.39 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1ajc h ALA 31 CO -0.88 0.63 0.58 0.00 0.00 0.00 0.00 179.25 179.59 1ajc h ALA 32 N 1.28 1.17 -0.14 0.00 0.00 -1.30 -2.16 119.26 118.12 1ajc h ALA 32 Ca 0.32 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 1ajc h ALA 32 Cb -0.01 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1ajc h ALA 32 CO -0.06 0.60 -0.53 1.25 0.00 0.00 0.00 179.25 180.52 1ajc h LEU 33 N 1.26 0.42 -0.94 0.00 5.85 -0.15 -3.06 115.31 118.70 1ajc h LEU 33 Ca 0.33 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1ajc h LEU 33 Cb -0.10 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.77 1ajc h LEU 33 CO -0.07 0.87 0.49 0.03 -0.34 0.00 0.00 178.44 179.42 1ajc h ARG 34 N 0.30 1.24 0.00 1.25 3.08 -0.57 -1.93 114.38 117.75 1ajc h ARG 34 Ca 0.01 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1ajc h ARG 34 Cb 1.02 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1ajc h ARG 34 CO 0.09 0.90 0.00 -0.25 -1.07 0.00 0.00 179.97 179.64 1ajc n ASP 35 N -4.33 0.00 -0.09 7.04 8.00 -0.95 -3.19 116.55 123.03 1ajc n ASP 35 Ca 0.09 0.01 0.11 0.00 0.71 0.00 0.00 54.79 55.71 1ajc n ASP 35 Cb 0.10 -0.32 0.13 0.00 -0.02 0.00 0.00 41.12 41.00 1ajc n ASP 35 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ajc n SER 36 N -1.32 0.90 -4.65 -2.24 7.64 -0.73 -3.44 113.62 109.78 1ajc n SER 36 Ca 0.12 -0.72 -0.39 0.00 1.01 0.00 0.00 58.87 58.89 1ajc n SER 36 Cb 0.23 0.50 -0.07 0.00 -1.01 0.00 0.00 64.21 63.85 1ajc n SER 36 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ajc s LEU 37 N -2.87 4.12 -0.20 -3.43 1.02 -1.19 -4.65 118.68 111.48 1ajc s LEU 37 Ca 0.13 0.55 -0.08 0.00 0.02 0.00 0.00 54.13 54.75 1ajc s LEU 37 Cb 0.17 -2.60 0.09 0.00 0.02 0.00 0.00 46.19 43.87 1ajc s LEU 37 CO 0.71 -0.16 0.44 -0.55 0.02 0.00 0.00 176.35 176.81 1ajc s SER 38 N 1.24 -0.37 -0.30 2.29 0.15 -1.26 -5.03 113.70 110.42 1ajc s SER 38 Ca 0.21 1.02 0.09 0.00 0.70 0.00 0.00 55.95 57.97 1ajc s SER 38 Cb -0.15 1.28 0.70 0.00 -1.71 0.00 0.00 66.02 66.15 1ajc s SER 38 CO 0.09 -0.22 1.73 -0.90 1.20 0.00 0.00 173.24 175.14 1ajc n ASP 39 N 5.14 4.72 -4.88 5.45 5.75 -1.26 -0.06 116.55 131.41 1ajc n ASP 39 Ca -0.12 -3.11 -0.30 0.00 -0.01 0.00 0.00 54.79 51.25 1ajc n ASP 39 Cb 0.51 -0.73 0.04 0.00 -1.03 0.00 0.00 41.12 39.91 1ajc n ASP 39 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1ajc s LYS 40 N -2.79 2.94 0.20 0.11 -0.14 -1.26 -4.90 119.74 113.90 1ajc s LYS 40 Ca 0.51 0.49 -0.31 0.00 -1.36 0.00 0.00 55.97 55.30 1ajc s LYS 40 Cb 0.41 -2.03 -0.11 0.00 -1.68 0.00 0.00 37.83 34.42 1ajc s LYS 40 CO 0.13 -0.98 1.61 -2.14 -0.76 0.00 0.00 175.35 173.21 1ajc s PRO 41 N -5.34 4.18 -0.17 -1.68 0.02 -1.26 -4.56 135.00 126.20 1ajc s PRO 41 Ca 0.58 2.46 -0.25 0.00 0.02 0.00 0.00 61.00 63.81 1ajc s PRO 41 Cb -0.11 -3.11 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 1ajc s PRO 41 CO 0.52 -0.64 0.80 0.00 -0.33 0.00 0.00 177.00 177.35 1ajc s ALA 42 N 0.95 3.51 0.08 -1.55 0.00 -0.76 -4.94 121.76 119.04 1ajc s ALA 42 Ca 0.70 0.01 -0.14 0.00 0.00 0.00 0.00 51.96 52.53 1ajc s ALA 42 Cb -0.46 -3.19 -0.20 0.00 0.00 0.00 0.00 23.12 19.27 1ajc s ALA 42 CO 0.34 -0.61 1.23 -0.22 0.00 0.00 0.00 175.76 176.50 1ajc h LYS 43 N 7.32 0.72 -4.94 0.00 3.64 -1.02 -3.38 116.57 118.92 1ajc h LYS 43 Ca -0.30 -0.68 -0.36 0.00 -1.27 0.00 0.00 60.65 58.04 1ajc h LYS 43 Cb 1.14 0.17 -0.14 0.00 -0.41 0.00 0.00 32.23 32.98 1ajc h LYS 43 CO 0.82 1.27 -0.63 -0.80 -2.27 0.00 0.00 179.45 177.85 1ajc s ASN 44 N -7.15 1.41 -0.03 4.20 0.01 -1.07 -3.71 114.94 108.59 1ajc s ASN 44 Ca -0.10 -1.33 -0.03 0.00 -0.71 0.00 0.00 52.86 50.69 1ajc s ASN 44 Cb 0.07 0.11 0.01 0.00 0.41 0.00 0.00 41.25 41.85 1ajc s ASN 44 CO 0.90 -0.66 0.08 -0.63 -1.51 0.00 0.00 177.10 175.28 1ajc s ILE 45 N -3.65 -0.00 -0.09 0.60 1.01 -0.73 -2.24 121.20 116.10 1ajc s ILE 45 Ca 0.34 0.02 0.01 0.00 0.00 0.00 0.00 60.65 61.02 1ajc s ILE 45 Cb 0.07 -0.13 0.02 0.00 0.01 0.00 0.00 42.46 42.44 1ajc s ILE 45 CO 0.12 0.01 -0.09 -0.63 0.00 0.00 0.00 174.94 174.35 1ajc s ILE 46 N 0.13 0.99 -0.30 2.92 1.01 -0.55 -0.99 121.20 124.42 1ajc s ILE 46 Ca -0.01 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.34 1ajc s ILE 46 Cb -0.01 -0.97 0.07 0.00 0.01 0.00 0.00 42.46 41.55 1ajc s ILE 46 CO -0.00 0.34 -0.03 -0.22 0.00 0.00 0.00 174.94 175.03 1ajc s LEU 47 N 1.26 3.96 -0.34 2.97 0.20 0.18 -0.99 118.68 125.91 1ajc s LEU 47 Ca -0.04 -1.56 -0.17 0.00 0.69 0.00 0.00 54.13 53.05 1ajc s LEU 47 Cb -0.14 -1.63 -0.01 0.00 -0.43 0.00 0.00 46.19 43.98 1ajc s LEU 47 CO -0.03 -0.27 0.43 -0.76 -0.29 0.00 0.00 176.35 175.43 1ajc s LEU 48 N 1.10 4.38 -0.15 -0.68 2.01 0.21 -0.25 118.68 125.31 1ajc s LEU 48 Ca -0.03 -0.12 -0.05 0.00 0.01 0.00 0.00 54.13 53.95 1ajc s LEU 48 Cb -0.20 -2.46 -0.03 0.00 0.01 0.00 0.00 46.19 43.51 1ajc s LEU 48 CO -0.05 -0.40 0.01 -0.63 1.01 0.00 0.00 176.35 176.30 1ajc s ILE 49 N 2.19 4.33 -0.34 -0.59 -1.09 -0.13 -1.80 121.20 123.77 1ajc s ILE 49 Ca 0.15 -0.21 -0.06 0.00 -2.23 0.00 0.00 60.65 58.29 1ajc s ILE 49 Cb -0.16 -2.89 0.04 0.00 -1.58 0.00 0.00 42.46 37.87 1ajc s ILE 49 CO 0.12 0.51 0.11 -0.83 -1.23 0.00 0.00 174.94 173.62 1ajc s GLY 50 N 0.02 1.85 -0.21 6.18 0.00 0.13 -1.61 107.32 113.68 1ajc s GLY 50 Ca 0.03 -1.77 -0.28 0.00 0.00 0.00 0.00 44.72 42.70 1ajc s GLY 50 CO 0.02 0.78 2.20 0.99 0.00 0.00 0.00 173.10 177.09 1ajc s ASP 51 N 1.43 5.50 -0.25 1.64 1.01 -0.95 -1.79 116.67 123.26 1ajc s ASP 51 Ca -0.01 1.91 0.00 0.00 0.71 0.00 0.00 52.55 55.16 1ajc s ASP 51 Cb -0.20 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1ajc s ASP 51 CO 0.03 -1.92 0.00 0.61 0.21 0.00 0.00 175.17 174.10 1ajc n GLY 52 N 5.70 0.57 3.41 0.21 0.00 -1.24 -0.30 105.19 113.54 1ajc n GLY 52 Ca 0.29 -0.76 -0.44 0.00 0.00 0.00 0.00 46.02 45.12 1ajc n GLY 52 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ajc n MET 53 N -2.82 3.39 -2.05 1.61 0.00 -0.74 -3.85 117.12 112.66 1ajc n MET 53 Ca -0.02 -3.79 -0.22 0.00 0.00 0.00 0.00 57.70 53.67 1ajc n MET 53 Cb 0.09 -3.05 0.13 0.00 0.00 0.00 0.00 33.22 30.39 1ajc n MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ajc n GLY 54 N 4.02 -0.15 0.36 -5.12 0.00 -1.26 -4.44 105.19 98.58 1ajc n GLY 54 Ca 0.38 -1.90 0.16 0.00 0.00 0.00 0.00 46.02 44.66 1ajc n GLY 54 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ajc h ASP 55 N -0.90 0.15 -0.46 1.61 3.32 -1.93 -0.92 116.42 117.28 1ajc h ASP 55 Ca -0.32 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.60 1ajc h ASP 55 Cb 1.05 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1ajc h ASP 55 CO 0.29 0.09 -0.23 -1.28 -1.72 0.00 0.00 179.24 176.39 1ajc h SER 56 N 0.17 1.01 -0.21 6.45 0.87 -1.92 -1.75 113.55 118.17 1ajc h SER 56 Ca 0.24 -0.39 -0.16 0.00 -1.23 0.00 0.00 61.79 60.25 1ajc h SER 56 Cb 0.72 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1ajc h SER 56 CO -0.04 1.19 -0.50 -0.33 -0.53 0.00 0.00 176.83 176.62 1ajc h GLU 57 N 0.84 0.70 -0.30 2.24 3.07 -1.51 -2.74 114.58 116.87 1ajc h GLU 57 Ca 0.11 -0.48 0.05 0.00 -0.50 0.00 0.00 59.36 58.53 1ajc h GLU 57 Cb 0.81 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.75 1ajc h GLU 57 CO 0.07 1.10 0.05 0.82 -1.40 0.00 0.00 179.01 179.65 1ajc h ILE 58 N 0.41 0.84 0.72 3.13 2.04 -1.19 -2.02 117.51 121.44 1ajc h ILE 58 Ca -0.00 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 1ajc h ILE 58 Cb 1.11 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1ajc h ILE 58 CO 0.11 0.03 -0.43 0.74 0.00 0.00 0.00 178.15 178.60 1ajc h THR 59 N 0.15 0.13 -0.90 -0.27 2.02 -1.29 -1.41 112.91 111.35 1ajc h THR 59 Ca 0.14 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.53 1ajc h THR 59 Cb 0.16 0.13 -0.12 0.00 -1.74 0.00 0.00 68.15 66.58 1ajc h THR 59 CO -0.20 0.00 0.42 0.00 0.37 0.00 0.00 175.52 176.11 1ajc h ALA 60 N -0.89 1.44 -0.40 6.16 0.00 -1.38 0.30 119.26 124.49 1ajc h ALA 60 Ca -0.09 0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1ajc h ALA 60 Cb 0.86 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1ajc h ALA 60 CO 0.10 -0.29 -0.16 0.00 0.00 0.00 0.00 179.25 178.90 1ajc h ALA 61 N 1.69 0.96 0.25 0.00 0.00 -1.15 -1.68 119.26 119.32 1ajc h ALA 61 Ca 0.55 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1ajc h ALA 61 Cb 1.01 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1ajc h ALA 61 CO -0.50 0.61 -0.12 -0.09 0.00 0.00 0.00 179.25 179.15 1ajc h ARG 62 N 0.67 -0.33 -0.53 0.00 2.43 0.44 -0.35 114.38 116.71 1ajc h ARG 62 Ca 0.11 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.38 1ajc h ARG 62 Cb 0.65 0.07 -0.10 0.00 -0.42 0.00 0.00 29.97 30.17 1ajc h ARG 62 CO 0.05 0.03 -0.45 -0.91 -1.51 0.00 0.00 179.97 177.18 1ajc h ASN 63 N -0.88 -1.52 0.52 -3.80 2.35 -0.56 0.44 115.58 112.12 1ajc h ASN 63 Ca -0.03 0.24 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 1ajc h ASN 63 Cb 0.51 0.68 0.00 0.00 0.05 0.00 0.00 38.32 39.56 1ajc h ASN 63 CO 0.06 -0.35 -0.25 0.22 -1.65 0.00 0.00 177.43 175.46 1ajc h TYR 64 N -0.26 -0.66 0.00 1.19 5.03 -1.36 0.12 116.97 121.03 1ajc h TYR 64 Ca 0.16 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.39 1ajc h TYR 64 Cb 0.57 0.22 -0.01 0.00 1.55 0.00 0.00 36.73 39.06 1ajc h TYR 64 CO -0.70 -0.41 -0.31 0.00 -1.32 0.00 0.00 178.16 175.43 1ajc h ALA 65 N -1.67 1.16 0.00 1.82 0.00 -0.89 -0.02 119.26 119.66 1ajc h ALA 65 Ca -0.07 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ajc h ALA 65 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ajc h ALA 65 CO 0.12 0.39 0.00 0.39 0.00 0.00 0.00 179.25 180.14 1ajc n GLU 66 N -3.69 0.17 0.00 0.00 1.02 0.14 -4.82 120.64 113.46 1ajc n GLU 66 Ca -0.01 -0.38 0.00 0.00 -0.02 0.00 0.00 57.16 56.75 1ajc n GLU 66 Cb 0.42 -0.58 0.00 0.00 -0.02 0.00 0.00 31.44 31.26 1ajc n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ajc n GLY 67 N -0.04 -2.15 0.30 0.62 0.00 0.42 -3.17 105.19 101.17 1ajc n GLY 67 Ca 0.00 -1.44 0.02 0.00 0.00 0.00 0.00 46.02 44.60 1ajc n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajc h ALA 68 N 0.00 1.13 -0.13 4.61 0.00 -1.80 0.21 119.26 123.28 1ajc h ALA 68 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ajc h ALA 68 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ajc h ALA 68 CO 0.00 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.75 1ajc n GLY 69 N -1.32 -0.20 3.62 0.00 0.00 -1.26 -4.88 105.19 101.15 1ajc n GLY 69 Ca 0.13 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1ajc n GLY 69 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ajc s GLY 70 N -1.36 1.61 -0.14 -0.02 0.00 0.74 -0.74 107.32 107.41 1ajc s GLY 70 Ca 0.24 -1.10 -0.08 0.00 0.00 0.00 0.00 44.72 43.78 1ajc s GLY 70 CO 0.18 -0.17 0.34 -0.12 0.00 0.00 0.00 173.10 173.34 1ajc s PHE 71 N -3.12 -0.47 -0.46 1.90 5.36 -1.26 -4.69 117.98 115.24 1ajc s PHE 71 Ca 0.73 1.05 -0.25 0.00 -0.96 0.00 0.00 56.93 57.50 1ajc s PHE 71 Cb -0.07 0.17 0.03 0.00 -0.34 0.00 0.00 43.02 42.80 1ajc s PHE 71 CO 0.55 -0.27 0.88 -0.06 -1.46 0.00 0.00 175.22 174.86 1ajc s PHE 72 N 1.10 2.95 0.48 10.12 0.08 -1.26 -4.94 117.98 126.51 1ajc s PHE 72 Ca -0.07 0.32 0.23 0.00 0.12 0.00 0.00 56.93 57.53 1ajc s PHE 72 Cb -0.08 -3.87 1.27 0.00 -0.57 0.00 0.00 43.02 39.77 1ajc s PHE 72 CO -0.09 -1.06 1.89 0.87 -0.10 0.00 0.00 175.22 176.74 1ajc h LYS 73 N 9.04 0.20 0.00 0.44 6.56 -1.95 -2.31 116.57 128.55 1ajc h LYS 73 Ca -0.24 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.34 1ajc h LYS 73 Cb 1.08 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.69 1ajc h LYS 73 CO 1.01 0.13 0.00 0.41 -2.06 0.00 0.00 179.45 178.94 1ajc n GLY 74 N -1.60 -0.05 0.30 3.86 0.00 -1.26 -4.15 105.19 102.29 1ajc n GLY 74 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1ajc n GLY 74 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ajc n ILE 75 N -1.20 -0.36 1.27 -0.61 5.41 -1.25 -0.51 119.36 122.10 1ajc n ILE 75 Ca 0.00 1.94 0.13 0.00 1.00 0.00 0.00 62.75 65.82 1ajc n ILE 75 Cb 0.00 -2.73 0.48 0.00 -0.71 0.00 0.00 39.64 36.67 1ajc n ILE 75 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1ajc n ASP 76 N -5.34 0.64 0.01 4.38 8.00 -0.87 -4.11 116.55 119.26 1ajc n ASP 76 Ca 0.16 -0.57 0.14 0.00 0.71 0.00 0.00 54.79 55.22 1ajc n ASP 76 Cb 0.52 0.02 0.55 0.00 -0.02 0.00 0.00 41.12 42.19 1ajc n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ajc n ALA 77 N -0.95 2.46 -2.26 2.24 0.00 0.33 -4.84 120.51 117.49 1ajc n ALA 77 Ca 0.12 -0.12 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1ajc n ALA 77 Cb 0.31 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.31 1ajc n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ajc s LEU 78 N -3.17 4.25 0.21 0.00 1.02 -1.25 -1.04 118.68 118.70 1ajc s LEU 78 Ca 0.13 1.94 -0.08 0.00 0.02 0.00 0.00 54.13 56.14 1ajc s LEU 78 Cb 0.18 -3.54 0.16 0.00 0.02 0.00 0.00 46.19 43.01 1ajc s LEU 78 CO 0.56 -0.79 1.80 1.55 0.02 0.00 0.00 176.35 179.48 1ajc h PRO 79 N 8.50 1.15 -4.84 1.29 0.13 -1.87 -3.43 132.00 132.95 1ajc h PRO 79 Ca -0.33 -0.18 -0.66 0.00 -0.87 0.00 0.00 66.00 63.97 1ajc h PRO 79 Cb 1.14 -0.20 -0.19 0.00 0.13 0.00 0.00 31.00 31.88 1ajc h PRO 79 CO 0.95 0.90 -0.52 -0.51 -0.23 0.00 0.00 178.00 178.59 1ajc s LEU 80 N -9.80 4.13 0.22 1.56 1.43 -1.06 -5.00 118.68 110.15 1ajc s LEU 80 Ca -0.13 -0.21 0.08 0.00 -1.03 0.00 0.00 54.13 52.85 1ajc s LEU 80 Cb 0.15 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 1ajc s LEU 80 CO 0.83 -0.12 -0.14 0.42 0.23 0.00 0.00 176.35 177.57 1ajc s THR 81 N 1.72 1.77 0.00 5.49 -4.23 -1.26 0.22 115.64 119.35 1ajc s THR 81 Ca 0.06 -2.22 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 1ajc s THR 81 Cb -0.16 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.57 1ajc s THR 81 CO 0.10 -0.55 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 1ajc n GLY 82 N -0.42 2.55 2.93 3.99 0.00 0.11 -4.11 105.19 110.25 1ajc n GLY 82 Ca -0.07 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 1ajc n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ajc s GLN 83 N 0.89 0.10 0.04 1.61 1.11 -1.06 -2.43 119.66 119.92 1ajc s GLN 83 Ca 0.00 0.38 0.07 0.00 0.01 0.00 0.00 55.36 55.82 1ajc s GLN 83 Cb 0.00 -0.17 -0.02 0.00 -1.01 0.00 0.00 33.01 31.80 1ajc s GLN 83 CO 0.00 -0.16 -0.21 1.52 0.01 0.00 0.00 175.29 176.45 1ajc s TYR 84 N 1.17 1.83 0.22 0.91 1.13 -0.61 -2.12 117.35 119.88 1ajc s TYR 84 Ca -0.09 -0.37 -0.17 0.00 -1.41 0.00 0.00 57.07 55.02 1ajc s TYR 84 Cb -0.11 -1.10 -0.08 0.00 -1.10 0.00 0.00 41.96 39.57 1ajc s TYR 84 CO -0.06 0.09 0.68 0.95 -2.51 0.00 0.00 175.55 174.69 1ajc s THR 85 N -0.78 4.67 -0.04 -3.49 -4.23 -0.04 -2.61 115.64 109.12 1ajc s THR 85 Ca 0.08 1.09 0.15 0.00 -1.18 0.00 0.00 61.69 61.83 1ajc s THR 85 Cb -0.09 -3.78 0.28 0.00 1.34 0.00 0.00 72.50 70.25 1ajc s THR 85 CO 0.02 0.14 1.12 0.00 -0.54 0.00 0.00 174.62 175.36 1ajc n HIS 86 N 0.53 0.00 -1.60 3.99 1.44 -1.26 -0.95 115.22 117.37 1ajc n HIS 86 Ca -0.02 -0.51 -0.38 0.00 -2.01 0.00 0.00 57.72 54.80 1ajc n HIS 86 Cb 0.52 -0.13 0.05 0.00 0.12 0.00 0.00 29.99 30.54 1ajc n HIS 86 CO 0.00 0.00 0.00 2.48 -2.81 0.00 0.00 176.34 176.01 1ajc n TYR 87 N -0.03 0.72 -2.79 -1.40 0.18 -1.26 -4.46 117.16 108.13 1ajc n TYR 87 Ca 0.07 0.45 0.00 0.00 1.88 0.00 0.00 57.90 60.29 1ajc n TYR 87 Cb 0.91 -2.13 0.00 0.00 -0.38 0.00 0.00 39.34 37.73 1ajc n TYR 87 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1ajc n ALA 88 N -1.61 0.00 -2.47 -3.48 0.00 0.74 -4.89 120.51 108.80 1ajc n ALA 88 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.31 1ajc n ALA 88 Cb 0.47 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.79 1ajc n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ajc s LEU 89 N 0.00 2.34 -0.36 0.00 1.43 0.32 -0.17 118.68 122.24 1ajc s LEU 89 Ca 0.00 -0.75 -0.19 0.00 -1.03 0.00 0.00 54.13 52.16 1ajc s LEU 89 Cb 0.00 -1.01 0.00 0.00 0.03 0.00 0.00 46.19 45.21 1ajc s LEU 89 CO 0.00 0.09 0.57 0.21 0.23 0.00 0.00 176.35 177.45 1ajc s ASN 90 N -2.13 6.36 0.26 2.29 3.84 0.16 -4.17 114.94 121.55 1ajc s ASN 90 Ca 0.11 0.02 -0.06 0.00 0.21 0.00 0.00 52.86 53.14 1ajc s ASN 90 Cb -0.09 -2.30 0.47 0.00 -0.55 0.00 0.00 41.25 38.78 1ajc s ASN 90 CO 0.06 -0.55 1.62 0.50 -2.79 0.00 0.00 177.10 175.93 1ajc h LYS 91 N 8.49 0.06 -0.03 0.43 3.64 -1.91 0.40 116.57 127.65 1ajc h LYS 91 Ca -0.27 -0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 58.85 1ajc h LYS 91 Cb 1.12 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 32.94 1ajc h LYS 91 CO 0.81 0.04 -1.00 -0.22 -2.27 0.00 0.00 179.45 176.81 1ajc h LYS 92 N 0.07 0.72 0.00 1.90 1.63 -1.93 -3.36 116.57 115.60 1ajc h LYS 92 Ca 0.44 -0.74 -0.25 0.00 -0.85 0.00 0.00 60.65 59.25 1ajc h LYS 92 Cb 0.78 0.20 -0.04 0.00 -0.60 0.00 0.00 32.23 32.57 1ajc h LYS 92 CO -0.75 1.32 -1.57 1.79 -3.45 0.00 0.00 179.45 176.79 1ajc h THR 93 N 0.42 0.79 0.00 1.00 1.35 -1.93 -3.47 112.91 111.07 1ajc h THR 93 Ca -0.12 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.22 1ajc h THR 93 Cb 1.65 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 70.39 1ajc h THR 93 CO 0.20 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 176.53 1ajc n GLY 94 N 1.49 0.84 3.88 5.82 0.00 0.14 -5.01 105.19 112.35 1ajc n GLY 94 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1ajc n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajc s LYS 95 N -0.12 3.72 0.45 1.61 1.02 -1.25 -4.73 119.74 120.44 1ajc s LYS 95 Ca 0.00 0.43 -0.25 0.00 0.02 0.00 0.00 55.97 56.17 1ajc s LYS 95 Cb 0.00 -2.37 -0.08 0.00 -0.52 0.00 0.00 37.83 34.86 1ajc s LYS 95 CO 0.00 -0.11 1.45 -2.14 -0.92 0.00 0.00 175.35 173.63 1ajc s PRO 96 N -4.12 3.68 -0.49 -1.68 0.02 -1.26 0.36 135.00 131.51 1ajc s PRO 96 Ca 0.51 2.46 0.04 0.00 0.02 0.00 0.00 61.00 64.02 1ajc s PRO 96 Cb -0.10 -2.66 0.13 0.00 0.02 0.00 0.00 34.50 31.88 1ajc s PRO 96 CO 0.35 -0.84 0.23 0.34 -0.33 0.00 0.00 177.00 176.76 1ajc s ASP 97 N -0.45 4.43 0.31 2.53 -1.08 0.76 -4.61 116.67 118.56 1ajc s ASP 97 Ca 0.61 -2.86 0.06 0.00 -0.52 0.00 0.00 52.55 49.84 1ajc s ASP 97 Cb -0.45 -1.65 0.87 0.00 -1.46 0.00 0.00 42.92 40.23 1ajc s ASP 97 CO 0.58 -0.26 1.61 1.88 0.52 0.00 0.00 175.17 179.50 1ajc h TYR 98 N 6.71 0.36 -3.43 -5.34 0.05 -1.94 0.21 116.97 113.60 1ajc h TYR 98 Ca -0.07 0.05 -0.73 0.00 0.05 0.00 0.00 58.73 58.04 1ajc h TYR 98 Cb 0.92 -0.01 -0.22 0.00 1.01 0.00 0.00 36.73 38.43 1ajc h TYR 98 CO 0.52 -0.32 -0.40 0.08 -1.05 0.00 0.00 178.16 176.99 1ajc s VAL 99 N -5.86 5.12 0.77 -2.88 1.01 -1.26 -4.33 120.40 112.97 1ajc s VAL 99 Ca -0.12 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 60.86 1ajc s VAL 99 Cb 0.29 -3.95 0.05 0.00 0.00 0.00 0.00 36.38 32.77 1ajc s VAL 99 CO 0.78 -0.42 1.15 0.28 0.00 0.00 0.00 175.10 176.88 1ajc s THR 100 N 1.64 2.58 0.53 3.92 -1.32 -1.26 -4.79 115.64 116.93 1ajc s THR 100 Ca 0.04 0.18 0.05 0.00 -1.21 0.00 0.00 61.69 60.75 1ajc s THR 100 Cb -0.21 -3.18 0.02 0.00 -1.51 0.00 0.00 72.50 67.62 1ajc s THR 100 CO 0.08 -0.24 0.33 1.51 -2.21 0.00 0.00 174.62 174.09 1ajc s ASP 101 N -4.49 4.56 0.27 8.08 -4.77 -1.26 -4.85 116.67 114.21 1ajc s ASP 101 Ca 0.60 -1.27 -0.02 0.00 -3.30 0.00 0.00 52.55 48.56 1ajc s ASP 101 Cb -0.11 0.34 0.37 0.00 -1.09 0.00 0.00 42.92 42.43 1ajc s ASP 101 CO 0.50 -1.02 1.84 0.28 0.70 0.00 0.00 175.17 177.47 1ajc h SER 102 N 0.89 0.85 0.89 2.11 0.02 -1.99 -3.04 113.55 113.29 1ajc h SER 102 Ca -0.38 -0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 60.40 1ajc h SER 102 Cb 1.30 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 63.62 1ajc h SER 102 CO 0.60 0.78 -0.46 0.00 -1.14 0.00 0.00 176.83 176.61 1ajc h ALA 103 N 1.34 -1.32 -0.99 3.77 0.00 -1.89 -2.25 119.26 117.92 1ajc h ALA 103 Ca 0.21 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1ajc h ALA 103 Cb 0.22 0.53 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 1ajc h ALA 103 CO -0.01 -1.24 0.63 0.00 0.00 0.00 0.00 179.25 178.63 1ajc h ALA 104 N -1.34 1.37 -0.23 0.00 0.00 -1.66 -2.12 119.26 115.28 1ajc h ALA 104 Ca -0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1ajc h ALA 104 Cb 0.97 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1ajc h ALA 104 CO 0.18 0.41 -0.10 0.66 0.00 0.00 0.00 179.25 180.40 1ajc h SER 105 N 1.14 0.49 -0.88 0.00 4.64 -1.54 -1.07 113.55 116.33 1ajc h SER 105 Ca 0.43 -0.40 0.03 0.00 -0.47 0.00 0.00 61.79 61.38 1ajc h SER 105 Cb 0.18 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.09 1ajc h SER 105 CO -0.18 0.78 0.58 0.00 -0.87 0.00 0.00 176.83 177.13 1ajc h ALA 106 N 0.73 1.15 -0.65 5.18 0.00 -1.17 -1.06 119.26 123.43 1ajc h ALA 106 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ajc h ALA 106 Cb 0.58 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1ajc h ALA 106 CO 0.03 0.45 0.37 1.15 0.00 0.00 0.00 179.25 181.25 1ajc h THR 107 N 1.13 1.20 -0.56 0.00 2.02 -1.27 -1.76 112.91 113.67 1ajc h THR 107 Ca 0.34 -0.49 0.10 0.00 0.77 0.00 0.00 66.41 67.14 1ajc h THR 107 Cb -0.03 0.34 -0.08 0.00 -1.74 0.00 0.00 68.15 66.63 1ajc h THR 107 CO -0.10 0.22 0.11 0.00 0.37 0.00 0.00 175.52 176.11 1ajc h ALA 108 N 1.18 0.64 0.00 6.16 0.00 0.14 0.10 119.26 127.48 1ajc h ALA 108 Ca 0.23 0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.12 1ajc h ALA 108 Cb 0.02 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1ajc h ALA 108 CO -0.04 -0.31 -1.10 0.11 0.00 0.00 0.00 179.25 177.91 1ajc h TRP 109 N 0.24 0.00 0.00 0.00 0.09 -1.36 -1.30 115.95 113.62 1ajc h TRP 109 Ca 0.29 0.00 -0.12 0.00 0.09 0.00 0.00 58.89 59.15 1ajc h TRP 109 Cb 0.41 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 29.64 1ajc h TRP 109 CO -0.25 0.54 -0.63 0.66 0.09 0.00 0.00 178.44 178.86 1ajc h SER 110 N 0.00 0.00 0.00 0.11 4.64 -0.92 -3.26 113.55 114.12 1ajc h SER 110 Ca -0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1ajc h SER 110 Cb 1.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1ajc h SER 110 CO 0.05 0.54 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 1ajc n THR 111 N -3.20 0.00 -1.20 2.95 -2.24 0.32 -0.04 114.28 110.88 1ajc n THR 111 Ca 0.01 -0.45 -0.07 0.00 -2.27 0.00 0.00 64.05 61.27 1ajc n THR 111 Cb 0.76 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.97 1ajc n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ajc n GLY 112 N 0.79 0.86 3.12 3.38 0.00 -0.49 -4.93 105.19 107.92 1ajc n GLY 112 Ca 0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 1ajc n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajc s VAL 113 N -2.09 1.19 0.40 1.61 0.11 -1.25 -4.93 120.40 115.45 1ajc s VAL 113 Ca 0.00 -0.63 -0.23 0.00 -2.93 0.00 0.00 61.98 58.18 1ajc s VAL 113 Cb 0.00 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.75 1ajc s VAL 113 CO 0.00 0.34 1.02 -0.54 -3.33 0.00 0.00 175.10 172.59 1ajc s LYS 114 N -0.26 4.19 0.00 1.54 -0.14 -1.26 -3.97 119.74 119.84 1ajc s LYS 114 Ca 0.04 1.41 0.00 0.00 -1.36 0.00 0.00 55.97 56.06 1ajc s LYS 114 Cb -0.07 -2.47 0.00 0.00 -1.68 0.00 0.00 37.83 33.61 1ajc s LYS 114 CO -0.00 -0.09 0.00 -2.37 -0.76 0.00 0.00 175.35 172.12 1ajc n THR 115 N -0.16 0.00 -4.09 2.17 5.66 -1.26 -4.42 114.28 112.17 1ajc n THR 115 Ca 0.05 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.76 1ajc n THR 115 Cb 0.51 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.22 1ajc n THR 115 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1ajc s TYR 116 N -1.42 3.08 -0.01 1.09 1.13 -1.26 -0.52 117.35 119.45 1ajc s TYR 116 Ca 0.00 0.01 -0.36 0.00 -1.41 0.00 0.00 57.07 55.31 1ajc s TYR 116 Cb 0.00 -1.55 -0.14 0.00 -1.10 0.00 0.00 41.96 39.17 1ajc s TYR 116 CO 0.00 0.51 1.66 0.09 -2.51 0.00 0.00 175.55 175.30 1ajc n ASN 117 N 0.30 2.82 0.00 -0.18 3.02 -1.26 -1.84 115.26 118.12 1ajc n ASN 117 Ca -0.09 1.05 0.00 0.00 -0.03 0.00 0.00 54.58 55.51 1ajc n ASN 117 Cb 0.53 -1.31 0.00 0.00 -0.61 0.00 0.00 39.78 38.38 1ajc n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ajc n GLY 118 N 3.71 2.15 3.74 7.41 0.00 -1.26 -4.93 105.19 116.01 1ajc n GLY 118 Ca 0.21 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 1ajc n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajc s ALA 119 N -1.19 2.11 -0.15 4.61 0.00 -0.77 -0.24 121.76 126.13 1ajc s ALA 119 Ca 0.00 0.45 -0.04 0.00 0.00 0.00 0.00 51.96 52.37 1ajc s ALA 119 Cb 0.00 -3.34 0.07 0.00 0.00 0.00 0.00 23.12 19.85 1ajc s ALA 119 CO 0.00 -1.91 0.17 -0.51 0.00 0.00 0.00 175.76 173.51 1ajc s LEU 120 N -5.81 0.00 -0.24 0.00 1.43 -0.27 -3.83 118.68 109.97 1ajc s LEU 120 Ca 0.65 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.64 1ajc s LEU 120 Cb -0.20 0.20 0.00 0.00 0.03 0.00 0.00 46.19 46.22 1ajc s LEU 120 CO 0.53 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.42 1ajc n GLY 121 N 5.31 0.46 3.05 -3.19 0.00 -1.25 -0.15 105.19 109.42 1ajc n GLY 121 Ca -0.05 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 1ajc n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ajc s VAL 122 N -1.71 0.51 0.31 1.61 -7.23 -1.26 -1.98 120.40 110.66 1ajc s VAL 122 Ca 0.00 -1.01 -0.03 0.00 -1.81 0.00 0.00 61.98 59.13 1ajc s VAL 122 Cb 0.00 -0.57 0.07 0.00 0.56 0.00 0.00 36.38 36.43 1ajc s VAL 122 CO 0.00 -0.35 0.42 -0.90 -0.31 0.00 0.00 175.10 173.96 1ajc n ASP 123 N 1.58 0.23 0.16 4.85 5.68 -0.56 -4.72 116.55 123.77 1ajc n ASP 123 Ca -0.22 -1.27 0.11 0.00 -0.50 0.00 0.00 54.79 52.91 1ajc n ASP 123 Cb 0.55 -0.31 0.57 0.00 -1.14 0.00 0.00 41.12 40.79 1ajc n ASP 123 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1ajc n ILE 124 N -2.33 0.96 0.38 2.12 -5.35 -1.26 -0.30 119.36 113.58 1ajc n ILE 124 Ca 0.06 0.60 0.10 0.00 -0.27 0.00 0.00 62.75 63.24 1ajc n ILE 124 Cb 0.21 -1.58 0.27 0.00 -1.74 0.00 0.00 39.64 36.80 1ajc n ILE 124 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1ajc n HIS 125 N -2.27 0.59 -1.01 4.28 8.25 -1.26 -4.93 115.22 118.87 1ajc n HIS 125 Ca -0.00 -0.29 -0.00 0.00 -0.26 0.00 0.00 57.72 57.16 1ajc n HIS 125 Cb 0.09 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.20 1ajc n HIS 125 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1ajc n GLU 126 N 1.16 -1.26 -2.70 -0.41 1.02 0.59 -4.98 120.64 114.06 1ajc n GLU 126 Ca 0.19 0.33 -0.37 0.00 -0.02 0.00 0.00 57.16 57.29 1ajc n GLU 126 Cb 0.51 -4.27 -0.06 0.00 -0.02 0.00 0.00 31.44 27.59 1ajc n GLU 126 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1ajc s LYS 127 N -1.29 4.44 0.67 3.49 -0.14 -1.26 -4.70 119.74 120.95 1ajc s LYS 127 Ca 0.00 1.39 -0.11 0.00 -1.36 0.00 0.00 55.97 55.89 1ajc s LYS 127 Cb 0.00 -2.69 -0.01 0.00 -1.68 0.00 0.00 37.83 33.45 1ajc s LYS 127 CO 0.00 0.13 1.06 -0.51 -0.76 0.00 0.00 175.35 175.26 1ajc s ASP 128 N -1.62 5.67 -0.07 2.83 1.11 -1.26 -1.49 116.67 121.84 1ajc s ASP 128 Ca 0.53 1.45 -0.04 0.00 0.18 0.00 0.00 52.55 54.67 1ajc s ASP 128 Cb -0.19 -2.37 0.03 0.00 1.07 0.00 0.00 42.92 41.46 1ajc s ASP 128 CO 0.25 -1.24 0.16 -1.00 1.18 0.00 0.00 175.17 174.52 1ajc s HIS 129 N -3.15 -0.18 0.39 4.23 3.76 -0.84 -4.89 115.29 114.60 1ajc s HIS 129 Ca 0.57 0.50 -0.28 0.00 -0.15 0.00 0.00 55.06 55.70 1ajc s HIS 129 Cb -0.12 -0.04 -0.11 0.00 1.11 0.00 0.00 32.58 33.42 1ajc s HIS 129 CO 0.54 -0.16 1.49 -1.25 -0.85 0.00 0.00 174.74 174.51 1ajc s PRO 130 N 0.95 4.04 0.44 8.40 0.04 -1.26 -4.88 135.00 142.73 1ajc s PRO 130 Ca -0.07 2.57 -0.00 0.00 0.04 0.00 0.00 61.00 63.54 1ajc s PRO 130 Cb -0.09 -2.92 -0.01 0.00 0.04 0.00 0.00 34.50 31.52 1ajc s PRO 130 CO -0.05 -0.59 0.67 0.95 0.04 0.00 0.00 177.00 178.02 1ajc s THR 131 N -1.13 4.22 0.52 1.26 -4.23 -1.26 -4.57 115.64 110.44 1ajc s THR 131 Ca 0.54 -0.43 0.19 0.00 -1.18 0.00 0.00 61.69 60.82 1ajc s THR 131 Cb -0.46 -3.56 0.27 0.00 1.34 0.00 0.00 72.50 70.09 1ajc s THR 131 CO 0.63 -0.41 2.14 -0.29 -0.54 0.00 0.00 174.62 176.15 1ajc h ILE 132 N 0.42 0.89 0.14 2.99 6.09 -0.78 0.33 117.51 127.60 1ajc h ILE 132 Ca -0.47 -0.14 -0.30 0.00 -1.37 0.00 0.00 64.86 62.58 1ajc h ILE 132 Cb 1.24 1.08 0.03 0.00 0.47 0.00 0.00 36.82 39.65 1ajc h ILE 132 CO 0.58 0.04 -1.27 0.25 -3.07 0.00 0.00 178.15 174.68 1ajc h LEU 133 N 0.00 0.87 -0.78 2.19 6.46 -1.84 -0.04 115.31 122.16 1ajc h LEU 133 Ca -0.00 -0.84 -0.05 0.00 -0.12 0.00 0.00 57.88 56.87 1ajc h LEU 133 Cb 0.08 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.70 1ajc h LEU 133 CO 0.01 1.62 0.29 -0.33 -0.62 0.00 0.00 178.44 179.41 1ajc h GLU 134 N 0.23 1.17 -0.12 1.25 5.08 -1.60 -0.92 114.58 119.68 1ajc h GLU 134 Ca -0.20 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 57.91 1ajc h GLU 134 Cb 1.95 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 31.01 1ajc h GLU 134 CO 0.24 0.96 -0.05 0.52 -1.00 0.00 0.00 179.01 179.69 1ajc h MET 135 N 1.14 0.24 0.28 2.33 2.86 -0.96 -1.39 114.93 119.41 1ajc h MET 135 Ca 0.26 -0.10 0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1ajc h MET 135 Cb 0.24 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1ajc h MET 135 CO -0.02 0.57 -0.37 0.00 1.06 0.00 0.00 176.91 178.15 1ajc h ALA 136 N 0.66 -0.74 -0.82 6.32 0.00 -0.85 -1.33 119.26 122.49 1ajc h ALA 136 Ca 0.03 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.94 1ajc h ALA 136 Cb 0.50 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 1ajc h ALA 136 CO 0.02 -0.96 0.54 -0.22 0.00 0.00 0.00 179.25 178.62 1ajc h LYS 137 N -0.70 0.72 0.00 0.00 3.64 -1.22 0.10 116.57 119.12 1ajc h LYS 137 Ca -0.01 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1ajc h LYS 137 Cb 0.66 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1ajc h LYS 137 CO -0.12 0.48 -0.10 0.00 -2.27 0.00 0.00 179.45 177.44 1ajc h ALA 138 N 1.59 1.19 -0.01 5.00 0.00 -0.15 -1.60 119.26 125.29 1ajc h ALA 138 Ca 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1ajc h ALA 138 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1ajc h ALA 138 CO -0.16 0.12 -0.19 0.00 0.00 0.00 0.00 179.25 179.03 1ajc n ALA 139 N -2.23 2.94 -0.05 0.00 0.00 -0.00 -4.93 120.51 116.25 1ajc n ALA 139 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1ajc n ALA 139 Cb 0.24 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1ajc n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ajc n GLY 140 N 1.30 0.48 3.75 0.00 0.00 -0.60 -5.06 105.19 105.05 1ajc n GLY 140 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1ajc n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajc s LEU 141 N 0.00 4.50 0.43 0.99 1.02 -1.05 -4.76 118.68 119.83 1ajc s LEU 141 Ca 0.00 2.28 -0.23 0.00 0.02 0.00 0.00 54.13 56.20 1ajc s LEU 141 Cb 0.00 -3.62 -0.08 0.00 0.02 0.00 0.00 46.19 42.51 1ajc s LEU 141 CO 0.00 -0.25 1.09 0.00 0.02 0.00 0.00 176.35 177.21 1ajc s ALA 142 N -0.75 3.01 0.07 4.21 0.00 0.04 -3.91 121.76 124.44 1ajc s ALA 142 Ca 0.48 0.78 0.04 0.00 0.00 0.00 0.00 51.96 53.26 1ajc s ALA 142 Cb -0.33 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 1ajc s ALA 142 CO 0.40 -0.40 -0.11 0.95 0.00 0.00 0.00 175.76 176.60 1ajc s THR 143 N -1.65 0.93 0.02 0.00 -4.23 -1.26 -1.03 115.64 108.42 1ajc s THR 143 Ca 0.61 -1.37 -0.03 0.00 -1.18 0.00 0.00 61.69 59.72 1ajc s THR 143 Cb -0.24 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.52 1ajc s THR 143 CO 0.29 -0.38 0.03 -0.83 -0.54 0.00 0.00 174.62 173.20 1ajc s GLY 144 N -1.95 0.19 -0.08 3.99 0.00 0.42 -2.36 107.32 107.53 1ajc s GLY 144 Ca -0.01 -0.50 -0.02 0.00 0.00 0.00 0.00 44.72 44.19 1ajc s GLY 144 CO 0.01 -0.60 0.01 0.21 0.00 0.00 0.00 173.10 172.74 1ajc s ASN 145 N -1.59 1.65 -0.01 1.64 2.47 0.65 -2.90 114.94 116.85 1ajc s ASN 145 Ca -0.13 -0.13 0.03 0.00 0.42 0.00 0.00 52.86 53.04 1ajc s ASN 145 Cb -0.08 -0.41 -0.00 0.00 -1.45 0.00 0.00 41.25 39.31 1ajc s ASN 145 CO -0.01 -0.21 -0.09 -0.69 -3.72 0.00 0.00 177.10 172.38 1ajc s VAL 146 N 1.99 0.69 0.21 -5.21 1.01 -0.47 -1.08 120.40 117.55 1ajc s VAL 146 Ca 0.04 -0.36 -0.19 0.00 0.00 0.00 0.00 61.98 61.48 1ajc s VAL 146 Cb -0.13 -0.59 0.03 0.00 0.00 0.00 0.00 36.38 35.69 1ajc s VAL 146 CO -0.05 0.20 0.58 -0.55 0.00 0.00 0.00 175.10 175.28 1ajc s SER 147 N -0.09 -0.30 0.00 3.32 0.15 -0.70 -0.51 113.70 115.56 1ajc s SER 147 Ca 0.02 -0.46 0.11 0.00 0.70 0.00 0.00 55.95 56.31 1ajc s SER 147 Cb -0.05 0.62 0.07 0.00 -1.71 0.00 0.00 66.02 64.95 1ajc s SER 147 CO -0.00 -1.12 0.80 0.35 1.20 0.00 0.00 173.24 174.47 1ajc n THR 148 N -0.38 0.00 -2.74 6.45 -2.24 -1.09 -3.99 114.28 110.28 1ajc n THR 148 Ca -0.09 -0.48 -0.22 0.00 -2.27 0.00 0.00 64.05 60.99 1ajc n THR 148 Cb 0.62 1.20 0.09 0.00 -2.10 0.00 0.00 70.33 70.14 1ajc n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajc s ALA 149 N -0.99 4.06 0.26 6.98 0.00 -1.26 -1.74 121.76 129.07 1ajc s ALA 149 Ca 0.12 -1.86 -0.29 0.00 0.00 0.00 0.00 51.96 49.92 1ajc s ALA 149 Cb 0.09 -1.82 -0.09 0.00 0.00 0.00 0.00 23.12 21.29 1ajc s ALA 149 CO 0.16 -1.22 1.24 -1.83 0.00 0.00 0.00 175.76 174.11 1ajc s GLU 150 N -4.96 4.46 0.43 0.00 -1.05 -1.26 -2.44 118.70 113.88 1ajc s GLU 150 Ca 0.64 2.02 0.20 0.00 -0.15 0.00 0.00 54.97 57.69 1ajc s GLU 150 Cb -0.06 -3.16 1.07 0.00 -0.44 0.00 0.00 34.13 31.55 1ajc s GLU 150 CO 0.42 -0.09 1.55 -0.07 0.95 0.00 0.00 175.26 178.02 1ajc h LEU 151 N 4.26 0.00 -0.87 1.83 3.38 -1.74 0.96 115.31 123.13 1ajc h LEU 151 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1ajc h LEU 151 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1ajc h LEU 151 CO 0.70 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.23 1ajc n GLN 152 N -2.34 1.59 -1.18 1.13 3.00 -1.26 -3.78 117.38 114.54 1ajc n GLN 152 Ca -0.01 -0.87 -0.32 0.00 -0.01 0.00 0.00 57.00 55.79 1ajc n GLN 152 Cb 0.29 -1.45 0.11 0.00 0.00 0.00 0.00 30.24 29.19 1ajc n GLN 152 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1ajc s GLY 153 N -1.87 1.97 0.17 1.08 0.00 0.33 -4.65 107.32 104.35 1ajc s GLY 153 Ca 0.37 0.63 -0.24 0.00 0.00 0.00 0.00 44.72 45.48 1ajc s GLY 153 CO 0.32 1.02 1.58 0.00 0.00 0.00 0.00 173.10 176.02 1ajc h ALA 154 N -0.97 -0.24 0.17 3.20 0.00 -1.91 0.21 119.26 119.71 1ajc h ALA 154 Ca -0.45 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ajc h ALA 154 Cb 1.27 0.84 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 1ajc h ALA 154 CO 0.48 -0.77 -0.15 1.15 0.00 0.00 0.00 179.25 179.96 1ajc h THR 155 N -0.24 0.67 0.00 0.00 2.02 -1.92 0.33 112.91 113.78 1ajc h THR 155 Ca 0.18 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 67.18 1ajc h THR 155 Cb 0.56 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1ajc h THR 155 CO -0.63 0.00 -0.85 1.55 0.37 0.00 0.00 175.52 175.97 1ajc h PRO 156 N -0.34 0.03 -0.46 6.66 0.13 -1.79 -3.30 132.00 132.93 1ajc h PRO 156 Ca -0.00 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.03 1ajc h PRO 156 Cb 0.31 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.43 1ajc h PRO 156 CO -0.03 0.86 0.06 0.00 -0.23 0.00 0.00 178.00 178.67 1ajc h ALA 157 N 1.13 0.62 -0.00 -0.56 0.00 -0.45 -2.96 119.26 117.03 1ajc h ALA 157 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ajc h ALA 157 Cb 1.49 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1ajc h ALA 157 CO 0.11 0.35 0.36 0.00 0.00 0.00 0.00 179.25 180.08 1ajc h ALA 158 N 0.95 1.36 0.00 0.00 0.00 -1.01 0.13 119.26 120.69 1ajc h ALA 158 Ca 0.14 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1ajc h ALA 158 Cb 0.41 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1ajc h ALA 158 CO 0.01 -0.36 -0.75 -0.07 0.00 0.00 0.00 179.25 178.08 1ajc h LEU 159 N 0.00 0.00 0.00 0.00 4.07 -1.68 -3.41 115.31 114.29 1ajc h LEU 159 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1ajc h LEU 159 Cb 0.72 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.46 1ajc h LEU 159 CO -0.00 0.41 -0.88 1.33 -1.08 0.00 0.00 178.44 178.22 1ajc n VAL 160 N -3.06 0.00 -4.32 1.22 0.24 0.22 -4.46 118.33 108.17 1ajc n VAL 160 Ca -0.01 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.03 1ajc n VAL 160 Cb 0.72 0.42 -0.09 0.00 -1.47 0.00 0.00 33.84 33.41 1ajc n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ajc s ALA 161 N -1.76 2.93 -0.30 2.33 0.00 0.09 -4.57 121.76 120.47 1ajc s ALA 161 Ca 0.00 -1.57 -0.01 0.00 0.00 0.00 0.00 51.96 50.38 1ajc s ALA 161 Cb 0.00 -0.66 0.10 0.00 0.00 0.00 0.00 23.12 22.56 1ajc s ALA 161 CO 0.00 0.40 0.10 -1.01 0.00 0.00 0.00 175.76 175.25 1ajc s HIS 162 N -1.91 1.51 0.09 0.00 0.09 -1.25 -3.92 115.29 109.90 1ajc s HIS 162 Ca 0.26 -1.59 0.02 0.00 -0.00 0.00 0.00 55.06 53.75 1ajc s HIS 162 Cb -0.08 -1.58 -0.04 0.00 -0.00 0.00 0.00 32.58 30.88 1ajc s HIS 162 CO 0.16 -0.86 -0.06 0.14 -0.00 0.00 0.00 174.74 174.11 1ajc s VAL 163 N 1.69 0.66 -2.32 -0.90 -7.23 0.79 -4.96 120.40 108.13 1ajc s VAL 163 Ca 0.09 -1.93 0.29 0.00 -1.81 0.00 0.00 61.98 58.62 1ajc s VAL 163 Cb -0.17 -1.67 0.66 0.00 0.56 0.00 0.00 36.38 35.76 1ajc s VAL 163 CO -0.26 -0.88 1.89 0.35 -0.31 0.00 0.00 175.10 175.88 1ajc n THR 164 N -0.03 0.01 -3.65 5.32 -2.24 -1.26 -1.11 114.28 111.32 1ajc n THR 164 Ca -0.12 -0.17 -0.07 0.00 -2.27 0.00 0.00 64.05 61.42 1ajc n THR 164 Cb 0.61 0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.92 1ajc n THR 164 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ajc s SER 165 N -1.97 -0.88 0.55 3.42 0.15 -1.25 -4.09 113.70 109.64 1ajc s SER 165 Ca 0.41 1.42 0.24 0.00 0.70 0.00 0.00 55.95 58.71 1ajc s SER 165 Cb 0.21 1.35 1.49 0.00 -1.71 0.00 0.00 66.02 67.36 1ajc s SER 165 CO 0.34 -0.23 2.10 0.08 1.20 0.00 0.00 173.24 176.73 1ajc h ARG 166 N 7.11 0.00 0.00 5.44 0.11 -0.91 -2.29 114.38 123.83 1ajc h ARG 166 Ca -0.30 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.77 1ajc h ARG 166 Cb 1.21 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.29 1ajc h ARG 166 CO 0.18 0.00 -0.03 0.87 0.10 0.00 0.00 179.97 181.09 1ajc h LYS 167 N 0.00 0.00 -3.85 0.08 1.57 -1.95 -3.36 116.57 109.07 1ajc h LYS 167 Ca 0.10 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.36 1ajc h LYS 167 Cb 0.44 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.77 1ajc h LYS 167 CO -0.00 0.03 2.58 0.00 -0.57 0.00 0.00 179.45 181.48 1ajc h TYR 169 N 6.84 -1.10 -4.41 0.00 -1.99 -1.88 -1.16 116.97 113.28 1ajc h TYR 169 Ca 0.49 -0.03 -0.42 0.00 2.00 0.00 0.00 58.73 60.77 1ajc h TYR 169 Cb 0.39 0.36 -0.10 0.00 2.00 0.00 0.00 36.73 39.38 1ajc h TYR 169 CO 1.65 -0.68 -0.36 0.41 -0.00 0.00 0.00 178.16 179.18 1ajc n GLY 170 N -1.23 3.37 0.33 3.88 0.00 -1.26 -1.34 105.19 108.94 1ajc n GLY 170 Ca -0.15 -2.02 -0.06 0.00 0.00 0.00 0.00 46.02 43.79 1ajc n GLY 170 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ajc n PRO 171 N -0.66 -0.30 0.11 1.61 -0.02 -1.26 -1.52 135.00 132.95 1ajc n PRO 171 Ca -0.02 1.23 -0.14 0.00 -2.02 0.00 0.00 63.50 62.55 1ajc n PRO 171 Cb 0.47 -1.81 -0.08 0.00 -0.02 0.00 0.00 33.50 32.06 1ajc n PRO 171 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1ajc h SER 172 N 0.00 -1.29 -0.59 2.55 0.02 -1.97 -1.49 113.55 110.77 1ajc h SER 172 Ca 0.18 0.13 0.03 0.00 -0.84 0.00 0.00 61.79 61.29 1ajc h SER 172 Cb 0.38 0.47 -0.04 0.00 0.14 0.00 0.00 62.40 63.35 1ajc h SER 172 CO -0.77 -0.47 0.35 0.00 -1.14 0.00 0.00 176.83 174.80 1ajc h ALA 173 N -0.77 0.76 -0.59 3.77 0.00 -1.81 -2.75 119.26 117.89 1ajc h ALA 173 Ca -0.01 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1ajc h ALA 173 Cb 0.63 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1ajc h ALA 173 CO -0.22 0.07 0.25 1.15 0.00 0.00 0.00 179.25 180.51 1ajc h THR 174 N 0.69 0.84 -0.82 0.00 2.02 -1.06 0.34 112.91 114.93 1ajc h THR 174 Ca 0.24 -0.16 0.11 0.00 0.77 0.00 0.00 66.41 67.38 1ajc h THR 174 Cb 0.04 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 66.73 1ajc h THR 174 CO -0.11 0.08 0.53 0.28 0.37 0.00 0.00 175.52 176.68 1ajc h SER 175 N 0.46 0.63 0.19 4.18 0.02 -0.96 0.35 113.55 118.42 1ajc h SER 175 Ca 0.28 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.20 1ajc h SER 175 Cb 0.29 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1ajc h SER 175 CO -0.25 0.35 -1.87 -1.84 -1.14 0.00 0.00 176.83 172.08 1ajc n GLU 176 N -4.52 0.65 -0.06 3.45 0.28 -0.74 -4.38 120.64 115.33 1ajc n GLU 176 Ca 0.15 -0.10 -0.06 0.00 -0.16 0.00 0.00 57.16 56.98 1ajc n GLU 176 Cb 0.39 -1.58 -0.08 0.00 1.43 0.00 0.00 31.44 31.60 1ajc n GLU 176 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1ajc n LYS 177 N -2.42 1.75 -3.36 3.44 5.02 0.11 -4.79 118.16 117.91 1ajc n LYS 177 Ca -0.07 0.02 -0.26 0.00 -2.02 0.00 0.00 58.31 55.98 1ajc n LYS 177 Cb 0.66 -1.27 -0.08 0.00 -0.02 0.00 0.00 35.03 34.32 1ajc n LYS 177 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ajc h PRO 179 N 4.31 0.13 0.00 0.00 0.11 -1.74 0.05 132.00 134.86 1ajc h PRO 179 Ca 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1ajc h PRO 179 Cb 0.78 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1ajc h PRO 179 CO 0.63 0.09 0.00 0.41 -0.21 0.00 0.00 178.00 178.92 1ajc n GLY 180 N -1.22 -0.86 0.00 -0.55 0.00 -1.26 -0.99 105.19 100.31 1ajc n GLY 180 Ca 0.00 0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.14 1ajc n GLY 180 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ajc n ASN 181 N -1.83 0.70 -4.70 1.61 5.03 -0.46 -4.10 115.26 111.52 1ajc n ASN 181 Ca 0.01 -0.73 -0.42 0.00 0.87 0.00 0.00 54.58 54.31 1ajc n ASN 181 Cb 0.09 1.04 -0.03 0.00 -1.02 0.00 0.00 39.78 39.87 1ajc n ASN 181 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ajc s ALA 182 N -2.23 3.79 0.55 5.41 0.00 -0.12 -0.78 121.76 128.39 1ajc s ALA 182 Ca 0.04 1.46 0.25 0.00 0.00 0.00 0.00 51.96 53.70 1ajc s ALA 182 Cb 0.09 -3.74 1.45 0.00 0.00 0.00 0.00 23.12 20.92 1ajc s ALA 182 CO 0.51 -1.15 2.05 1.25 0.00 0.00 0.00 175.76 178.42 1ajc h LEU 183 N 8.22 0.00 -0.93 0.00 5.85 -1.88 0.43 115.31 127.01 1ajc h LEU 183 Ca -0.45 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.16 1ajc h LEU 183 Cb 1.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1ajc h LEU 183 CO 0.95 0.00 -0.50 -0.33 -0.34 0.00 0.00 178.44 178.22 1ajc h GLU 184 N 0.00 0.09 -0.99 1.25 3.07 -1.89 -2.89 114.58 113.22 1ajc h GLU 184 Ca 0.16 -0.05 -0.66 0.00 -0.50 0.00 0.00 59.36 58.31 1ajc h GLU 184 Cb 0.69 0.00 -0.29 0.00 -0.84 0.00 0.00 28.75 28.31 1ajc h GLU 184 CO -0.00 0.57 0.82 1.63 -1.40 0.00 0.00 179.01 180.63 1ajc n LYS 185 N -3.95 2.65 -0.68 2.33 5.02 0.93 -4.85 118.16 119.61 1ajc n LYS 185 Ca -0.02 -3.27 0.00 0.00 -2.02 0.00 0.00 58.31 53.00 1ajc n LYS 185 Cb 0.53 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.26 1ajc n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ajc n GLY 186 N -0.94 0.08 3.71 0.72 0.00 -1.09 -4.77 105.19 102.90 1ajc n GLY 186 Ca 0.62 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.33 1ajc n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ajc s GLY 187 N -2.00 1.82 0.58 -0.02 0.00 0.11 -4.90 107.32 102.92 1ajc s GLY 187 Ca 0.00 0.56 0.37 0.00 0.00 0.00 0.00 44.72 45.64 1ajc s GLY 187 CO 0.00 0.95 2.12 1.70 0.00 0.00 0.00 173.10 177.87 1ajc h LYS 188 N -1.33 0.00 0.00 2.90 1.63 -1.77 -3.32 116.57 114.68 1ajc h LYS 188 Ca -0.44 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.36 1ajc h LYS 188 Cb 1.26 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.89 1ajc h LYS 188 CO 0.46 0.02 0.00 0.41 -3.45 0.00 0.00 179.45 176.89 1ajc n GLY 189 N -0.40 2.86 3.81 5.01 0.00 0.04 -4.66 105.19 111.85 1ajc n GLY 189 Ca -0.01 -1.99 -0.29 0.00 0.00 0.00 0.00 46.02 43.73 1ajc n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ajc s SER 190 N 0.00 3.95 0.19 1.61 1.04 -1.26 -4.72 113.70 114.51 1ajc s SER 190 Ca 0.00 1.04 -0.16 0.00 0.48 0.00 0.00 55.95 57.31 1ajc s SER 190 Cb 0.00 -1.65 0.17 0.00 0.10 0.00 0.00 66.02 64.64 1ajc s SER 190 CO 0.00 -2.28 1.64 0.40 0.98 0.00 0.00 173.24 173.97 1ajc h ILE 191 N -1.31 0.44 -0.44 -1.02 2.04 -1.06 -0.11 117.51 116.04 1ajc h ILE 191 Ca -0.49 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 1ajc h ILE 191 Cb 1.31 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1ajc h ILE 191 CO 0.62 0.00 0.23 0.74 0.00 0.00 0.00 178.15 179.74 1ajc h THR 192 N -0.03 1.17 -0.87 -0.27 2.02 -1.46 -0.35 112.91 113.13 1ajc h THR 192 Ca 0.25 -0.45 0.02 0.00 0.77 0.00 0.00 66.41 67.01 1ajc h THR 192 Cb 0.41 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 1ajc h THR 192 CO -0.55 0.18 0.57 -0.33 0.37 0.00 0.00 175.52 175.75 1ajc h GLU 193 N 0.58 1.09 0.00 6.66 5.08 -1.43 -0.87 114.58 125.69 1ajc h GLU 193 Ca 0.15 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 1ajc h GLU 193 Cb 0.08 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 1ajc h GLU 193 CO -0.02 0.72 -0.48 1.96 -1.00 0.00 0.00 179.01 180.19 1ajc h GLN 194 N 1.12 0.00 0.40 2.33 4.20 -0.76 -1.92 115.11 120.48 1ajc h GLN 194 Ca 0.33 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.03 1ajc h GLN 194 Cb -0.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1ajc h GLN 194 CO -0.10 0.48 -0.28 1.25 -0.67 0.00 0.00 178.83 179.51 1ajc h LEU 195 N 0.00 -0.73 -1.38 1.46 7.12 0.30 0.29 115.31 122.37 1ajc h LEU 195 Ca -0.00 0.05 0.02 0.00 0.13 0.00 0.00 57.88 58.07 1ajc h LEU 195 Cb 0.88 0.23 -0.03 0.00 -0.53 0.00 0.00 40.66 41.20 1ajc h LEU 195 CO 0.06 -0.43 0.43 -0.07 -0.13 0.00 0.00 178.44 178.30 1ajc h LEU 196 N -0.67 0.72 -0.46 2.25 4.07 -1.13 -2.11 115.31 117.98 1ajc h LEU 196 Ca -0.04 -0.01 -0.13 0.00 0.08 0.00 0.00 57.88 57.78 1ajc h LEU 196 Cb 0.57 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.12 1ajc h LEU 196 CO 0.01 0.51 -0.22 0.78 -1.08 0.00 0.00 178.44 178.44 1ajc h ASN 197 N 0.84 0.98 -0.52 -0.43 2.35 -0.56 -3.16 115.58 115.09 1ajc h ASN 197 Ca 0.25 -0.40 0.11 0.00 -0.55 0.00 0.00 56.30 55.70 1ajc h ASN 197 Cb -0.04 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.03 1ajc h ASN 197 CO -0.06 1.17 0.35 0.00 -1.65 0.00 0.00 177.43 177.24 1ajc h ALA 198 N 0.85 2.17 -6.36 -0.83 0.00 0.26 -3.47 119.26 111.87 1ajc h ALA 198 Ca 0.10 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.64 1ajc h ALA 198 Cb 0.80 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1ajc h ALA 198 CO 0.07 -0.29 -0.80 -2.13 0.00 0.00 0.00 179.25 176.10 1ajc n ARG 199 N -4.45 -1.40 -3.03 0.00 0.63 -1.17 -4.94 116.66 102.29 1ajc n ARG 199 Ca 0.08 0.89 -0.39 0.00 -0.92 0.00 0.00 57.85 57.52 1ajc n ARG 199 Cb 0.42 -3.33 -0.06 0.00 0.45 0.00 0.00 32.46 29.93 1ajc n ARG 199 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ajc s ALA 200 N -3.05 3.47 0.18 5.13 0.00 -1.26 -4.95 121.76 121.28 1ajc s ALA 200 Ca 0.06 0.30 -0.14 0.00 0.00 0.00 0.00 51.96 52.18 1ajc s ALA 200 Cb -0.03 -2.90 0.17 0.00 0.00 0.00 0.00 23.12 20.37 1ajc s ALA 200 CO 0.86 0.30 1.68 -0.44 0.00 0.00 0.00 175.76 178.16 1ajc h ASP 201 N 4.45 -0.24 -3.23 0.00 5.19 -1.79 -3.40 116.42 117.41 1ajc h ASP 201 Ca -0.47 0.12 -0.62 0.00 -0.62 0.00 0.00 57.03 55.44 1ajc h ASP 201 Cb 1.21 0.22 -0.34 0.00 0.18 0.00 0.00 39.33 40.59 1ajc h ASP 201 CO 0.66 -0.08 -0.85 -0.69 -3.12 0.00 0.00 179.24 175.16 1ajc s VAL 202 N -6.18 1.71 -0.10 -1.35 1.01 -1.00 -0.39 120.40 114.10 1ajc s VAL 202 Ca -0.14 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 1ajc s VAL 202 Cb 0.16 -1.54 0.03 0.00 0.00 0.00 0.00 36.38 35.03 1ajc s VAL 202 CO 0.72 0.48 0.00 -0.89 0.00 0.00 0.00 175.10 175.42 1ajc s THR 203 N 0.98 0.46 -0.02 3.92 2.01 -0.99 -0.26 115.64 121.74 1ajc s THR 203 Ca -0.05 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 61.89 1ajc s THR 203 Cb -0.15 -0.69 0.01 0.00 0.01 0.00 0.00 72.50 71.69 1ajc s THR 203 CO -0.03 0.16 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.26 1ajc s LEU 204 N 1.93 1.65 0.00 4.42 1.43 -0.24 -0.85 118.68 127.01 1ajc s LEU 204 Ca 0.04 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 1ajc s LEU 204 Cb -0.13 -0.33 0.00 0.00 0.03 0.00 0.00 46.19 45.76 1ajc s LEU 204 CO -0.06 0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.13 1ajc n GLY 205 N 3.50 -1.55 0.00 -3.19 0.00 -0.38 -1.72 105.19 101.85 1ajc n GLY 205 Ca -0.20 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1ajc n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajc n GLY 206 N -0.12 1.52 2.06 -0.02 0.00 -1.02 -2.08 105.19 105.53 1ajc n GLY 206 Ca 0.00 -1.77 -0.06 0.00 0.00 0.00 0.00 46.02 44.19 1ajc n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajc n GLY 207 N 5.00 0.45 0.23 -0.02 0.00 0.15 -2.34 105.19 108.66 1ajc n GLY 207 Ca 0.00 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.68 1ajc n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajc h ALA 208 N 0.26 1.00 -0.02 4.61 0.00 -0.58 -3.32 119.26 121.22 1ajc h ALA 208 Ca -0.14 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1ajc h ALA 208 Cb 1.10 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1ajc h ALA 208 CO 0.15 0.00 -0.51 -0.22 0.00 0.00 0.00 179.25 178.67 1ajc h LYS 209 N 0.00 -0.62 0.00 0.00 3.11 -1.57 0.24 116.57 117.73 1ajc h LYS 209 Ca 0.00 0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 57.88 1ajc h LYS 209 Cb 0.57 0.14 -0.00 0.00 -1.00 0.00 0.00 32.23 31.94 1ajc h LYS 209 CO 0.00 -0.41 -0.01 1.15 -2.81 0.00 0.00 179.45 177.36 1ajc h THR 210 N -0.64 0.31 0.00 1.00 2.02 -1.82 -1.02 112.91 112.75 1ajc h THR 210 Ca 0.02 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1ajc h THR 210 Cb 0.71 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1ajc h THR 210 CO -0.36 0.01 0.00 0.49 0.37 0.00 0.00 175.52 176.03 1ajc n PHE 211 N -3.50 0.07 0.11 3.16 3.01 0.07 -0.92 117.46 119.46 1ajc n PHE 211 Ca -0.03 0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1ajc n PHE 211 Cb 0.10 -0.55 -0.02 0.00 -0.01 0.00 0.00 39.48 39.01 1ajc n PHE 211 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ajc h ALA 212 N 2.36 0.60 -2.56 4.37 0.00 -1.16 -0.66 119.26 122.21 1ajc h ALA 212 Ca 0.00 -0.59 -0.56 0.00 0.00 0.00 0.00 54.91 53.75 1ajc h ALA 212 Cb 0.20 -0.07 0.18 0.00 0.00 0.00 0.00 17.79 18.09 1ajc h ALA 212 CO 0.00 0.79 -0.22 -1.91 0.00 0.00 0.00 179.25 177.91 1ajc n GLU 213 N -3.23 0.45 -4.74 0.00 4.07 -0.09 -4.56 120.64 112.54 1ajc n GLU 213 Ca 0.01 0.20 -0.33 0.00 -0.06 0.00 0.00 57.16 56.98 1ajc n GLU 213 Cb 0.79 -1.94 -0.12 0.00 -0.06 0.00 0.00 31.44 30.11 1ajc n GLU 213 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 1ajc s THR 214 N -1.81 3.24 0.58 6.31 -1.32 -1.26 -0.37 115.64 121.02 1ajc s THR 214 Ca 0.69 -0.75 -0.19 0.00 -1.21 0.00 0.00 61.69 60.23 1ajc s THR 214 Cb -0.37 -2.32 -0.04 0.00 -1.51 0.00 0.00 72.50 68.26 1ajc s THR 214 CO 0.54 0.52 1.19 0.00 -2.21 0.00 0.00 174.62 174.66 1ajc s ALA 215 N -0.82 2.57 -1.09 11.08 0.00 -0.59 -4.82 121.76 128.10 1ajc s ALA 215 Ca 0.13 0.95 0.10 0.00 0.00 0.00 0.00 51.96 53.14 1ajc s ALA 215 Cb -0.11 -3.43 0.15 0.00 0.00 0.00 0.00 23.12 19.73 1ajc s ALA 215 CO 0.03 -1.08 0.96 0.25 0.00 0.00 0.00 175.76 175.92 1ajc n THR 216 N -1.55 0.36 -2.89 0.00 -2.24 -1.26 -1.20 114.28 105.49 1ajc n THR 216 Ca 0.13 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1ajc n THR 216 Cb 0.50 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 1ajc n THR 216 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajc n ALA 217 N 0.50 0.00 -0.51 6.98 0.00 -1.26 -4.86 120.51 121.36 1ajc n ALA 217 Ca 0.07 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.58 1ajc n ALA 217 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.73 1ajc n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ajc n GLY 218 N 0.00 -2.06 0.00 0.00 0.00 -1.26 -2.58 105.19 99.29 1ajc n GLY 218 Ca 0.00 -1.37 0.03 0.00 0.00 0.00 0.00 46.02 44.68 1ajc n GLY 218 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ajc n GLU 219 N -2.95 0.25 -0.95 1.61 -0.58 -1.26 -2.00 120.64 114.75 1ajc n GLU 219 Ca -0.01 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.78 1ajc n GLU 219 Cb 0.24 -1.39 0.12 0.00 -0.57 0.00 0.00 31.44 29.84 1ajc n GLU 219 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 1ajc n TRP 220 N -0.89 0.00 -1.26 -0.32 8.01 -1.26 -5.09 117.44 116.63 1ajc n TRP 220 Ca 0.05 -0.98 -0.36 0.00 -1.31 0.00 0.00 57.50 54.91 1ajc n TRP 220 Cb 0.02 -0.19 0.08 0.00 -2.01 0.00 0.00 31.31 29.21 1ajc n TRP 220 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.69 177.62 1ajc n GLN 221 N -0.39 0.34 0.00 -0.99 7.27 -0.85 -2.15 117.38 120.61 1ajc n GLN 221 Ca 0.12 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.36 1ajc n GLN 221 Cb 0.89 -2.04 0.00 0.00 2.41 0.00 0.00 30.24 31.50 1ajc n GLN 221 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ajc n GLY 222 N 1.32 0.95 3.81 1.69 0.00 -0.34 -4.89 105.19 107.73 1ajc n GLY 222 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1ajc n GLY 222 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ajc s LYS 223 N 0.00 4.12 0.67 1.61 2.47 -0.91 -4.77 119.74 122.93 1ajc s LYS 223 Ca 0.00 0.58 -0.16 0.00 -1.56 0.00 0.00 55.97 54.84 1ajc s LYS 223 Cb 0.00 -3.26 0.01 0.00 -1.46 0.00 0.00 37.83 33.12 1ajc s LYS 223 CO 0.00 0.58 1.16 0.95 0.16 0.00 0.00 175.35 178.20 1ajc s THR 224 N -0.82 2.83 0.57 3.43 -4.23 -1.26 -1.54 115.64 114.61 1ajc s THR 224 Ca 0.27 0.41 0.25 0.00 -1.18 0.00 0.00 61.69 61.44 1ajc s THR 224 Cb -0.18 -2.97 0.33 0.00 1.34 0.00 0.00 72.50 71.02 1ajc s THR 224 CO 0.16 -0.21 2.20 -0.07 -0.54 0.00 0.00 174.62 176.15 1ajc h LEU 225 N 0.05 0.00 -0.10 4.79 4.07 -0.58 -0.74 115.31 122.80 1ajc h LEU 225 Ca -0.48 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.41 1ajc h LEU 225 Cb 1.27 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.01 1ajc h LEU 225 CO 0.53 0.00 -0.24 -0.09 -1.08 0.00 0.00 178.44 177.55 1ajc h ARG 226 N 0.00 0.34 -0.77 1.13 2.43 -1.38 -1.39 114.38 114.75 1ajc h ARG 226 Ca 0.02 -0.23 0.06 0.00 -0.81 0.00 0.00 59.98 59.01 1ajc h ARG 226 Cb 0.07 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.60 1ajc h ARG 226 CO -0.00 0.84 0.46 0.93 -1.51 0.00 0.00 179.97 180.69 1ajc h GLU 227 N -0.11 0.83 -0.55 0.20 5.08 -1.54 -1.52 114.58 116.98 1ajc h GLU 227 Ca -0.00 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1ajc h GLU 227 Cb 0.85 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 1ajc h GLU 227 CO 0.05 0.55 0.36 0.37 -1.00 0.00 0.00 179.01 179.34 1ajc h GLN 228 N 0.85 0.72 -0.03 2.33 4.15 -1.13 0.12 115.11 122.12 1ajc h GLN 228 Ca 0.33 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.75 1ajc h GLN 228 Cb 0.15 -0.16 -0.05 0.00 0.21 0.00 0.00 27.48 27.63 1ajc h GLN 228 CO -0.17 0.48 -0.25 0.00 -1.93 0.00 0.00 178.83 176.96 1ajc h ALA 229 N 1.20 -0.31 0.06 3.38 0.00 -0.27 0.72 119.26 124.04 1ajc h ALA 229 Ca 0.20 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ajc h ALA 229 Cb -0.08 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ajc h ALA 229 CO -0.04 -0.74 -0.03 0.93 0.00 0.00 0.00 179.25 179.36 1ajc h GLU 230 N -0.37 -0.08 -0.04 0.00 5.08 -1.06 -1.28 114.58 116.83 1ajc h GLU 230 Ca 0.07 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1ajc h GLU 230 Cb 0.47 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ajc h GLU 230 CO -0.25 0.05 0.09 0.00 -1.00 0.00 0.00 179.01 177.90 1ajc h ALA 231 N 0.74 1.34 -0.00 3.43 0.00 -0.50 -1.33 119.26 122.95 1ajc h ALA 231 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ajc h ALA 231 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ajc h ALA 231 CO 0.01 -0.11 -0.49 0.54 0.00 0.00 0.00 179.25 179.20 1ajc n ARG 232 N -3.39 0.10 0.00 0.00 1.74 0.22 -4.94 116.66 110.39 1ajc n ARG 232 Ca -0.02 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1ajc n ARG 232 Cb 0.17 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 1ajc n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ajc n GLY 233 N 1.48 1.51 3.77 -0.13 0.00 -0.50 -5.05 105.19 106.27 1ajc n GLY 233 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1ajc n GLY 233 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ajc s TYR 234 N -2.00 2.73 -0.36 1.61 2.02 -0.55 -4.06 117.35 116.74 1ajc s TYR 234 Ca 0.00 1.34 -0.06 0.00 -0.37 0.00 0.00 57.07 57.98 1ajc s TYR 234 Cb 0.00 -3.79 0.06 0.00 -0.40 0.00 0.00 41.96 37.83 1ajc s TYR 234 CO 0.00 -2.41 0.14 1.14 -1.57 0.00 0.00 175.55 172.86 1ajc s GLN 235 N -2.20 2.51 0.49 -0.62 -2.07 0.27 -4.37 119.66 113.67 1ajc s GLN 235 Ca 0.56 -1.34 -0.20 0.00 -1.82 0.00 0.00 55.36 52.56 1ajc s GLN 235 Cb -0.41 -3.52 -0.08 0.00 -1.09 0.00 0.00 33.01 27.90 1ajc s GLN 235 CO 0.54 -0.79 1.02 -0.51 -1.32 0.00 0.00 175.29 174.23 1ajc s LEU 236 N 1.36 3.82 -0.12 2.60 1.02 -1.26 -2.14 118.68 123.96 1ajc s LEU 236 Ca 0.00 1.85 -0.09 0.00 0.02 0.00 0.00 54.13 55.91 1ajc s LEU 236 Cb -0.21 -4.55 0.04 0.00 0.02 0.00 0.00 46.19 41.49 1ajc s LEU 236 CO 0.01 -0.73 0.30 -0.69 0.02 0.00 0.00 176.35 175.26 1ajc s VAL 237 N -2.10 -0.01 0.00 -1.59 1.01 -0.85 -4.94 120.40 111.92 1ajc s VAL 237 Ca 0.65 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.67 1ajc s VAL 237 Cb -0.15 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.80 1ajc s VAL 237 CO 0.21 0.02 0.68 -1.54 0.00 0.00 0.00 175.10 174.46 1ajc n SER 238 N 3.33 1.22 -3.86 3.32 3.41 -1.26 -1.25 113.62 118.53 1ajc n SER 238 Ca -0.17 -1.45 -0.08 0.00 -0.26 0.00 0.00 58.87 56.91 1ajc n SER 238 Cb 0.57 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.48 1ajc n SER 238 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1ajc s ASP 239 N -0.45 -0.23 0.14 4.04 1.47 -1.26 -4.57 116.67 115.81 1ajc s ASP 239 Ca 0.00 -0.65 -0.21 0.00 1.18 0.00 0.00 52.55 52.87 1ajc s ASP 239 Cb 0.00 0.66 0.02 0.00 -0.34 0.00 0.00 42.92 43.26 1ajc s ASP 239 CO 0.00 -1.23 1.66 0.00 0.68 0.00 0.00 175.17 176.28 1ajc h ALA 240 N 2.10 0.00 0.06 2.11 0.00 -0.81 -0.96 119.26 121.76 1ajc h ALA 240 Ca -0.23 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1ajc h ALA 240 Cb 1.25 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 19.35 1ajc h ALA 240 CO 0.29 -0.58 -0.38 0.00 0.00 0.00 0.00 179.25 178.58 1ajc h ALA 241 N 0.99 -0.86 -0.52 0.00 0.00 -1.88 0.20 119.26 117.20 1ajc h ALA 241 Ca 0.13 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1ajc h ALA 241 Cb 0.34 0.80 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1ajc h ALA 241 CO -0.31 -0.96 0.35 0.66 0.00 0.00 0.00 179.25 178.98 1ajc h SER 242 N -0.52 0.35 -0.72 0.00 4.64 -1.95 0.10 113.55 115.45 1ajc h SER 242 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1ajc h SER 242 Cb 0.54 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 1ajc h SER 242 CO -0.23 0.22 0.19 0.25 -0.87 0.00 0.00 176.83 176.39 1ajc h LEU 243 N 0.39 1.09 -1.05 5.97 5.85 -0.18 -2.39 115.31 125.01 1ajc h LEU 243 Ca 0.23 -0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 1ajc h LEU 243 Cb 0.40 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1ajc h LEU 243 CO -0.06 1.03 -0.48 0.78 -0.34 0.00 0.00 178.44 179.38 1ajc h ASN 244 N 1.09 0.00 1.30 1.25 2.35 0.18 -2.97 115.58 118.78 1ajc h ASN 244 Ca 0.23 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.96 1ajc h ASN 244 Cb 0.36 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.73 1ajc h ASN 244 CO 0.00 0.48 -0.10 0.77 -1.65 0.00 0.00 177.43 176.93 1ajc h SER 245 N 0.00 0.00 -2.30 5.81 4.64 -0.66 -3.44 113.55 117.61 1ajc h SER 245 Ca -0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1ajc h SER 245 Cb 0.84 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.94 1ajc h SER 245 CO 0.06 0.10 1.30 -0.69 -0.87 0.00 0.00 176.83 176.74 1ajc s VAL 246 N -3.48 3.12 -0.10 0.95 1.01 -1.07 -4.86 120.40 115.96 1ajc s VAL 246 Ca 0.03 0.14 0.19 0.00 0.00 0.00 0.00 61.98 62.34 1ajc s VAL 246 Cb 0.08 -3.12 -0.29 0.00 0.00 0.00 0.00 36.38 33.06 1ajc s VAL 246 CO 0.62 -0.04 0.28 0.35 0.00 0.00 0.00 175.10 176.31 1ajc n THR 247 N 6.41 0.59 -4.23 3.92 -2.24 -1.26 -4.99 114.28 112.48 1ajc n THR 247 Ca 0.23 -0.63 -0.21 0.00 -2.27 0.00 0.00 64.05 61.17 1ajc n THR 247 Cb 0.43 -0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.34 1ajc n THR 247 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ajc s GLU 248 N -3.01 0.98 -0.30 -0.78 8.01 -1.26 -4.98 118.70 117.36 1ajc s GLU 248 Ca -0.08 -1.08 -0.01 0.00 0.01 0.00 0.00 54.97 53.80 1ajc s GLU 248 Cb 0.10 -1.10 0.19 0.00 -4.31 0.00 0.00 34.13 29.00 1ajc s GLU 248 CO 0.83 0.25 0.59 0.00 0.01 0.00 0.00 175.26 176.94 1ajc s ALA 249 N -1.31 -2.18 0.06 5.21 0.00 -1.26 -4.86 121.76 117.42 1ajc s ALA 249 Ca 0.03 1.79 -0.02 0.00 0.00 0.00 0.00 51.96 53.76 1ajc s ALA 249 Cb -0.10 -2.14 0.01 0.00 0.00 0.00 0.00 23.12 20.90 1ajc s ALA 249 CO 0.03 -1.32 0.10 0.27 0.00 0.00 0.00 175.76 174.84 1ajc n ASN 250 N 5.43 -0.29 0.18 0.00 2.04 -0.85 -4.86 115.26 116.91 1ajc n ASN 250 Ca -0.01 -1.24 0.14 0.00 -0.44 0.00 0.00 54.58 53.03 1ajc n ASN 250 Cb 0.51 0.50 0.73 0.00 -2.53 0.00 0.00 39.78 38.99 1ajc n ASN 250 CO 0.00 0.00 0.00 1.56 -0.44 0.00 0.00 177.26 178.38 1ajc h GLN 251 N 0.00 0.00 -0.28 -3.83 1.08 -1.93 0.18 115.11 110.33 1ajc h GLN 251 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1ajc h GLN 251 Cb 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1ajc h GLN 251 CO 0.06 0.00 0.00 1.04 -0.95 0.00 0.00 178.83 178.98 1ajc n GLN 252 N -4.23 2.11 -2.86 1.46 1.13 -1.26 -4.52 117.38 109.22 1ajc n GLN 252 Ca 0.02 -1.96 -0.11 0.00 -1.94 0.00 0.00 57.00 53.01 1ajc n GLN 252 Cb 0.29 -1.38 0.05 0.00 0.11 0.00 0.00 30.24 29.31 1ajc n GLN 252 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1ajc n LYS 253 N 1.06 1.05 -1.97 -1.09 5.02 -0.61 -4.91 118.16 116.71 1ajc n LYS 253 Ca 0.14 -2.51 -0.36 0.00 -2.02 0.00 0.00 58.31 53.56 1ajc n LYS 253 Cb 0.49 -1.10 0.04 0.00 -0.02 0.00 0.00 35.03 34.43 1ajc n LYS 253 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ajc s PRO 254 N -0.96 2.98 -0.07 1.97 0.04 0.53 -2.01 135.00 137.49 1ajc s PRO 254 Ca 0.28 1.90 -0.05 0.00 0.04 0.00 0.00 61.00 63.17 1ajc s PRO 254 Cb 0.35 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.86 1ajc s PRO 254 CO -0.06 -1.21 0.15 -1.17 0.04 0.00 0.00 177.00 174.76 1ajc s LEU 255 N -3.98 4.35 -0.26 -3.56 2.96 0.48 -0.56 118.68 118.11 1ajc s LEU 255 Ca 0.77 0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 55.05 1ajc s LEU 255 Cb -0.32 -2.31 0.10 0.00 0.50 0.00 0.00 46.19 44.16 1ajc s LEU 255 CO 0.35 0.34 0.18 -0.22 -1.32 0.00 0.00 176.35 175.69 1ajc s LEU 256 N -1.45 0.21 -0.32 -0.68 2.96 -0.91 -2.35 118.68 116.14 1ajc s LEU 256 Ca 0.21 -0.89 -0.11 0.00 -0.22 0.00 0.00 54.13 53.11 1ajc s LEU 256 Cb -0.12 -0.00 -0.01 0.00 0.50 0.00 0.00 46.19 46.55 1ajc s LEU 256 CO 0.11 -0.40 0.18 -0.83 -1.32 0.00 0.00 176.35 174.09 1ajc s GLY 257 N 2.21 1.90 -0.33 7.98 0.00 -0.03 -2.01 107.32 117.04 1ajc s GLY 257 Ca 0.08 -1.37 -0.02 0.00 0.00 0.00 0.00 44.72 43.41 1ajc s GLY 257 CO -0.28 0.72 0.06 1.08 0.00 0.00 0.00 173.10 174.68 1ajc s LEU 258 N 1.66 4.32 -0.06 0.66 1.43 -0.38 -1.25 118.68 125.06 1ajc s LEU 258 Ca 0.05 -1.52 0.18 0.00 -1.03 0.00 0.00 54.13 51.81 1ajc s LEU 258 Cb -0.17 -1.74 0.59 0.00 0.03 0.00 0.00 46.19 44.89 1ajc s LEU 258 CO 0.08 -0.34 1.50 0.49 0.23 0.00 0.00 176.35 178.30 1ajc n PHE 259 N 4.60 1.05 -3.59 0.29 3.72 -0.88 -4.26 117.46 118.39 1ajc n PHE 259 Ca -0.09 -0.58 -0.07 0.00 -0.05 0.00 0.00 57.45 56.67 1ajc n PHE 259 Cb 0.43 -0.13 -0.04 0.00 -0.94 0.00 0.00 39.48 38.80 1ajc n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ajc s ALA 260 N -1.49 -2.00 0.12 4.37 0.00 -1.26 -4.93 121.76 116.57 1ajc s ALA 260 Ca 0.43 1.58 -0.12 0.00 0.00 0.00 0.00 51.96 53.84 1ajc s ALA 260 Cb 0.26 -0.55 -0.11 0.00 0.00 0.00 0.00 23.12 22.72 1ajc s ALA 260 CO 0.24 -0.43 1.38 -0.44 0.00 0.00 0.00 175.76 176.50 1ajc h ASP 261 N 2.21 0.95 0.00 0.00 3.32 -1.93 0.15 116.42 121.13 1ajc h ASP 261 Ca -0.14 -0.56 0.00 0.00 0.02 0.00 0.00 57.03 56.36 1ajc h ASP 261 Cb 1.18 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.45 1ajc h ASP 261 CO 0.27 1.34 0.00 0.61 -1.72 0.00 0.00 179.24 179.73 1ajc n GLY 262 N 0.45 1.71 3.90 2.75 0.00 -1.26 -1.83 105.19 110.91 1ajc n GLY 262 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 1ajc n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ajc s ASN 263 N 0.68 5.83 0.87 1.61 0.01 -1.26 0.30 114.94 122.98 1ajc s ASN 263 Ca 0.00 0.96 -0.13 0.00 -0.71 0.00 0.00 52.86 52.98 1ajc s ASN 263 Cb 0.00 -2.00 0.12 0.00 0.41 0.00 0.00 41.25 39.78 1ajc s ASN 263 CO 0.00 -0.97 1.17 -0.04 -1.51 0.00 0.00 177.10 175.76 1ajc s MET 264 N -5.03 1.45 0.53 -0.60 -1.94 -0.71 -4.88 119.30 108.11 1ajc s MET 264 Ca 0.53 0.13 -0.21 0.00 -1.71 0.00 0.00 55.69 54.43 1ajc s MET 264 Cb -0.11 -1.89 -0.06 0.00 2.01 0.00 0.00 34.83 34.79 1ajc s MET 264 CO 0.48 -1.96 1.18 -2.14 -0.01 0.00 0.00 175.02 172.57 1ajc s PRO 265 N -5.49 3.37 0.26 2.03 0.02 -1.26 -5.00 135.00 128.92 1ajc s PRO 265 Ca 0.64 1.78 -0.21 0.00 0.02 0.00 0.00 61.00 63.23 1ajc s PRO 265 Cb -0.12 -2.14 -0.09 0.00 0.02 0.00 0.00 34.50 32.17 1ajc s PRO 265 CO 0.51 -0.88 0.78 0.14 -0.33 0.00 0.00 177.00 177.22 1ajc s VAL 266 N -1.60 4.49 0.05 3.83 -7.23 -1.26 -5.01 120.40 113.67 1ajc s VAL 266 Ca 0.71 1.38 -0.25 0.00 -1.81 0.00 0.00 61.98 62.01 1ajc s VAL 266 Cb -0.29 -3.87 -0.13 0.00 0.56 0.00 0.00 36.38 32.65 1ajc s VAL 266 CO 0.33 0.15 1.38 -0.09 -0.31 0.00 0.00 175.10 176.57 1ajc h ARG 267 N 3.25 -0.79 -6.09 4.82 2.43 -1.89 -3.42 114.38 112.68 1ajc h ARG 267 Ca -0.48 0.05 -0.65 0.00 -0.81 0.00 0.00 59.98 58.10 1ajc h ARG 267 Cb 1.19 0.18 -0.10 0.00 -0.42 0.00 0.00 29.97 30.82 1ajc h ARG 267 CO 0.65 -0.53 -0.59 -1.58 -1.51 0.00 0.00 179.97 176.41 1ajc s TRP 268 N -4.98 3.23 0.23 2.20 0.51 -1.26 -0.74 118.94 118.12 1ajc s TRP 268 Ca -0.13 0.14 0.10 0.00 -2.12 0.00 0.00 56.10 54.09 1ajc s TRP 268 Cb 0.02 -1.68 -0.04 0.00 -0.81 0.00 0.00 33.47 30.96 1ajc s TRP 268 CO 0.41 0.53 -0.08 -0.51 -0.51 0.00 0.00 176.95 176.79 1ajc s LEU 269 N -2.01 2.99 -0.16 2.99 1.43 0.15 -3.71 118.68 120.36 1ajc s LEU 269 Ca 0.25 -0.67 -0.35 0.00 -1.03 0.00 0.00 54.13 52.33 1ajc s LEU 269 Cb -0.12 -1.59 0.14 0.00 0.03 0.00 0.00 46.19 44.65 1ajc s LEU 269 CO 0.17 0.06 1.30 -0.83 0.23 0.00 0.00 176.35 177.28 1ajc s GLY 270 N -3.24 -0.33 0.81 -3.19 0.00 -1.26 -1.11 107.32 99.00 1ajc s GLY 270 Ca 0.28 1.38 -0.11 0.00 0.00 0.00 0.00 44.72 46.27 1ajc s GLY 270 CO 0.17 0.41 1.09 2.56 0.00 0.00 0.00 173.10 177.33 1ajc s PRO 271 N -2.27 2.01 0.68 2.90 0.04 -1.26 -4.93 135.00 132.18 1ajc s PRO 271 Ca 0.12 0.88 -0.13 0.00 0.04 0.00 0.00 61.00 61.91 1ajc s PRO 271 Cb 0.02 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.67 1ajc s PRO 271 CO -0.04 -1.74 1.09 0.21 0.04 0.00 0.00 177.00 176.56 1ajc s LYS 272 N -5.00 2.78 0.43 4.56 2.20 -1.26 -4.64 119.74 118.80 1ajc s LYS 272 Ca 0.61 1.23 -0.22 0.00 -0.36 0.00 0.00 55.97 57.23 1ajc s LYS 272 Cb -0.16 -1.96 -0.10 0.00 -1.51 0.00 0.00 37.83 34.10 1ajc s LYS 272 CO 0.56 -1.25 0.98 0.00 -0.36 0.00 0.00 175.35 175.28 1ajc s ALA 273 N -2.62 3.01 0.17 3.13 0.00 -0.83 -5.00 121.76 119.62 1ajc s ALA 273 Ca 0.63 0.50 0.02 0.00 0.00 0.00 0.00 51.96 53.11 1ajc s ALA 273 Cb -0.18 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 1ajc s ALA 273 CO 0.46 -0.02 -0.00 0.95 0.00 0.00 0.00 175.76 177.15 1ajc s THR 274 N -2.02 0.66 0.05 0.00 -4.23 -1.06 -4.72 115.64 104.32 1ajc s THR 274 Ca 0.62 -1.98 -0.32 0.00 -1.18 0.00 0.00 61.69 58.84 1ajc s THR 274 Cb -0.13 -2.08 -0.11 0.00 1.34 0.00 0.00 72.50 71.52 1ajc s THR 274 CO 0.17 -0.50 1.86 0.00 -0.54 0.00 0.00 174.62 175.61 1ajc n TYR 275 N -0.22 2.48 -1.52 3.99 4.19 -1.26 -0.61 117.16 124.21 1ajc n TYR 275 Ca -0.07 -0.14 -0.17 0.00 3.31 0.00 0.00 57.90 60.84 1ajc n TYR 275 Cb 0.63 -2.72 -0.07 0.00 0.49 0.00 0.00 39.34 37.67 1ajc n TYR 275 CO 0.00 0.00 0.00 0.72 0.91 0.00 0.00 176.86 178.49 1ajc n HIS 276 N 6.23 -0.26 -0.35 2.98 8.25 -1.25 -4.83 115.22 125.99 1ajc n HIS 276 Ca 0.20 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.79 1ajc n HIS 276 Cb 0.35 -2.98 0.33 0.00 1.12 0.00 0.00 29.99 28.81 1ajc n HIS 276 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ajc h GLY 277 N 0.00 1.79 2.00 -1.41 0.00 -0.93 0.20 103.07 104.72 1ajc h GLY 277 Ca -0.34 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 46.63 1ajc h GLY 277 CO 0.49 -0.08 -0.00 3.45 0.00 0.00 0.00 176.54 180.41 1ajc h ASN 278 N 0.75 0.00 0.00 0.19 -1.07 -1.79 0.50 115.58 114.15 1ajc h ASN 278 Ca 0.58 0.00 -0.36 0.00 0.07 0.00 0.00 56.30 56.59 1ajc h ASN 278 Cb 0.93 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 37.11 1ajc h ASN 278 CO -0.39 0.00 -2.37 -0.38 0.07 0.00 0.00 177.43 174.37 1ajc n ILE 279 N -3.12 1.38 1.01 6.14 5.41 0.54 -4.64 119.36 126.07 1ajc n ILE 279 Ca -0.03 -0.52 0.11 0.00 1.00 0.00 0.00 62.75 63.32 1ajc n ILE 279 Cb 0.10 -1.38 0.01 0.00 -0.71 0.00 0.00 39.64 37.66 1ajc n ILE 279 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1ajc n ASP 280 N -3.26 0.98 -4.15 4.38 8.00 -0.16 -4.95 116.55 117.39 1ajc n ASP 280 Ca -0.43 -0.86 -0.20 0.00 0.71 0.00 0.00 54.79 54.01 1ajc n ASP 280 Cb 0.95 0.72 -0.13 0.00 -0.02 0.00 0.00 41.12 42.63 1ajc n ASP 280 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1ajc s LYS 281 N -2.92 0.96 1.04 -1.24 1.02 0.17 -5.03 119.74 113.73 1ajc s LYS 281 Ca 0.11 -0.77 -0.13 0.00 0.02 0.00 0.00 55.97 55.19 1ajc s LYS 281 Cb 0.17 -0.97 0.14 0.00 -0.52 0.00 0.00 37.83 36.65 1ajc s LYS 281 CO 0.78 0.24 0.65 -2.30 -0.92 0.00 0.00 175.35 173.80 1ajc n PRO 282 N 1.88 -1.17 -2.32 -1.68 -0.02 -1.26 -4.53 135.00 125.90 1ajc n PRO 282 Ca -0.18 -0.30 -0.43 0.00 -2.02 0.00 0.00 63.50 60.57 1ajc n PRO 282 Cb 0.55 -2.03 -0.02 0.00 -0.02 0.00 0.00 33.50 31.98 1ajc n PRO 282 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ajc s ALA 283 N -2.42 3.47 0.37 3.55 0.00 -1.26 -4.65 121.76 120.83 1ajc s ALA 283 Ca 0.62 0.38 -0.25 0.00 0.00 0.00 0.00 51.96 52.70 1ajc s ALA 283 Cb -0.21 -3.74 -0.09 0.00 0.00 0.00 0.00 23.12 19.09 1ajc s ALA 283 CO 0.64 -1.57 1.09 0.08 0.00 0.00 0.00 175.76 176.00 1ajc s VAL 284 N 4.22 3.53 -0.10 0.00 1.01 0.40 -4.61 120.40 124.84 1ajc s VAL 284 Ca 0.60 1.27 0.03 0.00 0.00 0.00 0.00 61.98 63.89 1ajc s VAL 284 Cb -0.22 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1ajc s VAL 284 CO 0.22 0.10 -0.21 -0.89 0.00 0.00 0.00 175.10 174.32 1ajc s THR 285 N -1.49 1.89 0.17 3.92 2.01 -1.26 -0.54 115.64 120.33 1ajc s THR 285 Ca 0.55 -0.91 -0.30 0.00 0.31 0.00 0.00 61.69 61.34 1ajc s THR 285 Cb -0.26 -1.65 -0.08 0.00 0.01 0.00 0.00 72.50 70.52 1ajc s THR 285 CO 0.33 0.52 1.21 0.00 -0.69 0.00 0.00 174.62 175.99 1ajc s THR 287 N 0.12 4.98 0.39 0.00 2.01 -0.26 -4.91 115.64 117.96 1ajc s THR 287 Ca 0.54 0.06 -0.27 0.00 0.31 0.00 0.00 61.69 62.33 1ajc s THR 287 Cb -0.33 -3.36 -0.11 0.00 0.01 0.00 0.00 72.50 68.72 1ajc s THR 287 CO 0.36 0.29 1.32 -2.65 -0.69 0.00 0.00 174.62 173.25 1ajc n PRO 288 N 4.96 2.15 -2.18 4.92 -0.02 -1.26 0.30 135.00 143.87 1ajc n PRO 288 Ca -0.15 0.76 -0.43 0.00 -2.02 0.00 0.00 63.50 61.66 1ajc n PRO 288 Cb 0.52 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 1ajc n PRO 288 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1ajc s ASN 289 N -0.38 6.76 0.51 2.55 3.84 0.08 -4.72 114.94 123.58 1ajc s ASN 289 Ca 0.58 1.98 0.30 0.00 0.21 0.00 0.00 52.86 55.92 1ajc s ASN 289 Cb -0.52 -2.54 1.29 0.00 -0.55 0.00 0.00 41.25 38.94 1ajc s ASN 289 CO 0.61 -0.88 1.97 -0.65 -2.79 0.00 0.00 177.10 175.35 1ajc h PRO 290 N 9.10 0.00 -0.56 0.43 0.11 -1.90 -3.17 132.00 136.00 1ajc h PRO 290 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1ajc h PRO 290 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1ajc h PRO 290 CO 0.96 0.10 0.00 1.04 -0.21 0.00 0.00 178.00 179.90 1ajc n GLN 291 N -3.30 4.16 0.22 1.05 6.02 -1.26 -4.29 117.38 119.98 1ajc n GLN 291 Ca -0.00 -2.99 0.10 0.00 -0.01 0.00 0.00 57.00 54.10 1ajc n GLN 291 Cb 0.32 -2.04 0.45 0.00 1.02 0.00 0.00 30.24 29.99 1ajc n GLN 291 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1ajc h ARG 292 N 3.73 0.00 -3.56 -1.09 0.11 -1.87 -3.48 114.38 108.22 1ajc h ARG 292 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ajc h ARG 292 Cb 1.68 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.76 1ajc h ARG 292 CO 0.34 0.21 -0.91 0.09 0.10 0.00 0.00 179.97 179.80 1ajc n ASN 293 N -3.34 -8.14 0.04 0.08 3.02 -1.26 -4.25 115.26 101.41 1ajc n ASN 293 Ca 0.00 1.60 0.13 0.00 -0.03 0.00 0.00 54.58 56.28 1ajc n ASN 293 Cb 0.43 -4.72 0.52 0.00 -0.61 0.00 0.00 39.78 35.40 1ajc n ASN 293 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ajc n ASP 294 N -2.02 0.32 0.03 6.41 9.92 -1.26 -2.56 116.55 127.39 1ajc n ASP 294 Ca 0.00 0.53 0.13 0.00 -0.53 0.00 0.00 54.79 54.92 1ajc n ASP 294 Cb 0.31 -0.62 0.35 0.00 -0.64 0.00 0.00 41.12 40.52 1ajc n ASP 294 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1ajc n SER 295 N -1.80 0.48 -4.32 -2.24 3.41 -1.26 -4.74 113.62 103.15 1ajc n SER 295 Ca 0.06 0.18 -0.35 0.00 -0.26 0.00 0.00 58.87 58.51 1ajc n SER 295 Cb 0.36 -0.14 -0.14 0.00 -0.26 0.00 0.00 64.21 64.03 1ajc n SER 295 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ajc s VAL 296 N -3.06 3.38 0.65 -3.33 1.01 -1.06 -0.12 120.40 117.87 1ajc s VAL 296 Ca 0.10 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.43 1ajc s VAL 296 Cb 0.16 -2.53 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 1ajc s VAL 296 CO 0.65 0.43 1.18 -2.16 0.00 0.00 0.00 175.10 175.19 1ajc s PRO 297 N 1.41 2.66 0.56 2.72 0.04 -1.26 -4.85 135.00 136.28 1ajc s PRO 297 Ca 0.05 1.69 0.01 0.00 0.04 0.00 0.00 61.00 62.79 1ajc s PRO 297 Cb -0.14 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.53 1ajc s PRO 297 CO -0.03 -1.41 0.78 0.95 0.04 0.00 0.00 177.00 177.33 1ajc s THR 298 N -1.92 2.65 0.14 1.26 -4.23 -1.26 -4.88 115.64 107.39 1ajc s THR 298 Ca 0.74 -0.65 -0.18 0.00 -1.18 0.00 0.00 61.69 60.41 1ajc s THR 298 Cb -0.27 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.55 1ajc s THR 298 CO 0.39 0.00 1.74 0.25 -0.54 0.00 0.00 174.62 176.46 1ajc h LEU 299 N 0.05 0.07 -0.45 4.79 5.85 -1.96 0.25 115.31 123.90 1ajc h LEU 299 Ca -0.42 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.40 1ajc h LEU 299 Cb 1.30 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.30 1ajc h LEU 299 CO 0.52 0.07 0.11 0.00 -0.34 0.00 0.00 178.44 178.81 1ajc h ALA 300 N 1.18 0.52 -0.81 1.25 0.00 -1.89 0.17 119.26 119.67 1ajc h ALA 300 Ca 0.12 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1ajc h ALA 300 Cb 0.10 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1ajc h ALA 300 CO -0.13 -0.29 0.47 1.96 0.00 0.00 0.00 179.25 181.26 1ajc h GLN 301 N 0.26 1.12 -0.53 0.00 4.20 -1.76 -0.61 115.11 117.79 1ajc h GLN 301 Ca 0.22 -0.12 -0.12 0.00 0.06 0.00 0.00 58.65 58.70 1ajc h GLN 301 Cb 0.26 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1ajc h GLN 301 CO -0.27 0.81 -0.13 0.52 -0.67 0.00 0.00 178.83 179.09 1ajc h MET 302 N 1.12 1.01 -0.05 1.46 2.86 -0.00 -1.60 114.93 119.74 1ajc h MET 302 Ca 0.29 -0.38 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1ajc h MET 302 Cb -0.00 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1ajc h MET 302 CO -0.05 1.07 -0.01 1.15 1.06 0.00 0.00 176.91 180.13 1ajc h THR 303 N 0.90 0.96 -0.47 2.22 2.02 -0.18 0.39 112.91 118.74 1ajc h THR 303 Ca 0.13 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.26 1ajc h THR 303 Cb 0.70 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 1ajc h THR 303 CO 0.05 0.00 0.09 -0.78 0.37 0.00 0.00 175.52 175.25 1ajc h ASP 304 N 0.00 0.68 -0.21 4.18 3.58 -1.01 0.13 116.42 123.77 1ajc h ASP 304 Ca 0.02 -0.12 -0.05 0.00 0.42 0.00 0.00 57.03 57.29 1ajc h ASP 304 Cb 0.03 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 1ajc h ASP 304 CO -0.04 0.69 -0.08 0.11 -2.88 0.00 0.00 179.24 177.04 1ajc h LYS 305 N 0.70 0.43 -0.52 0.28 1.79 -0.90 -0.49 116.57 117.86 1ajc h LYS 305 Ca 0.15 -0.18 0.05 0.00 -2.18 0.00 0.00 60.65 58.50 1ajc h LYS 305 Cb 0.30 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.89 1ajc h LYS 305 CO 0.00 0.70 0.24 0.00 -1.08 0.00 0.00 179.45 179.31 1ajc h ALA 306 N 0.72 0.66 -0.54 3.86 0.00 -0.59 -1.56 119.26 121.81 1ajc h ALA 306 Ca 0.05 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1ajc h ALA 306 Cb 0.56 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1ajc h ALA 306 CO 0.03 -0.12 0.03 0.82 0.00 0.00 0.00 179.25 180.01 1ajc h ILE 307 N 0.47 1.25 -0.56 0.00 2.04 -0.80 -0.50 117.51 119.42 1ajc h ILE 307 Ca 0.23 -1.02 0.02 0.00 1.00 0.00 0.00 64.86 65.09 1ajc h ILE 307 Cb 0.17 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1ajc h ILE 307 CO -0.18 0.37 0.35 -0.08 0.00 0.00 0.00 178.15 178.61 1ajc h GLU 308 N 0.83 0.69 0.17 2.37 4.81 -0.21 -2.45 114.58 120.79 1ajc h GLU 308 Ca 0.16 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1ajc h GLU 308 Cb 0.45 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1ajc h GLU 308 CO 0.02 0.46 -0.08 -0.07 -0.73 0.00 0.00 179.01 178.60 1ajc h LEU 309 N 0.71 -0.20 -1.79 1.64 3.38 -1.14 -3.36 115.31 114.56 1ajc h LEU 309 Ca 0.21 0.01 0.38 0.00 0.09 0.00 0.00 57.88 58.57 1ajc h LEU 309 Cb -0.03 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1ajc h LEU 309 CO -0.07 0.13 0.90 -0.07 0.09 0.00 0.00 178.44 179.42 1ajc h LEU 310 N -0.77 0.12 -0.57 1.67 3.38 -1.17 0.17 115.31 118.14 1ajc h LEU 310 Ca -0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ajc h LEU 310 Cb 0.18 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1ajc h LEU 310 CO 0.04 -0.01 0.00 0.77 0.09 0.00 0.00 178.44 179.33 1ajc h SER 311 N 0.09 0.00 0.59 -0.43 4.64 -1.58 -2.94 113.55 113.92 1ajc h SER 311 Ca 0.66 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.98 1ajc h SER 311 Cb 2.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.48 1ajc h SER 311 CO -0.12 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.13 1ajc n LYS 312 N -2.43 0.18 -2.83 4.77 4.76 0.58 -4.55 118.16 118.64 1ajc n LYS 312 Ca 0.03 0.45 -0.42 0.00 -2.87 0.00 0.00 58.31 55.51 1ajc n LYS 312 Cb 0.32 -1.87 -0.04 0.00 -1.84 0.00 0.00 35.03 31.60 1ajc n LYS 312 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1ajc s ASN 313 N -4.16 7.02 0.42 4.39 3.84 -1.11 -4.95 114.94 120.38 1ajc s ASN 313 Ca 0.03 1.25 0.13 0.00 0.21 0.00 0.00 52.86 54.48 1ajc s ASN 313 Cb 0.09 -2.48 0.89 0.00 -0.55 0.00 0.00 41.25 39.19 1ajc s ASN 313 CO 0.35 -0.45 1.93 -0.33 -2.79 0.00 0.00 177.10 175.82 1ajc h GLU 314 N 7.33 0.04 -0.26 0.43 4.39 -1.90 -3.14 114.58 121.47 1ajc h GLU 314 Ca -0.28 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.33 1ajc h GLU 314 Cb 1.12 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 1ajc h GLU 314 CO 0.86 0.27 -0.18 -0.22 -1.16 0.00 0.00 179.01 178.58 1ajc h LYS 315 N 0.04 0.45 0.00 2.33 3.11 -1.92 -3.49 116.57 117.08 1ajc h LYS 315 Ca 0.01 -0.14 0.00 0.00 -2.81 0.00 0.00 60.65 57.70 1ajc h LYS 315 Cb 0.42 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.61 1ajc h LYS 315 CO 0.03 0.62 0.00 0.41 -2.81 0.00 0.00 179.45 177.70 1ajc n GLY 316 N -0.56 1.51 3.23 5.01 0.00 -1.19 -4.90 105.19 108.29 1ajc n GLY 316 Ca 0.00 -2.13 -0.09 0.00 0.00 0.00 0.00 46.02 43.80 1ajc n GLY 316 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ajc s PHE 317 N -1.30 0.22 -0.10 1.61 -0.12 -1.24 -0.78 117.98 116.26 1ajc s PHE 317 Ca 0.00 -0.64 0.03 0.00 -0.05 0.00 0.00 56.93 56.27 1ajc s PHE 317 Cb 0.00 -0.08 0.01 0.00 -0.63 0.00 0.00 43.02 42.32 1ajc s PHE 317 CO 0.00 -0.57 -0.19 0.12 -0.05 0.00 0.00 175.22 174.52 1ajc s PHE 318 N -3.89 2.23 -0.04 3.49 5.36 -0.20 -1.78 117.98 123.16 1ajc s PHE 318 Ca 0.08 -0.98 0.01 0.00 -0.96 0.00 0.00 56.93 55.08 1ajc s PHE 318 Cb 0.05 -1.54 0.02 0.00 -0.34 0.00 0.00 43.02 41.21 1ajc s PHE 318 CO -0.09 -0.44 -0.05 -1.17 -1.46 0.00 0.00 175.22 172.01 1ajc s LEU 319 N 0.64 1.35 -0.13 6.12 2.96 -0.16 -0.43 118.68 129.04 1ajc s LEU 319 Ca -0.13 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1ajc s LEU 319 Cb -0.16 -0.47 0.00 0.00 0.50 0.00 0.00 46.19 46.06 1ajc s LEU 319 CO 0.03 -0.05 -0.21 -1.58 -1.32 0.00 0.00 176.35 173.23 1ajc s GLN 320 N 0.89 3.10 -0.08 1.98 0.74 -1.14 0.48 119.66 125.62 1ajc s GLN 320 Ca -0.12 -0.83 0.05 0.00 0.05 0.00 0.00 55.36 54.51 1ajc s GLN 320 Cb -0.14 -2.43 -0.00 0.00 1.10 0.00 0.00 33.01 31.53 1ajc s GLN 320 CO 0.00 0.09 -0.24 0.08 -0.55 0.00 0.00 175.29 174.67 1ajc s VAL 321 N 0.59 1.99 -0.19 1.34 1.01 0.66 -1.37 120.40 124.43 1ajc s VAL 321 Ca -0.12 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1ajc s VAL 321 Cb -0.16 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.54 1ajc s VAL 321 CO 0.03 0.55 -0.16 -0.70 0.00 0.00 0.00 175.10 174.82 1ajc s GLU 322 N 0.16 2.64 -0.88 2.72 2.12 0.33 -0.96 118.70 124.83 1ajc s GLU 322 Ca -0.13 -0.84 -0.19 0.00 0.36 0.00 0.00 54.97 54.17 1ajc s GLU 322 Cb -0.16 -2.49 0.12 0.00 0.26 0.00 0.00 34.13 31.85 1ajc s GLU 322 CO 0.07 -0.29 1.10 0.20 -0.54 0.00 0.00 175.26 175.79 1ajc s GLY 323 N 1.32 1.82 -0.06 -1.50 0.00 -0.63 -2.69 107.32 105.58 1ajc s GLY 323 Ca 0.02 -2.60 -0.20 0.00 0.00 0.00 0.00 44.72 41.95 1ajc s GLY 323 CO -0.11 2.02 0.80 0.00 0.00 0.00 0.00 173.10 175.81 1ajc h ALA 324 N 8.98 -0.19 0.00 3.20 0.00 -1.90 -2.54 119.26 126.82 1ajc h ALA 324 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ajc h ALA 324 Cb 1.03 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1ajc h ALA 324 CO 1.13 -0.26 0.08 0.77 0.00 0.00 0.00 179.25 180.97 1ajc h SER 325 N -0.89 0.00 -0.18 0.00 0.02 -1.90 -2.94 113.55 107.66 1ajc h SER 325 Ca -0.02 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.98 1ajc h SER 325 Cb 0.53 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.00 1ajc h SER 325 CO 0.03 0.00 -0.30 0.40 -1.14 0.00 0.00 176.83 175.82 1ajc h ILE 326 N 0.00 0.31 0.20 3.27 2.04 -1.77 0.40 117.51 121.97 1ajc h ILE 326 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1ajc h ILE 326 Cb 0.16 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1ajc h ILE 326 CO 0.00 0.00 -0.17 -0.78 0.00 0.00 0.00 178.15 177.20 1ajc h ASP 327 N -0.35 -0.46 -0.25 1.72 1.82 -0.46 0.47 116.42 118.92 1ajc h ASP 327 Ca 0.11 0.04 0.04 0.00 -0.39 0.00 0.00 57.03 56.83 1ajc h ASP 327 Cb 0.52 0.15 -0.04 0.00 0.68 0.00 0.00 39.33 40.65 1ajc h ASP 327 CO -0.37 -0.27 0.00 0.11 -1.61 0.00 0.00 179.24 177.10 1ajc h LYS 328 N -0.39 0.08 -0.04 0.28 1.57 -1.58 0.19 116.57 116.68 1ajc h LYS 328 Ca -0.01 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 1ajc h LYS 328 Cb 0.36 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1ajc h LYS 328 CO -0.03 0.05 -0.34 1.96 -0.57 0.00 0.00 179.45 180.52 1ajc h GLN 329 N 0.08 0.08 -0.51 3.15 1.08 0.01 0.39 115.11 119.38 1ajc h GLN 329 Ca 0.12 -0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.19 1ajc h GLN 329 Cb 0.15 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 1ajc h GLN 329 CO -0.19 0.41 -0.05 0.22 -0.95 0.00 0.00 178.83 178.27 1ajc h ASP 330 N 0.07 0.89 -0.51 1.46 1.82 0.88 0.61 116.42 121.64 1ajc h ASP 330 Ca 0.01 -0.25 -0.12 0.00 -0.39 0.00 0.00 57.03 56.28 1ajc h ASP 330 Cb 0.64 -0.24 -0.02 0.00 0.68 0.00 0.00 39.33 40.40 1ajc h ASP 330 CO 0.05 0.98 -0.13 0.45 -1.61 0.00 0.00 179.24 178.97 1ajc h HIS 331 N 0.82 1.11 0.00 0.28 3.86 0.70 -2.50 115.15 119.42 1ajc h HIS 331 Ca 0.14 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1ajc h HIS 331 Cb 0.56 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1ajc h HIS 331 CO 0.03 1.05 0.00 0.00 0.86 0.00 0.00 177.93 179.88 1ajc n ALA 332 N -2.50 1.66 -3.53 2.45 0.00 0.12 -1.46 120.51 117.25 1ajc n ALA 332 Ca 0.01 -0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.23 1ajc n ALA 332 Cb 0.41 -1.28 0.08 0.00 0.00 0.00 0.00 19.45 18.66 1ajc n ALA 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ajc n ALA 333 N -1.57 -1.77 -3.88 0.00 0.00 0.06 -4.78 120.51 108.57 1ajc n ALA 333 Ca 0.03 0.08 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 1ajc n ALA 333 Cb 0.19 -3.42 -0.12 0.00 0.00 0.00 0.00 19.45 16.10 1ajc n ALA 333 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ajc s ASN 334 N -4.00 4.80 0.12 0.00 3.84 -0.35 -1.97 114.94 117.38 1ajc s ASN 334 Ca 0.21 -3.51 -0.24 0.00 0.21 0.00 0.00 52.86 49.53 1ajc s ASN 334 Cb -0.09 -1.68 -0.05 0.00 -0.55 0.00 0.00 41.25 38.87 1ajc s ASN 334 CO 0.74 -0.16 1.38 -2.65 -2.79 0.00 0.00 177.10 173.63 1ajc n PRO 335 N 2.47 -0.34 -0.29 0.43 -0.02 -1.26 -1.78 135.00 134.21 1ajc n PRO 335 Ca 0.14 1.36 0.09 0.00 -2.02 0.00 0.00 63.50 63.07 1ajc n PRO 335 Cb 0.34 -2.00 0.24 0.00 -0.02 0.00 0.00 33.50 32.06 1ajc n PRO 335 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ajc h GLY 337 N 0.48 0.89 0.94 0.00 0.00 -1.43 0.20 103.07 104.15 1ajc h GLY 337 Ca 0.48 -0.88 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1ajc h GLY 337 CO -0.44 0.80 0.12 -1.61 0.00 0.00 0.00 176.54 175.41 1ajc h GLN 338 N 0.68 0.33 -0.39 4.80 4.15 -0.43 -0.82 115.11 123.43 1ajc h GLN 338 Ca 0.06 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.33 1ajc h GLN 338 Cb 0.92 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.54 1ajc h GLN 338 CO 0.08 0.31 -0.21 0.82 -1.93 0.00 0.00 178.83 177.91 1ajc h ILE 339 N 0.26 1.28 -0.58 2.39 2.04 -0.75 -2.54 117.51 119.61 1ajc h ILE 339 Ca 0.08 -1.35 0.05 0.00 1.00 0.00 0.00 64.86 64.65 1ajc h ILE 339 Cb 0.08 1.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 1ajc h ILE 339 CO -0.01 0.45 0.30 1.23 0.00 0.00 0.00 178.15 180.12 1ajc h GLY 340 N 0.64 0.83 2.00 5.37 0.00 -0.41 -1.40 103.07 110.10 1ajc h GLY 340 Ca 0.08 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 1ajc h GLY 340 CO 0.06 0.12 -0.26 0.83 0.00 0.00 0.00 176.54 177.29 1ajc h GLU 341 N 0.57 0.00 -0.06 4.80 4.39 -1.00 0.10 114.58 123.37 1ajc h GLU 341 Ca 0.26 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.79 1ajc h GLU 341 Cb 0.18 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 1ajc h GLU 341 CO -0.18 0.26 -0.71 1.15 -1.16 0.00 0.00 179.01 178.37 1ajc h THR 342 N 0.00 1.41 -0.26 1.13 2.02 -0.88 -1.91 112.91 114.41 1ajc h THR 342 Ca -0.00 -2.18 -0.14 0.00 0.77 0.00 0.00 66.41 64.86 1ajc h THR 342 Cb 0.51 2.14 -0.00 0.00 -1.74 0.00 0.00 68.15 69.06 1ajc h THR 342 CO 0.03 0.65 -0.39 0.58 0.37 0.00 0.00 175.52 176.76 1ajc h VAL 343 N 0.20 1.30 -0.64 3.16 2.07 -0.49 -1.46 116.25 120.38 1ajc h VAL 343 Ca -0.02 -1.58 0.05 0.00 0.82 0.00 0.00 66.70 65.97 1ajc h VAL 343 Cb 1.27 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 32.66 1ajc h VAL 343 CO 0.11 0.50 0.36 -0.78 0.02 0.00 0.00 177.57 177.79 1ajc h ASP 344 N 0.46 0.55 -0.44 0.57 3.58 -0.76 -2.52 116.42 117.87 1ajc h ASP 344 Ca 0.03 0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.40 1ajc h ASP 344 Cb 0.98 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.93 1ajc h ASP 344 CO 0.09 0.36 -0.12 0.25 -2.88 0.00 0.00 179.24 176.94 1ajc h LEU 345 N 0.68 0.86 -0.94 2.28 5.85 -1.24 -3.09 115.31 119.72 1ajc h LEU 345 Ca 0.28 -0.37 0.14 0.00 0.84 0.00 0.00 57.88 58.77 1ajc h LEU 345 Cb 0.14 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.85 1ajc h LEU 345 CO -0.16 1.03 0.55 -0.78 -0.34 0.00 0.00 178.44 178.74 1ajc h ASP 346 N 0.68 0.76 -0.43 1.25 3.58 -0.84 0.79 116.42 122.21 1ajc h ASP 346 Ca 0.11 0.07 -0.04 0.00 0.42 0.00 0.00 57.03 57.59 1ajc h ASP 346 Cb 0.66 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.61 1ajc h ASP 346 CO 0.05 0.36 0.15 -0.33 -2.88 0.00 0.00 179.24 176.59 1ajc h GLU 347 N 0.82 0.72 -0.37 0.28 5.08 -1.41 -1.09 114.58 118.60 1ajc h GLU 347 Ca 0.49 -0.12 -0.15 0.00 -1.00 0.00 0.00 59.36 58.57 1ajc h GLU 347 Cb 0.59 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1ajc h GLU 347 CO -0.31 0.63 -0.37 0.00 -1.00 0.00 0.00 179.01 177.96 1ajc h ALA 348 N 1.46 0.63 -0.57 3.43 0.00 -0.88 -1.76 119.26 121.57 1ajc h ALA 348 Ca 0.16 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1ajc h ALA 348 Cb 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ajc h ALA 348 CO -0.01 0.67 0.09 0.28 0.00 0.00 0.00 179.25 180.29 1ajc h VAL 349 N 0.73 1.25 -0.50 0.00 2.07 -0.72 -1.62 116.25 117.46 1ajc h VAL 349 Ca 0.06 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 1ajc h VAL 349 Cb 0.95 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1ajc h VAL 349 CO 0.09 0.35 0.29 1.56 0.02 0.00 0.00 177.57 179.88 1ajc h GLN 350 N 0.87 0.69 0.01 1.57 4.20 -0.94 0.13 115.11 121.64 1ajc h GLN 350 Ca 0.18 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.84 1ajc h GLN 350 Cb 0.39 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 1ajc h GLN 350 CO 0.01 0.52 -0.11 0.00 -0.67 0.00 0.00 178.83 178.57 1ajc h ARG 351 N 0.67 -0.18 -0.46 1.46 -0.00 -0.88 -0.91 114.38 114.07 1ajc h ARG 351 Ca 0.18 0.01 -0.00 0.00 -0.50 0.00 0.00 59.98 59.67 1ajc h ARG 351 Cb 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 29.97 30.00 1ajc h ARG 351 CO -0.03 -0.12 0.28 0.00 0.00 0.00 0.00 179.97 180.10 1ajc h ALA 352 N 0.77 0.59 -0.49 0.04 0.00 -1.00 -1.82 119.26 117.35 1ajc h ALA 352 Ca 0.04 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ajc h ALA 352 Cb 0.24 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ajc h ALA 352 CO -0.11 0.07 0.32 -0.07 0.00 0.00 0.00 179.25 179.46 1ajc h LEU 353 N 0.62 0.53 0.20 0.00 3.38 -0.58 0.00 115.31 119.46 1ajc h LEU 353 Ca 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ajc h LEU 353 Cb -0.02 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1ajc h LEU 353 CO -0.03 0.38 -0.10 -0.08 0.09 0.00 0.00 178.44 178.70 1ajc h GLU 354 N 0.62 -0.26 0.82 1.13 4.81 -0.37 0.11 114.58 121.44 1ajc h GLU 354 Ca 0.18 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1ajc h GLU 354 Cb -0.01 0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.43 1ajc h GLU 354 CO -0.04 -0.11 -0.39 0.35 -0.73 0.00 0.00 179.01 178.08 1ajc h PHE 355 N -0.34 -1.02 -0.54 0.92 3.57 -0.81 -2.80 116.94 115.92 1ajc h PHE 355 Ca -0.03 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.55 1ajc h PHE 355 Cb 0.27 0.34 -0.08 0.00 2.79 0.00 0.00 35.95 39.26 1ajc h PHE 355 CO -0.04 -0.63 0.10 0.00 -2.23 0.00 0.00 178.31 175.51 1ajc h ALA 356 N -0.99 0.60 -0.84 2.41 0.00 -1.02 0.11 119.26 119.52 1ajc h ALA 356 Ca -0.11 0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.04 1ajc h ALA 356 Cb 0.85 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 1ajc h ALA 356 CO 0.18 -0.32 0.55 -0.22 0.00 0.00 0.00 179.25 179.44 1ajc h LYS 357 N 0.23 0.66 0.04 0.00 1.63 -0.78 0.65 116.57 119.00 1ajc h LYS 357 Ca 0.27 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 60.03 1ajc h LYS 357 Cb 0.39 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1ajc h LYS 357 CO -0.37 0.44 -0.02 0.87 -3.45 0.00 0.00 179.45 176.92 1ajc h LYS 358 N 0.68 -0.05 -0.92 1.90 1.57 -0.84 -3.36 116.57 115.55 1ajc h LYS 358 Ca 0.41 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 59.34 1ajc h LYS 358 Cb 0.63 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.87 1ajc h LYS 358 CO -0.17 0.15 0.59 1.49 -0.57 0.00 0.00 179.45 180.94 1ajc h GLU 359 N -1.00 0.72 0.00 3.15 4.22 -0.71 -3.46 114.58 117.49 1ajc h GLU 359 Ca -0.01 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.39 1ajc h GLU 359 Cb 0.22 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ajc h GLU 359 CO 0.01 0.48 0.00 0.41 -2.18 0.00 0.00 179.01 177.73 1ajc n GLY 360 N -1.41 1.04 2.73 1.92 0.00 0.21 -4.81 105.19 104.87 1ajc n GLY 360 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.15 1ajc n GLY 360 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ajc n ASN 361 N 0.00 1.54 -3.86 1.61 3.02 -1.26 -4.88 115.26 111.43 1ajc n ASN 361 Ca 0.00 -2.44 -0.26 0.00 -0.03 0.00 0.00 54.58 51.85 1ajc n ASN 361 Cb 0.00 -0.51 -0.17 0.00 -0.61 0.00 0.00 39.78 38.49 1ajc n ASN 361 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ajc s THR 362 N -3.43 0.84 -0.19 3.41 2.01 -1.26 -0.38 115.64 116.63 1ajc s THR 362 Ca 0.27 -0.20 -0.23 0.00 0.31 0.00 0.00 61.69 61.84 1ajc s THR 362 Cb 0.40 -0.92 -0.02 0.00 0.01 0.00 0.00 72.50 71.97 1ajc s THR 362 CO 0.01 0.31 0.73 -0.22 -0.69 0.00 0.00 174.62 174.75 1ajc s LEU 363 N 1.78 4.15 -0.18 4.42 2.96 -0.95 -4.42 118.68 126.44 1ajc s LEU 363 Ca 0.05 0.98 -0.02 0.00 -0.22 0.00 0.00 54.13 54.91 1ajc s LEU 363 Cb -0.13 -3.05 -0.01 0.00 0.50 0.00 0.00 46.19 43.51 1ajc s LEU 363 CO -0.07 -0.35 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.82 1ajc s VAL 364 N 2.12 3.12 -0.14 1.68 1.01 -0.45 -1.47 120.40 126.26 1ajc s VAL 364 Ca 0.33 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1ajc s VAL 364 Cb -0.16 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.85 1ajc s VAL 364 CO 0.11 0.48 -0.20 -0.63 0.00 0.00 0.00 175.10 174.86 1ajc s ILE 365 N 0.99 2.30 -0.26 2.22 1.01 -0.16 -1.58 121.20 125.71 1ajc s ILE 365 Ca -0.01 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.75 1ajc s ILE 365 Cb -0.15 -1.93 0.05 0.00 0.01 0.00 0.00 42.46 40.44 1ajc s ILE 365 CO -0.01 0.54 -0.09 -0.69 0.00 0.00 0.00 174.94 174.69 1ajc s VAL 366 N 0.71 2.37 0.11 2.92 1.01 -0.53 -0.62 120.40 126.38 1ajc s VAL 366 Ca -0.09 -1.51 0.01 0.00 0.00 0.00 0.00 61.98 60.39 1ajc s VAL 366 Cb -0.16 -2.36 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 1ajc s VAL 366 CO 0.01 0.00 0.13 1.07 0.00 0.00 0.00 175.10 176.31 1ajc n THR 367 N 4.49 0.00 -4.44 3.92 5.66 -0.74 -1.93 114.28 121.24 1ajc n THR 367 Ca -0.14 -0.68 -0.21 0.00 -3.05 0.00 0.00 64.05 59.96 1ajc n THR 367 Cb 0.43 0.38 -0.10 0.00 -1.55 0.00 0.00 70.33 69.49 1ajc n THR 367 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ajc s ALA 368 N -2.17 2.35 -0.02 1.79 0.00 -1.26 -0.70 121.76 121.76 1ajc s ALA 368 Ca 0.11 -1.97 0.11 0.00 0.00 0.00 0.00 51.96 50.22 1ajc s ALA 368 Cb 0.00 0.36 -0.23 0.00 0.00 0.00 0.00 23.12 23.25 1ajc s ALA 368 CO 0.08 -0.17 0.76 0.38 0.00 0.00 0.00 175.76 176.81 1ajc h ASP 369 N 2.21 0.01 -4.59 0.00 2.03 -1.91 -3.47 116.42 110.71 1ajc h ASP 369 Ca -0.40 -0.02 0.18 0.00 -0.73 0.00 0.00 57.03 56.07 1ajc h ASP 369 Cb 1.24 -0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 39.57 1ajc h ASP 369 CO 0.69 1.01 0.64 -1.38 -1.03 0.00 0.00 179.24 179.17 1ajc s HIS 370 N -2.62 -0.23 0.44 4.15 -3.43 -1.26 -4.86 115.29 107.49 1ajc s HIS 370 Ca -0.04 0.12 -0.16 0.00 -0.80 0.00 0.00 55.06 54.18 1ajc s HIS 370 Cb 0.08 0.54 -0.08 0.00 -1.43 0.00 0.00 32.58 31.69 1ajc s HIS 370 CO 0.82 -0.41 0.89 0.00 -2.00 0.00 0.00 174.74 174.05 1ajc s ALA 371 N -2.81 3.16 0.00 -1.38 0.00 -1.15 -3.63 121.76 115.96 1ajc s ALA 371 Ca 0.08 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1ajc s ALA 371 Cb -0.01 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.14 1ajc s ALA 371 CO -0.06 -0.03 0.00 1.58 0.00 0.00 0.00 175.76 177.25 1ajc n HIS 372 N -1.15 -1.19 0.10 0.00 -0.00 -1.25 -0.16 115.22 111.57 1ajc n HIS 372 Ca 0.05 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.35 1ajc n HIS 372 Cb 0.54 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.36 1ajc n HIS 372 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1ajc n ALA 373 N -3.00 2.65 -1.78 1.57 0.00 -1.15 -4.44 120.51 114.36 1ajc n ALA 373 Ca 0.00 -0.32 -0.41 0.00 0.00 0.00 0.00 53.44 52.71 1ajc n ALA 373 Cb 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.44 1ajc n ALA 373 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ajc s SER 374 N -5.04 6.43 0.03 0.00 1.04 -1.26 -4.68 113.70 110.22 1ajc s SER 374 Ca -0.02 2.96 0.01 0.00 0.48 0.00 0.00 55.95 59.38 1ajc s SER 374 Cb 0.11 -2.66 -0.02 0.00 0.10 0.00 0.00 66.02 63.55 1ajc s SER 374 CO 0.82 -0.82 -0.06 -1.10 0.98 0.00 0.00 173.24 173.06 1ajc s GLN 375 N -1.72 0.45 -0.32 4.02 -0.21 -1.01 -4.75 119.66 116.11 1ajc s GLN 375 Ca 0.54 -0.69 -0.17 0.00 0.02 0.00 0.00 55.36 55.06 1ajc s GLN 375 Cb -0.45 -0.15 -0.01 0.00 1.00 0.00 0.00 33.01 33.39 1ajc s GLN 375 CO 0.58 0.02 0.48 0.42 -2.12 0.00 0.00 175.29 174.67 1ajc s ILE 376 N -1.37 5.06 0.36 1.08 1.01 -1.26 -1.28 121.20 124.80 1ajc s ILE 376 Ca -0.12 0.45 0.09 0.00 0.00 0.00 0.00 60.65 61.07 1ajc s ILE 376 Cb -0.10 -3.88 -0.07 0.00 0.01 0.00 0.00 42.46 38.42 1ajc s ILE 376 CO -0.00 -0.09 -0.04 0.68 0.00 0.00 0.00 174.94 175.49 1ajc s VAL 377 N 2.29 2.26 0.31 2.92 -7.23 -0.14 -5.00 120.40 115.81 1ajc s VAL 377 Ca 0.18 -2.10 -0.29 0.00 -1.81 0.00 0.00 61.98 57.95 1ajc s VAL 377 Cb -0.16 -2.76 -0.12 0.00 0.56 0.00 0.00 36.38 33.91 1ajc s VAL 377 CO 0.12 -0.15 1.48 0.00 -0.31 0.00 0.00 175.10 176.23 1ajc n ALA 378 N -0.87 1.97 -0.24 1.32 0.00 -1.26 -3.91 120.51 117.51 1ajc n ALA 378 Ca -0.05 0.37 0.18 0.00 0.00 0.00 0.00 53.44 53.94 1ajc n ALA 378 Cb 0.64 -2.37 0.49 0.00 0.00 0.00 0.00 19.45 18.20 1ajc n ALA 378 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ajc h PRO 379 N 3.87 0.44 -0.63 0.00 0.13 -1.91 -1.79 132.00 132.11 1ajc h PRO 379 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1ajc h PRO 379 Cb 1.25 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1ajc h PRO 379 CO 0.72 0.29 0.00 -0.40 -0.23 0.00 0.00 178.00 178.38 1ajc n ASP 380 N -4.53 2.68 -4.71 1.44 5.75 -1.26 -4.86 116.55 111.07 1ajc n ASP 380 Ca 0.19 -2.27 -0.42 0.00 -0.01 0.00 0.00 54.79 52.28 1ajc n ASP 380 Cb 0.65 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.26 1ajc n ASP 380 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1ajc s THR 381 N -1.71 3.73 -0.96 2.12 2.01 -0.67 -4.99 115.64 115.15 1ajc s THR 381 Ca 0.24 1.21 -0.03 0.00 0.31 0.00 0.00 61.69 63.43 1ajc s THR 381 Cb 0.17 -3.77 0.27 0.00 0.01 0.00 0.00 72.50 69.17 1ajc s THR 381 CO 0.11 0.07 1.07 0.29 -0.69 0.00 0.00 174.62 175.46 1ajc n LYS 382 N 4.32 3.39 -1.96 4.92 5.02 -1.26 -4.88 118.16 127.71 1ajc n LYS 382 Ca 0.11 -4.53 -0.29 0.00 -2.02 0.00 0.00 58.31 51.58 1ajc n LYS 382 Cb 0.44 -2.45 0.12 0.00 -0.02 0.00 0.00 35.03 33.13 1ajc n LYS 382 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ajc s ALA 383 N -2.00 2.60 -1.41 7.82 0.00 -1.26 -5.00 121.76 122.51 1ajc s ALA 383 Ca 0.31 -0.90 0.26 0.00 0.00 0.00 0.00 51.96 51.63 1ajc s ALA 383 Cb -0.00 -2.83 0.63 0.00 0.00 0.00 0.00 23.12 20.91 1ajc s ALA 383 CO -0.03 -1.88 1.49 -0.35 0.00 0.00 0.00 175.76 174.99 1ajc n PRO 384 N -3.41 0.46 0.00 0.00 -0.04 -1.26 -4.73 135.00 126.01 1ajc n PRO 384 Ca 0.11 -0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1ajc n PRO 384 Cb 0.60 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 1ajc n PRO 384 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ajc n GLY 385 N 1.41 4.30 3.71 0.55 0.00 -1.26 -5.01 105.19 108.90 1ajc n GLY 385 Ca 0.09 -2.03 -0.41 0.00 0.00 0.00 0.00 46.02 43.66 1ajc n GLY 385 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajc s LEU 386 N 0.00 4.36 0.06 0.99 1.43 0.85 -3.90 118.68 122.47 1ajc s LEU 386 Ca 0.00 1.55 0.02 0.00 -1.03 0.00 0.00 54.13 54.67 1ajc s LEU 386 Cb 0.00 -3.45 -0.03 0.00 0.03 0.00 0.00 46.19 42.73 1ajc s LEU 386 CO 0.00 -0.21 -0.06 0.42 0.23 0.00 0.00 176.35 176.72 1ajc s THR 387 N 0.90 0.53 -0.14 5.49 -4.23 -0.24 0.04 115.64 117.98 1ajc s THR 387 Ca 0.48 -1.46 -0.09 0.00 -1.18 0.00 0.00 61.69 59.45 1ajc s THR 387 Cb -0.20 -1.07 0.05 0.00 1.34 0.00 0.00 72.50 72.62 1ajc s THR 387 CO 0.26 -0.64 0.35 -1.58 -0.54 0.00 0.00 174.62 172.47 1ajc s GLN 388 N -2.64 0.35 -0.22 3.99 0.74 -0.50 -2.55 119.66 118.83 1ajc s GLN 388 Ca -0.01 0.65 -0.13 0.00 0.05 0.00 0.00 55.36 55.92 1ajc s GLN 388 Cb -0.03 0.00 -0.04 0.00 1.10 0.00 0.00 33.01 34.04 1ajc s GLN 388 CO -0.03 -0.13 0.29 0.00 -0.55 0.00 0.00 175.29 174.87 1ajc s ALA 389 N 1.08 3.58 0.30 1.58 0.00 -1.26 -1.15 121.76 125.89 1ajc s ALA 389 Ca -0.07 -0.69 0.09 0.00 0.00 0.00 0.00 51.96 51.28 1ajc s ALA 389 Cb -0.08 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 1ajc s ALA 389 CO -0.09 -0.25 0.10 -0.51 0.00 0.00 0.00 175.76 175.01 1ajc s LEU 390 N 1.19 3.32 -0.56 0.00 1.02 0.28 -0.46 118.68 123.48 1ajc s LEU 390 Ca 0.14 -0.64 -0.14 0.00 0.02 0.00 0.00 54.13 53.51 1ajc s LEU 390 Cb -0.14 -1.83 0.14 0.00 0.02 0.00 0.00 46.19 44.38 1ajc s LEU 390 CO 0.06 -0.14 0.49 0.20 0.02 0.00 0.00 176.35 176.98 1ajc s ASN 391 N -3.78 6.13 0.81 2.29 0.02 0.30 -2.15 114.94 118.56 1ajc s ASN 391 Ca 0.35 -1.93 -0.12 0.00 -1.02 0.00 0.00 52.86 50.14 1ajc s ASN 391 Cb -0.05 -2.16 0.08 0.00 0.02 0.00 0.00 41.25 39.13 1ajc s ASN 391 CO 0.22 -0.79 1.13 0.42 0.02 0.00 0.00 177.10 178.10 1ajc s THR 392 N 1.37 2.66 0.16 1.60 -4.23 -1.02 -4.86 115.64 111.33 1ajc s THR 392 Ca 0.05 0.22 0.27 0.00 -1.18 0.00 0.00 61.69 61.05 1ajc s THR 392 Cb -0.27 -3.07 0.27 0.00 1.34 0.00 0.00 72.50 70.77 1ajc s THR 392 CO 0.01 -0.28 1.81 0.50 -0.54 0.00 0.00 174.62 176.12 1ajc h LYS 393 N -1.09 0.00 0.00 3.99 1.63 -1.13 -0.12 116.57 119.86 1ajc h LYS 393 Ca -0.47 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 1ajc h LYS 393 Cb 1.29 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.92 1ajc h LYS 393 CO 0.62 0.00 -0.26 -0.25 -3.45 0.00 0.00 179.45 176.11 1ajc n ASP 394 N -2.50 0.27 -0.21 4.20 8.00 -1.26 -4.86 116.55 120.19 1ajc n ASP 394 Ca -0.02 0.12 -0.02 0.00 0.71 0.00 0.00 54.79 55.58 1ajc n ASP 394 Cb 0.13 -0.11 -0.00 0.00 -0.02 0.00 0.00 41.12 41.12 1ajc n ASP 394 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ajc n GLY 395 N 1.50 0.37 3.26 0.44 0.00 -0.06 -5.04 105.19 105.65 1ajc n GLY 395 Ca 0.06 -0.86 -0.15 0.00 0.00 0.00 0.00 46.02 45.07 1ajc n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajc s ALA 396 N -2.09 1.53 -0.01 4.61 0.00 -1.26 -4.98 121.76 119.56 1ajc s ALA 396 Ca 0.00 -1.49 -0.09 0.00 0.00 0.00 0.00 51.96 50.39 1ajc s ALA 396 Cb 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.08 1ajc s ALA 396 CO 0.00 -0.05 0.29 0.14 0.00 0.00 0.00 175.76 176.14 1ajc s VAL 397 N -3.11 5.25 -0.09 0.00 -7.23 -1.26 -2.43 120.40 111.53 1ajc s VAL 397 Ca 0.16 0.37 0.04 0.00 -1.81 0.00 0.00 61.98 60.74 1ajc s VAL 397 Cb 0.01 -3.58 0.00 0.00 0.56 0.00 0.00 36.38 33.38 1ajc s VAL 397 CO 0.02 0.46 -0.21 -0.32 -0.31 0.00 0.00 175.10 174.74 1ajc s MET 398 N -1.47 2.68 -0.24 4.82 0.00 -0.91 -4.89 119.30 119.28 1ajc s MET 398 Ca 0.25 -0.75 -0.08 0.00 0.00 0.00 0.00 55.69 55.11 1ajc s MET 398 Cb -0.14 -2.05 -0.03 0.00 0.00 0.00 0.00 34.83 32.60 1ajc s MET 398 CO 0.13 0.14 0.09 0.08 0.00 0.00 0.00 175.02 175.45 1ajc s VAL 399 N 0.43 4.52 -0.03 10.11 1.01 -1.25 -0.55 120.40 134.64 1ajc s VAL 399 Ca -0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 1ajc s VAL 399 Cb -0.17 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 1ajc s VAL 399 CO 0.07 0.34 0.10 -0.04 0.00 0.00 0.00 175.10 175.58 1ajc s MET 400 N 1.45 3.19 0.09 2.72 -1.94 -0.30 -0.97 119.30 123.54 1ajc s MET 400 Ca 0.06 -0.39 0.08 0.00 -1.71 0.00 0.00 55.69 53.73 1ajc s MET 400 Cb -0.15 -2.95 -0.03 0.00 2.01 0.00 0.00 34.83 33.71 1ajc s MET 400 CO 0.04 0.68 -0.21 0.45 -0.01 0.00 0.00 175.02 175.97 1ajc s SER 401 N -1.59 2.53 -0.20 3.03 0.15 -0.41 -1.41 113.70 115.80 1ajc s SER 401 Ca 0.22 -0.64 -0.03 0.00 0.70 0.00 0.00 55.95 56.20 1ajc s SER 401 Cb -0.12 -0.16 0.06 0.00 -1.71 0.00 0.00 66.02 64.09 1ajc s SER 401 CO 0.12 0.09 0.05 -0.31 1.20 0.00 0.00 173.24 174.39 1ajc s TYR 402 N -1.06 0.94 -0.01 3.44 1.51 0.11 -2.42 117.35 119.87 1ajc s TYR 402 Ca 0.07 -0.85 0.14 0.00 -1.01 0.00 0.00 57.07 55.42 1ajc s TYR 402 Cb -0.10 -1.03 0.24 0.00 -0.11 0.00 0.00 41.96 40.97 1ajc s TYR 402 CO 0.04 -0.63 1.10 0.41 -1.11 0.00 0.00 175.55 175.36 1ajc n GLY 403 N 5.07 0.81 1.32 0.71 0.00 -1.26 -0.11 105.19 111.73 1ajc n GLY 403 Ca -0.08 -0.46 0.10 0.00 0.00 0.00 0.00 46.02 45.58 1ajc n GLY 403 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ajc n ASN 404 N 0.23 4.09 -3.63 1.61 6.94 -1.26 -4.82 115.26 118.42 1ajc n ASN 404 Ca -0.10 -2.18 -0.12 0.00 -0.02 0.00 0.00 54.58 52.17 1ajc n ASN 404 Cb 0.94 -0.49 -0.05 0.00 -2.36 0.00 0.00 39.78 37.82 1ajc n ASN 404 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1ajc s SER 405 N -1.00 -0.30 0.00 0.53 0.15 -1.26 -4.72 113.70 107.10 1ajc s SER 405 Ca 0.46 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 57.02 1ajc s SER 405 Cb 0.26 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 65.03 1ajc s SER 405 CO 0.27 -0.76 0.31 -0.62 1.20 0.00 0.00 173.24 173.65 1ajc n GLU 406 N 0.18 -0.26 -4.09 5.44 1.02 -1.26 -4.97 120.64 116.69 1ajc n GLU 406 Ca -0.17 -0.31 -0.24 0.00 -0.02 0.00 0.00 57.16 56.41 1ajc n GLU 406 Cb 0.62 -0.80 -0.05 0.00 -0.02 0.00 0.00 31.44 31.19 1ajc n GLU 406 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1ajc s GLU 407 N -0.05 2.93 0.00 3.49 2.02 -1.26 -4.99 118.70 120.84 1ajc s GLU 407 Ca 0.00 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.03 1ajc s GLU 407 Cb 0.00 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.62 1ajc s GLU 407 CO 0.00 0.44 0.00 -0.40 0.02 0.00 0.00 175.26 175.32 1ajc n ASP 408 N -0.79 0.00 -4.25 -0.19 5.75 -1.26 -4.52 116.55 111.30 1ajc n ASP 408 Ca -0.08 0.00 -0.19 0.00 -0.01 0.00 0.00 54.79 54.51 1ajc n ASP 408 Cb 0.56 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.55 1ajc n ASP 408 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1ajc s SER 409 N -2.82 1.71 -0.22 -1.12 0.01 -1.26 -4.96 113.70 105.04 1ajc s SER 409 Ca 0.00 -1.46 -0.15 0.00 1.31 0.00 0.00 55.95 55.65 1ajc s SER 409 Cb 0.00 0.20 -0.04 0.00 0.21 0.00 0.00 66.02 66.40 1ajc s SER 409 CO 0.00 -0.77 0.39 -1.10 0.41 0.00 0.00 173.24 172.17 1ajc s GLN 410 N -3.92 4.13 1.01 12.44 -1.52 -0.54 -4.74 119.66 126.53 1ajc s GLN 410 Ca 0.35 0.15 -0.12 0.00 -1.95 0.00 0.00 55.36 53.79 1ajc s GLN 410 Cb 0.07 -3.57 0.20 0.00 -0.22 0.00 0.00 33.01 29.49 1ajc s GLN 410 CO 0.15 -0.10 1.09 -1.21 -0.25 0.00 0.00 175.29 174.97 1ajc s GLU 411 N 1.51 0.31 0.72 2.91 2.02 -1.26 -4.37 118.70 120.54 1ajc s GLU 411 Ca 0.18 0.51 -0.06 0.00 0.02 0.00 0.00 54.97 55.61 1ajc s GLU 411 Cb -0.15 -1.72 0.09 0.00 0.10 0.00 0.00 34.13 32.44 1ajc s GLU 411 CO 0.08 -2.81 1.02 -1.01 0.02 0.00 0.00 175.26 172.57 1ajc s HIS 412 N -2.95 2.54 0.03 1.61 3.76 -1.26 -2.92 115.29 116.11 1ajc s HIS 412 Ca 0.66 0.26 -0.04 0.00 -0.15 0.00 0.00 55.06 55.79 1ajc s HIS 412 Cb -0.19 -3.23 -0.02 0.00 1.11 0.00 0.00 32.58 30.26 1ajc s HIS 412 CO 0.58 -1.55 0.06 0.95 -0.85 0.00 0.00 174.74 173.93 1ajc s THR 413 N -3.26 0.14 -0.84 1.30 -4.23 0.77 -4.82 115.64 104.70 1ajc s THR 413 Ca 0.62 -1.13 0.13 0.00 -1.18 0.00 0.00 61.69 60.14 1ajc s THR 413 Cb -0.09 -0.84 0.62 0.00 1.34 0.00 0.00 72.50 73.52 1ajc s THR 413 CO 0.45 -0.62 1.48 0.61 -0.54 0.00 0.00 174.62 176.00 1ajc n GLY 414 N 0.85 2.43 3.77 3.99 0.00 -1.26 -2.94 105.19 112.04 1ajc n GLY 414 Ca -0.19 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 44.74 1ajc n GLY 414 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ajc s SER 415 N -0.72 5.97 0.55 1.61 0.15 -1.26 -4.83 113.70 115.17 1ajc s SER 415 Ca 0.42 2.42 -0.20 0.00 0.70 0.00 0.00 55.95 59.29 1ajc s SER 415 Cb 0.30 -2.61 -0.05 0.00 -1.71 0.00 0.00 66.02 61.95 1ajc s SER 415 CO 0.17 -1.06 1.22 0.00 1.20 0.00 0.00 173.24 174.76 1ajc s GLN 416 N -2.73 3.21 0.08 5.44 -2.07 -1.26 -4.46 119.66 117.86 1ajc s GLN 416 Ca 0.65 1.88 -0.00 0.00 -1.82 0.00 0.00 55.36 56.06 1ajc s GLN 416 Cb -0.32 -2.10 -0.04 0.00 -1.09 0.00 0.00 33.01 29.46 1ajc s GLN 416 CO 0.38 -1.03 -0.03 -0.48 -1.32 0.00 0.00 175.29 172.81 1ajc s LEU 417 N -3.72 2.40 0.38 2.60 0.05 -1.07 -4.90 118.68 114.41 1ajc s LEU 417 Ca 0.73 -1.03 -0.27 0.00 0.05 0.00 0.00 54.13 53.61 1ajc s LEU 417 Cb -0.31 0.13 -0.11 0.00 -2.05 0.00 0.00 46.19 43.84 1ajc s LEU 417 CO 0.36 -0.58 1.23 -1.14 -0.55 0.00 0.00 176.35 175.66 1ajc n ARG 418 N 0.03 1.90 -3.74 1.48 0.63 -1.26 -1.57 116.66 114.13 1ajc n ARG 418 Ca -0.12 0.67 -0.16 0.00 -0.92 0.00 0.00 57.85 57.32 1ajc n ARG 418 Cb 0.61 -2.28 -0.16 0.00 0.45 0.00 0.00 32.46 31.09 1ajc n ARG 418 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 1ajc s ILE 419 N -1.15 -0.08 0.18 5.15 2.07 -1.02 -4.27 121.20 122.08 1ajc s ILE 419 Ca 0.59 0.26 0.08 0.00 -1.41 0.00 0.00 60.65 60.17 1ajc s ILE 419 Cb -0.55 -0.12 -0.04 0.00 0.13 0.00 0.00 42.46 41.88 1ajc s ILE 419 CO 0.60 0.11 -0.17 0.00 -1.91 0.00 0.00 174.94 173.56 1ajc s ALA 420 N 1.35 2.04 0.10 1.50 0.00 -0.81 0.09 121.76 126.03 1ajc s ALA 420 Ca -0.06 -1.55 -0.19 0.00 0.00 0.00 0.00 51.96 50.16 1ajc s ALA 420 Cb -0.13 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.87 1ajc s ALA 420 CO -0.03 0.20 0.47 0.00 0.00 0.00 0.00 175.76 176.40 1ajc s ALA 421 N -2.28 -1.17 -0.11 0.00 0.00 0.13 -1.45 121.76 116.89 1ajc s ALA 421 Ca 0.18 0.27 -0.05 0.00 0.00 0.00 0.00 51.96 52.37 1ajc s ALA 421 Cb -0.05 0.60 0.05 0.00 0.00 0.00 0.00 23.12 23.73 1ajc s ALA 421 CO 0.07 -0.61 0.23 -0.47 0.00 0.00 0.00 175.76 174.99 1ajc s TYR 422 N -3.26 -0.33 -0.74 0.00 5.04 -0.62 -2.57 117.35 114.88 1ajc s TYR 422 Ca -0.01 0.79 0.00 0.00 -2.44 0.00 0.00 57.07 55.42 1ajc s TYR 422 Cb 0.00 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.31 1ajc s TYR 422 CO -0.08 -0.26 0.00 0.41 -1.34 0.00 0.00 175.55 174.28 1ajc n GLY 423 N 4.58 0.37 3.70 8.97 0.00 -1.26 -1.35 105.19 120.21 1ajc n GLY 423 Ca -0.19 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.15 1ajc n GLY 423 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ajc s PRO 424 N -0.35 4.19 0.00 1.61 0.04 -1.26 -2.20 135.00 137.03 1ajc s PRO 424 Ca 0.00 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1ajc s PRO 424 Cb 0.00 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1ajc s PRO 424 CO 0.00 -0.71 0.00 0.72 0.04 0.00 0.00 177.00 177.05 1ajc n HIS 425 N 4.83 0.00 0.22 0.56 8.25 0.92 -4.69 115.22 125.30 1ajc n HIS 425 Ca 0.15 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.71 1ajc n HIS 425 Cb 0.39 -0.33 0.49 0.00 1.12 0.00 0.00 29.99 31.66 1ajc n HIS 425 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ajc h ALA 426 N 0.00 1.08 -0.13 -1.41 0.00 -1.69 -2.72 119.26 114.38 1ajc h ALA 426 Ca 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.73 1ajc h ALA 426 Cb 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ajc h ALA 426 CO 0.00 0.30 0.27 0.00 0.00 0.00 0.00 179.25 179.82 1ajc h ALA 427 N 1.76 1.58 0.00 0.00 0.00 -1.89 -1.25 119.26 119.46 1ajc h ALA 427 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ajc h ALA 427 Cb 0.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ajc h ALA 427 CO 0.03 -0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.04 1ajc n ASN 428 N -3.35 0.00 -0.08 0.00 3.02 -1.03 -2.71 115.26 111.11 1ajc n ASN 428 Ca 0.01 -0.74 0.07 0.00 -0.03 0.00 0.00 54.58 53.89 1ajc n ASN 428 Cb 0.36 -0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.46 1ajc n ASN 428 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1ajc n VAL 429 N -1.00 0.00 -2.71 2.41 0.24 -0.47 -4.98 118.33 111.81 1ajc n VAL 429 Ca 0.18 -0.18 -0.36 0.00 -2.04 0.00 0.00 64.34 61.93 1ajc n VAL 429 Cb 0.08 1.04 -0.06 0.00 -1.47 0.00 0.00 33.84 33.44 1ajc n VAL 429 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1ajc s VAL 430 N -2.31 4.08 0.00 3.34 1.01 -1.10 -3.40 120.40 122.03 1ajc s VAL 430 Ca 0.07 1.61 0.00 0.00 0.00 0.00 0.00 61.98 63.66 1ajc s VAL 430 Cb 0.12 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.66 1ajc s VAL 430 CO 0.57 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.30 1ajc n GLY 431 N 0.29 -2.18 3.76 4.51 0.00 -1.26 -4.85 105.19 105.46 1ajc n GLY 431 Ca 0.04 -1.57 -0.40 0.00 0.00 0.00 0.00 46.02 44.08 1ajc n GLY 431 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ajc s LEU 432 N 0.00 4.56 0.19 0.99 2.96 -1.26 -2.56 118.68 123.56 1ajc s LEU 432 Ca 0.00 1.67 -0.13 0.00 -0.22 0.00 0.00 54.13 55.45 1ajc s LEU 432 Cb 0.00 -3.37 0.01 0.00 0.50 0.00 0.00 46.19 43.33 1ajc s LEU 432 CO 0.00 0.12 0.40 0.42 -1.32 0.00 0.00 176.35 175.97 1ajc s THR 433 N -0.74 0.04 0.15 3.68 -4.23 -0.90 -4.99 115.64 108.64 1ajc s THR 433 Ca 0.39 -1.17 0.03 0.00 -1.18 0.00 0.00 61.69 59.75 1ajc s THR 433 Cb -0.23 -1.80 -0.04 0.00 1.34 0.00 0.00 72.50 71.78 1ajc s THR 433 CO 0.27 -0.19 0.27 -0.62 -0.54 0.00 0.00 174.62 173.81 1ajc s ASP 434 N -2.94 6.26 0.38 3.99 2.15 -1.26 -0.86 116.67 124.39 1ajc s ASP 434 Ca 0.15 0.15 0.11 0.00 0.43 0.00 0.00 52.55 53.39 1ajc s ASP 434 Cb 0.01 -1.87 0.89 0.00 -0.30 0.00 0.00 42.92 41.66 1ajc s ASP 434 CO 0.00 0.06 1.89 -0.61 -0.17 0.00 0.00 175.17 176.34 1ajc h GLN 435 N 2.21 0.58 0.00 4.34 4.15 -1.38 0.71 115.11 125.73 1ajc h GLN 435 Ca -0.48 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.90 1ajc h GLN 435 Cb 1.19 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1ajc h GLN 435 CO 0.68 0.39 0.00 1.79 -1.93 0.00 0.00 178.83 179.76 1ajc h THR 436 N 0.60 0.00 -0.17 2.39 1.35 -1.86 -1.71 112.91 113.51 1ajc h THR 436 Ca 0.42 -0.38 -0.08 0.00 -0.55 0.00 0.00 66.41 65.82 1ajc h THR 436 Cb 0.75 1.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 1ajc h THR 436 CO -0.17 0.00 -0.24 0.44 -0.25 0.00 0.00 175.52 175.30 1ajc h ASP 437 N 0.00 0.30 -0.86 5.36 3.32 -1.16 -2.61 116.42 120.77 1ajc h ASP 437 Ca 0.00 -0.09 0.12 0.00 0.02 0.00 0.00 57.03 57.08 1ajc h ASP 437 Cb 0.38 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.79 1ajc h ASP 437 CO 0.00 0.55 0.55 0.25 -1.72 0.00 0.00 179.24 178.88 1ajc h LEU 438 N 0.28 0.67 0.21 1.55 5.85 -1.37 0.17 115.31 122.67 1ajc h LEU 438 Ca 0.04 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1ajc h LEU 438 Cb 0.58 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1ajc h LEU 438 CO 0.04 0.37 -0.10 0.15 -0.34 0.00 0.00 178.44 178.56 1ajc h PHE 439 N 0.73 -0.26 -0.61 1.25 3.57 -1.50 -1.66 116.94 118.46 1ajc h PHE 439 Ca 0.41 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.86 1ajc h PHE 439 Cb 0.59 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 1ajc h PHE 439 CO -0.00 0.00 0.17 1.88 -2.23 0.00 0.00 178.31 178.13 1ajc h TYR 440 N -0.51 0.96 -0.74 0.41 0.05 -1.34 0.13 116.97 115.94 1ajc h TYR 440 Ca -0.03 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.65 1ajc h TYR 440 Cb 0.38 -0.28 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 1ajc h TYR 440 CO 0.00 0.78 0.39 1.15 -1.05 0.00 0.00 178.16 179.44 1ajc h THR 441 N 0.90 1.23 0.06 -2.88 2.02 -0.67 -0.31 112.91 113.26 1ajc h THR 441 Ca 0.20 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 1ajc h THR 441 Cb 0.29 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1ajc h THR 441 CO -0.01 0.26 -0.03 0.24 0.37 0.00 0.00 175.52 176.35 1ajc h MET 442 N 1.02 -0.08 -0.29 6.66 2.86 -0.85 -1.06 114.93 123.19 1ajc h MET 442 Ca 0.26 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.96 1ajc h MET 442 Cb 0.06 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.68 1ajc h MET 442 CO -0.04 0.46 -0.04 -0.22 1.06 0.00 0.00 176.91 178.13 1ajc h LYS 443 N -0.67 0.04 -0.47 1.72 3.64 -0.72 -0.49 116.57 119.61 1ajc h LYS 443 Ca -0.01 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1ajc h LYS 443 Cb 0.57 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1ajc h LYS 443 CO 0.01 0.03 0.01 0.00 -2.27 0.00 0.00 179.45 177.23 1ajc h ALA 444 N 1.27 1.13 -0.37 5.00 0.00 -1.11 -1.60 119.26 123.58 1ajc h ALA 444 Ca 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1ajc h ALA 444 Cb 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1ajc h ALA 444 CO -0.27 0.56 0.10 0.00 0.00 0.00 0.00 179.25 179.64 1ajc h ALA 445 N 1.28 0.49 0.00 0.00 0.00 -0.42 -2.57 119.26 118.04 1ajc h ALA 445 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ajc h ALA 445 Cb 0.43 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ajc h ALA 445 CO 0.02 0.15 0.00 -0.11 0.00 0.00 0.00 179.25 179.30 1ajc n LEU 446 N -4.61 0.60 -0.14 0.00 7.94 -0.26 -1.83 117.00 118.70 1ajc n LEU 446 Ca -0.01 0.62 -0.02 0.00 -1.11 0.00 0.00 56.01 55.49 1ajc n LEU 446 Cb 0.19 -0.50 -0.01 0.00 0.53 0.00 0.00 43.42 43.63 1ajc n LEU 446 CO 0.38 -0.40 -0.02 0.61 -1.11 0.00 0.00 177.39 176.85 1ajc n GLY 447 N 0.41 0.54 3.74 -3.96 0.00 -0.68 -4.92 105.19 100.31 1ajc n GLY 447 Ca 0.03 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1ajc n GLY 447 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajc s LEU 448 N -0.41 4.36 0.00 0.99 1.02 -0.74 -5.01 118.68 118.89 1ajc s LEU 448 Ca 0.00 2.82 0.00 0.00 0.02 0.00 0.00 54.13 56.97 1ajc s LEU 448 Cb 0.00 -3.62 0.00 0.00 0.02 0.00 0.00 46.19 42.59 1ajc s LEU 448 CO 0.00 -0.88 0.34 0.29 0.02 0.00 0.00 176.35 176.13