#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jea s GLN 2 N 0.00 4.10 0.18 0.00 0.74 -1.20 -3.79 119.66 119.70 1jea s GLN 2 Ca 0.00 -0.25 0.07 0.00 0.05 0.00 0.00 55.36 55.24 1jea s GLN 2 Cb 0.00 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.71 1jea s GLN 2 CO 0.00 0.31 0.01 -1.54 -0.55 0.00 0.00 175.29 173.52 1jea s SER 3 N 0.30 4.79 -0.42 6.67 1.04 -0.03 -4.98 113.70 121.07 1jea s SER 3 Ca 0.07 -0.41 -0.11 0.00 0.48 0.00 0.00 55.95 55.98 1jea s SER 3 Cb -0.11 -1.02 0.06 0.00 0.10 0.00 0.00 66.02 65.05 1jea s SER 3 CO -0.01 0.08 0.28 -0.69 0.98 0.00 0.00 173.24 173.88 1jea s VAL 4 N -1.79 4.56 0.71 5.02 1.01 -1.26 -3.49 120.40 125.16 1jea s VAL 4 Ca 0.28 -1.18 -0.16 0.00 0.00 0.00 0.00 61.98 60.91 1jea s VAL 4 Cb -0.09 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 1jea s VAL 4 CO 0.19 -0.46 0.71 -2.65 0.00 0.00 0.00 175.10 172.89 1jea n PRO 5 N 5.01 0.40 -0.33 2.72 -0.02 -1.26 -4.78 135.00 136.73 1jea n PRO 5 Ca -0.11 0.18 0.01 0.00 -2.02 0.00 0.00 63.50 61.56 1jea n PRO 5 Cb 0.44 -1.98 0.15 0.00 -0.02 0.00 0.00 33.50 32.09 1jea n PRO 5 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 1jea h TRP 6 N -0.29 1.05 0.00 6.00 5.08 -1.94 -2.57 115.95 123.27 1jea h TRP 6 Ca -0.46 0.03 -0.06 0.00 1.08 0.00 0.00 58.89 59.48 1jea h TRP 6 Cb 1.35 -0.34 -0.01 0.00 -3.00 0.00 0.00 29.16 27.16 1jea h TRP 6 CO 0.37 0.53 -0.27 0.78 -1.28 0.00 0.00 178.44 178.56 1jea h GLY 7 N 1.02 0.00 0.99 11.11 0.00 -1.92 0.91 103.07 115.18 1jea h GLY 7 Ca 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.70 1jea h GLY 7 CO -0.18 0.00 0.27 -2.22 0.00 0.00 0.00 176.54 174.42 1jea h ILE 8 N 0.00 1.20 0.00 2.60 1.08 -1.81 0.44 117.51 121.02 1jea h ILE 8 Ca -0.00 -0.57 -0.07 0.00 -0.39 0.00 0.00 64.86 63.83 1jea h ILE 8 Cb 0.58 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 1jea h ILE 8 CO 0.04 0.23 -0.49 0.77 -0.69 0.00 0.00 178.15 178.00 1jea h SER 9 N 0.76 0.00 -0.34 1.72 4.64 -1.33 -1.84 113.55 117.16 1jea h SER 9 Ca 0.19 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.49 1jea h SER 9 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1jea h SER 9 CO -0.02 0.29 0.13 -0.09 -0.87 0.00 0.00 176.83 176.26 1jea h ARG 10 N 0.00 0.52 0.00 4.77 9.65 0.17 0.17 114.38 129.66 1jea h ARG 10 Ca -0.02 -0.10 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1jea h ARG 10 Cb 1.24 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.74 1jea h ARG 10 CO 0.03 0.52 0.00 1.33 2.80 0.00 0.00 179.97 184.66 1jea n VAL 11 N -4.69 0.14 -2.56 0.20 0.24 0.14 -4.91 118.33 106.90 1jea n VAL 11 Ca -0.01 0.04 -0.12 0.00 -2.04 0.00 0.00 64.34 62.20 1jea n VAL 11 Cb 0.15 -0.66 0.01 0.00 -1.47 0.00 0.00 33.84 31.88 1jea n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jea n GLN 12 N -1.15 -2.27 -0.29 7.34 6.02 0.05 -1.68 117.38 125.39 1jea n GLN 12 Ca 0.14 0.52 -0.04 0.00 -0.01 0.00 0.00 57.00 57.61 1jea n GLN 12 Cb 0.14 -4.57 0.07 0.00 1.02 0.00 0.00 30.24 26.89 1jea n GLN 12 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jea h ALA 13 N 0.55 1.01 -0.93 -1.58 0.00 -1.58 -2.90 119.26 113.84 1jea h ALA 13 Ca -0.29 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 54.70 1jea h ALA 13 Cb 1.20 -0.32 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 1jea h ALA 13 CO 0.32 0.45 0.60 -1.35 0.00 0.00 0.00 179.25 179.26 1jea h PRO 14 N 1.09 0.70 -0.88 0.00 0.11 -1.91 0.28 132.00 131.39 1jea h PRO 14 Ca 0.29 -0.04 0.10 0.00 0.11 0.00 0.00 66.00 66.45 1jea h PRO 14 Cb -0.09 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 30.79 1jea h PRO 14 CO -0.06 0.47 0.52 0.00 -0.21 0.00 0.00 178.00 178.72 1jea h ALA 15 N 1.60 1.27 -0.13 -0.75 0.00 -1.91 -0.16 119.26 119.17 1jea h ALA 15 Ca 0.48 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.26 1jea h ALA 15 Cb 0.77 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1jea h ALA 15 CO -0.24 0.16 -0.51 0.00 0.00 0.00 0.00 179.25 178.66 1jea h ALA 16 N 1.47 0.24 -0.92 0.00 0.00 -0.55 -3.02 119.26 116.49 1jea h ALA 16 Ca 0.42 -0.50 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1jea h ALA 16 Cb 0.36 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1jea h ALA 16 CO -0.24 0.42 0.57 0.45 0.00 0.00 0.00 179.25 180.45 1jea h HIS 17 N 0.21 1.03 0.00 0.00 3.86 -0.46 0.27 115.15 120.07 1jea h HIS 17 Ca -0.03 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1jea h HIS 17 Cb 1.14 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 29.28 1jea h HIS 17 CO 0.10 0.45 0.00 0.09 0.86 0.00 0.00 177.93 179.44 1jea n ASN 18 N -4.64 0.00 -0.80 2.45 4.13 -0.13 -1.38 115.26 114.89 1jea n ASN 18 Ca 0.15 0.28 0.07 0.00 1.68 0.00 0.00 54.58 56.76 1jea n ASN 18 Cb 0.27 -0.35 0.19 0.00 -1.54 0.00 0.00 39.78 38.35 1jea n ASN 18 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1jea n ARG 19 N -1.35 2.84 -0.34 3.52 1.74 0.05 -4.97 116.66 118.14 1jea n ARG 19 Ca 0.03 -2.19 0.00 0.00 -0.77 0.00 0.00 57.85 54.92 1jea n ARG 19 Cb 0.07 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 1jea n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jea n GLY 20 N 0.77 0.68 3.49 -0.13 0.00 -0.48 -5.04 105.19 104.49 1jea n GLY 20 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1jea n GLY 20 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jea s LEU 21 N 0.00 4.88 0.00 0.99 1.43 -0.99 -4.84 118.68 120.16 1jea s LEU 21 Ca 0.00 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.40 1jea s LEU 21 Cb 0.00 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 44.00 1jea s LEU 21 CO 0.00 -0.43 0.33 0.35 0.23 0.00 0.00 176.35 176.83 1jea n THR 22 N 5.22 0.09 -0.45 5.49 -2.24 -1.26 -3.07 114.28 118.06 1jea n THR 22 Ca -0.10 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1jea n THR 22 Cb 0.48 1.39 0.00 0.00 -2.10 0.00 0.00 70.33 70.09 1jea n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jea n GLY 23 N -0.04 0.76 3.63 3.38 0.00 -1.26 -1.16 105.19 110.49 1jea n GLY 23 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 1jea n GLY 23 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jea n SER 24 N 0.00 2.45 0.00 1.61 2.88 -1.25 -1.58 113.62 117.72 1jea n SER 24 Ca 0.00 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 1jea n SER 24 Cb 0.00 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.13 1jea n SER 24 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jea n GLY 25 N 2.95 0.52 3.71 0.46 0.00 -1.26 -4.80 105.19 106.77 1jea n GLY 25 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1jea n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jea s VAL 26 N -2.31 5.29 -0.24 1.61 1.01 -0.62 -4.97 120.40 120.18 1jea s VAL 26 Ca 0.00 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.01 1jea s VAL 26 Cb 0.00 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 1jea s VAL 26 CO 0.00 0.45 0.19 -0.54 0.00 0.00 0.00 175.10 175.20 1jea s LYS 27 N 0.34 4.08 -0.11 2.72 1.02 -1.26 -0.39 119.74 126.14 1jea s LYS 27 Ca 0.07 -0.20 -0.00 0.00 0.02 0.00 0.00 55.97 55.86 1jea s LYS 27 Cb -0.11 -3.54 0.02 0.00 -0.52 0.00 0.00 37.83 33.68 1jea s LYS 27 CO -0.02 0.04 -0.09 0.08 -0.92 0.00 0.00 175.35 174.45 1jea s VAL 28 N 1.11 1.07 -0.22 3.17 1.01 -0.27 0.10 120.40 126.37 1jea s VAL 28 Ca 0.09 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 1jea s VAL 28 Cb -0.14 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.12 1jea s VAL 28 CO 0.05 0.37 0.17 0.00 0.00 0.00 0.00 175.10 175.69 1jea s ALA 29 N 1.59 3.63 -0.47 5.51 0.00 -0.10 -0.57 121.76 131.35 1jea s ALA 29 Ca 0.03 -0.80 -0.12 0.00 0.00 0.00 0.00 51.96 51.07 1jea s ALA 29 Cb -0.13 -2.30 0.09 0.00 0.00 0.00 0.00 23.12 20.78 1jea s ALA 29 CO -0.07 -0.10 0.36 0.08 0.00 0.00 0.00 175.76 176.03 1jea s VAL 30 N 0.87 4.70 -0.61 0.00 1.01 -0.82 -0.35 120.40 125.20 1jea s VAL 30 Ca 0.09 -1.39 -0.24 0.00 0.00 0.00 0.00 61.98 60.44 1jea s VAL 30 Cb -0.13 -3.91 0.05 0.00 0.00 0.00 0.00 36.38 32.39 1jea s VAL 30 CO 0.03 -0.64 1.00 -0.76 0.00 0.00 0.00 175.10 174.73 1jea s LEU 31 N 1.51 4.06 0.00 3.92 1.02 0.12 -1.76 118.68 127.54 1jea s LEU 31 Ca 0.04 -0.55 0.00 0.00 0.02 0.00 0.00 54.13 53.63 1jea s LEU 31 Cb -0.25 -2.68 0.00 0.00 0.02 0.00 0.00 46.19 43.28 1jea s LEU 31 CO 0.03 -1.38 0.00 -0.67 0.02 0.00 0.00 176.35 174.35 1jea n ASP 32 N 7.80 0.00 -0.24 2.29 -0.08 -0.67 -4.23 116.55 121.42 1jea n ASP 32 Ca 0.00 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.32 1jea n ASP 32 Cb 0.47 0.00 0.14 0.00 2.34 0.00 0.00 41.12 44.07 1jea n ASP 32 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1jea n THR 33 N 0.00 0.16 0.00 5.18 -2.24 -1.25 -0.97 114.28 115.15 1jea n THR 33 Ca 0.00 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1jea n THR 33 Cb 0.00 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1jea n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jea n GLY 34 N 0.75 -0.72 2.72 3.38 0.00 -1.26 -3.84 105.19 106.22 1jea n GLY 34 Ca 0.07 -2.26 -0.20 0.00 0.00 0.00 0.00 46.02 43.62 1jea n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jea s ILE 35 N -0.89 0.06 0.26 -0.61 1.01 -0.19 -3.46 121.20 117.38 1jea s ILE 35 Ca 0.00 0.30 -0.24 0.00 0.00 0.00 0.00 60.65 60.71 1jea s ILE 35 Cb 0.00 -0.27 -0.09 0.00 0.01 0.00 0.00 42.46 42.11 1jea s ILE 35 CO 0.00 0.20 0.84 -0.44 0.00 0.00 0.00 174.94 175.54 1jea s SER 36 N 1.95 7.28 0.25 3.58 0.01 -1.26 -3.85 113.70 121.66 1jea s SER 36 Ca 0.03 1.67 -0.30 0.00 1.31 0.00 0.00 55.95 58.67 1jea s SER 36 Cb -0.12 -2.51 -0.14 0.00 0.21 0.00 0.00 66.02 63.45 1jea s SER 36 CO -0.04 0.03 1.10 0.41 0.41 0.00 0.00 173.24 175.16 1jea n THR 38 N 0.87 1.59 -3.66 1.44 -1.04 -1.26 -4.95 114.28 107.27 1jea n THR 38 Ca -0.01 -0.40 -0.14 0.00 -2.04 0.00 0.00 64.05 61.46 1jea n THR 38 Cb 0.50 -1.03 -0.08 0.00 -1.82 0.00 0.00 70.33 67.90 1jea n THR 38 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1jea s HIS 39 N -0.72 -0.59 0.28 -1.42 5.04 -1.26 -4.74 115.29 111.88 1jea s HIS 39 Ca 0.63 1.32 0.37 0.00 -1.54 0.00 0.00 55.06 55.84 1jea s HIS 39 Cb -0.73 0.24 1.81 0.00 0.04 0.00 0.00 32.58 33.94 1jea s HIS 39 CO 0.57 -0.37 2.11 -1.00 -2.34 0.00 0.00 174.74 173.70 1jea h PRO 40 N 4.64 0.00 -0.60 2.88 0.13 -1.95 -2.59 132.00 134.51 1jea h PRO 40 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1jea h PRO 40 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1jea h PRO 40 CO 0.22 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 174.52 1jea n ASP 41 N -2.91 4.61 -4.18 1.44 2.03 -1.26 -4.95 116.55 111.33 1jea n ASP 41 Ca -0.01 -2.47 -0.17 0.00 0.52 0.00 0.00 54.79 52.66 1jea n ASP 41 Cb 0.16 -0.56 -0.11 0.00 -0.72 0.00 0.00 41.12 39.89 1jea n ASP 41 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1jea s LEU 42 N -1.89 2.34 -0.40 -2.67 1.43 -0.98 -0.45 118.68 116.07 1jea s LEU 42 Ca 0.49 -0.71 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 1jea s LEU 42 Cb 0.32 -0.43 0.12 0.00 0.03 0.00 0.00 46.19 46.23 1jea s LEU 42 CO 0.23 -0.16 0.17 0.21 0.23 0.00 0.00 176.35 177.03 1jea s ASN 43 N -2.08 3.99 -0.32 2.29 2.47 -1.26 -4.61 114.94 115.42 1jea s ASN 43 Ca 0.02 -2.32 -0.23 0.00 0.42 0.00 0.00 52.86 50.75 1jea s ASN 43 Cb -0.07 -1.14 0.00 0.00 -1.45 0.00 0.00 41.25 38.60 1jea s ASN 43 CO 0.02 -0.32 0.77 -0.63 -3.72 0.00 0.00 177.10 173.21 1jea s ILE 44 N 0.72 4.79 -0.42 -5.21 1.01 -1.26 -4.09 121.20 116.74 1jea s ILE 44 Ca 0.14 1.06 0.23 0.00 0.00 0.00 0.00 60.65 62.09 1jea s ILE 44 Cb -0.22 -4.15 0.22 0.00 0.01 0.00 0.00 42.46 38.33 1jea s ILE 44 CO -0.08 -0.29 1.45 0.03 0.00 0.00 0.00 174.94 176.05 1jea h ARG 45 N 8.23 0.00 0.00 2.79 2.47 -0.18 -3.49 114.38 124.20 1jea h ARG 45 Ca -0.25 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 1jea h ARG 45 Cb 1.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.42 1jea h ARG 45 CO 0.88 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.82 1jea n GLY 46 N 1.16 -0.84 0.00 0.04 0.00 -1.25 -5.04 105.19 99.25 1jea n GLY 46 Ca 0.03 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1jea n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jea n GLY 47 N 0.00 -0.13 3.52 -0.02 0.00 -1.26 0.71 105.19 108.02 1jea n GLY 47 Ca 0.00 -1.57 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 1jea n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jea s ALA 48 N -1.00 -1.26 -0.02 4.61 0.00 -0.76 -4.91 121.76 118.43 1jea s ALA 48 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.10 1jea s ALA 48 Cb 0.00 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 1jea s ALA 48 CO 0.00 -0.82 -0.25 0.45 0.00 0.00 0.00 175.76 175.15 1jea s SER 49 N -2.83 2.88 -0.12 0.00 0.15 -1.26 -1.43 113.70 111.10 1jea s SER 49 Ca 0.06 -0.45 0.17 0.00 0.70 0.00 0.00 55.95 56.43 1jea s SER 49 Cb -0.02 -0.32 0.27 0.00 -1.71 0.00 0.00 66.02 64.24 1jea s SER 49 CO -0.06 0.30 1.14 0.49 1.20 0.00 0.00 173.24 176.31 1jea n PHE 50 N 2.45 0.00 -3.50 3.44 3.72 0.73 -4.94 117.46 119.36 1jea n PHE 50 Ca -0.16 -0.92 -0.42 0.00 -0.05 0.00 0.00 57.45 55.90 1jea n PHE 50 Cb 0.52 -0.14 -0.10 0.00 -0.94 0.00 0.00 39.48 38.82 1jea n PHE 50 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1jea s VAL 51 N -2.65 4.93 0.26 -4.37 1.01 -1.24 -4.60 120.40 113.74 1jea s VAL 51 Ca 0.29 -0.91 -0.31 0.00 0.00 0.00 0.00 61.98 61.06 1jea s VAL 51 Cb 0.26 -3.83 -0.12 0.00 0.00 0.00 0.00 36.38 32.69 1jea s VAL 51 CO 0.03 -0.38 1.65 -2.16 0.00 0.00 0.00 175.10 174.24 1jea s PRO 52 N 1.60 4.11 0.00 2.72 0.04 -1.26 -2.36 135.00 139.85 1jea s PRO 52 Ca 0.04 2.61 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1jea s PRO 52 Cb -0.21 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1jea s PRO 52 CO 0.07 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 176.83 1jea n GLY 53 N 2.87 0.79 2.34 0.56 0.00 -1.26 -4.94 105.19 105.56 1jea n GLY 53 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 1jea n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jea n GLU 54 N -2.00 0.52 0.22 1.61 1.02 -1.00 -4.99 120.64 116.02 1jea n GLU 54 Ca 0.00 -3.00 0.16 0.00 -0.02 0.00 0.00 57.16 54.29 1jea n GLU 54 Cb 0.00 -1.41 0.71 0.00 -0.02 0.00 0.00 31.44 30.72 1jea n GLU 54 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1jea h PRO 55 N 4.64 0.00 -6.49 3.49 0.13 -1.92 -3.42 132.00 128.42 1jea h PRO 55 Ca 0.12 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.77 1jea h PRO 55 Cb 0.92 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.05 1jea h PRO 55 CO 0.39 0.00 -0.21 -1.54 -0.23 0.00 0.00 178.00 176.41 1jea s SER 56 N -4.84 6.30 0.00 1.44 1.04 -1.26 -4.56 113.70 111.82 1jea s SER 56 Ca 0.00 0.44 0.26 0.00 0.48 0.00 0.00 55.95 57.13 1jea s SER 56 Cb 0.09 -2.02 0.77 0.00 0.10 0.00 0.00 66.02 64.96 1jea s SER 56 CO 0.41 -0.27 1.59 0.35 0.98 0.00 0.00 173.24 176.29 1jea n THR 57 N -1.70 0.04 -1.81 2.02 -2.24 -1.26 -4.79 114.28 104.54 1jea n THR 57 Ca -0.05 -0.34 -0.34 0.00 -2.27 0.00 0.00 64.05 61.05 1jea n THR 57 Cb 0.56 0.76 0.05 0.00 -2.10 0.00 0.00 70.33 69.60 1jea n THR 57 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1jea s GLN 58 N -1.96 2.78 -0.36 -0.78 -1.52 -1.26 -1.02 119.66 115.53 1jea s GLN 58 Ca 0.35 1.57 -0.18 0.00 -1.95 0.00 0.00 55.36 55.14 1jea s GLN 58 Cb 0.20 -1.93 0.00 0.00 -0.22 0.00 0.00 33.01 31.06 1jea s GLN 58 CO 0.32 -1.30 0.52 0.34 -0.25 0.00 0.00 175.29 174.92 1jea s ASP 60 N -2.18 6.31 0.00 5.90 2.15 -1.25 -4.51 116.67 123.09 1jea s ASP 60 Ca 0.71 -0.10 0.28 0.00 0.43 0.00 0.00 52.55 53.87 1jea s ASP 60 Cb -0.24 -2.27 1.10 0.00 -0.30 0.00 0.00 42.92 41.21 1jea s ASP 60 CO 0.39 -0.52 1.77 0.61 -0.17 0.00 0.00 175.17 177.25 1jea n GLY 61 N 4.84 -0.18 0.19 2.66 0.00 -1.25 -4.34 105.19 107.11 1jea n GLY 61 Ca -0.05 -0.41 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 1jea n GLY 61 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1jea n ASN 62 N -0.05 2.83 0.00 1.61 2.85 -1.26 -4.82 115.26 116.41 1jea n ASN 62 Ca 0.19 -0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 1jea n ASN 62 Cb 0.33 -0.14 0.00 0.00 1.24 0.00 0.00 39.78 41.21 1jea n ASN 62 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1jea n GLY 63 N 3.02 2.32 0.07 8.20 0.00 -1.26 -4.97 105.19 112.56 1jea n GLY 63 Ca -0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1jea n GLY 63 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1jea h HIS 64 N 0.00 0.10 -0.55 1.61 6.17 -1.94 -1.52 115.15 119.02 1jea h HIS 64 Ca 0.00 -0.01 -0.11 0.00 0.71 0.00 0.00 60.37 60.95 1jea h HIS 64 Cb 0.00 -0.03 -0.02 0.00 2.52 0.00 0.00 27.41 29.88 1jea h HIS 64 CO 0.00 0.32 -0.10 0.78 0.71 0.00 0.00 177.93 179.64 1jea h GLY 65 N -0.15 1.12 1.26 5.26 0.00 -1.89 -0.71 103.07 107.96 1jea h GLY 65 Ca 0.02 -0.90 0.01 0.00 0.00 0.00 0.00 47.33 46.46 1jea h GLY 65 CO 0.00 0.82 0.49 -0.84 0.00 0.00 0.00 176.54 177.01 1jea h THR 66 N 0.92 1.17 0.19 4.70 2.02 -1.55 0.26 112.91 120.63 1jea h THR 66 Ca 0.14 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 1jea h THR 66 Cb 0.67 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1jea h THR 66 CO 0.05 0.18 -0.09 -0.74 0.37 0.00 0.00 175.52 175.28 1jea h HIS 67 N 0.98 -0.24 -0.26 3.16 6.17 -0.98 -2.16 115.15 121.82 1jea h HIS 67 Ca 0.27 -0.01 0.01 0.00 0.71 0.00 0.00 60.37 61.36 1jea h HIS 67 Cb -0.09 0.08 -0.02 0.00 2.52 0.00 0.00 27.41 29.91 1jea h HIS 67 CO -0.00 0.04 0.16 0.28 0.71 0.00 0.00 177.93 179.11 1jea h VAL 68 N -0.51 1.04 -1.00 5.26 2.07 -0.89 -2.07 116.25 120.16 1jea h VAL 68 Ca -0.03 -0.11 0.07 0.00 0.82 0.00 0.00 66.70 67.45 1jea h VAL 68 Cb 0.38 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 1jea h VAL 68 CO 0.04 0.06 0.64 0.00 0.02 0.00 0.00 177.57 178.33 1jea h ALA 69 N 1.11 1.39 0.00 1.67 0.00 -0.41 -1.84 119.26 121.18 1jea h ALA 69 Ca 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1jea h ALA 69 Cb -0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1jea h ALA 69 CO -0.04 0.42 -0.33 0.78 0.00 0.00 0.00 179.25 180.08 1jea h GLY 70 N 1.16 0.00 1.23 0.00 0.00 -0.71 -1.42 103.07 103.34 1jea h GLY 70 Ca 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.70 1jea h GLY 70 CO -0.18 0.00 0.11 -0.84 0.00 0.00 0.00 176.54 175.64 1jea h THR 71 N 0.00 1.25 0.19 4.70 2.02 -0.98 -1.85 112.91 118.23 1jea h THR 71 Ca -0.00 -0.94 -0.01 0.00 0.77 0.00 0.00 66.41 66.23 1jea h THR 71 Cb 0.63 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1jea h THR 71 CO 0.04 0.35 -0.09 0.40 0.37 0.00 0.00 175.52 176.59 1jea h ILE 72 N 0.91 0.89 -0.16 3.11 2.04 -1.24 -1.40 117.51 121.66 1jea h ILE 72 Ca 0.19 -0.94 -0.20 0.00 1.00 0.00 0.00 64.86 64.91 1jea h ILE 72 Cb 0.37 1.40 -0.38 0.00 -0.74 0.00 0.00 36.82 37.47 1jea h ILE 72 CO 0.01 0.20 -1.04 0.00 0.00 0.00 0.00 178.15 177.31 1jea n ALA 73 N -2.49 2.55 -1.75 1.87 0.00 -0.58 -0.01 120.51 120.11 1jea n ALA 73 Ca -0.08 -2.56 -0.42 0.00 0.00 0.00 0.00 53.44 50.38 1jea n ALA 73 Cb 0.26 -0.76 -0.02 0.00 0.00 0.00 0.00 19.45 18.93 1jea n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jea s ALA 74 N -1.49 3.83 0.52 0.00 0.00 -0.70 -4.67 121.76 119.25 1jea s ALA 74 Ca 0.32 1.58 -0.23 0.00 0.00 0.00 0.00 51.96 53.64 1jea s ALA 74 Cb 0.37 -3.67 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1jea s ALA 74 CO -0.12 -0.96 1.38 -0.51 0.00 0.00 0.00 175.76 175.55 1jea s LEU 75 N 0.20 3.92 -0.57 0.00 1.43 0.41 -1.09 118.68 122.98 1jea s LEU 75 Ca 0.68 2.82 -0.21 0.00 -1.03 0.00 0.00 54.13 56.40 1jea s LEU 75 Cb -0.49 -4.18 0.07 0.00 0.03 0.00 0.00 46.19 41.63 1jea s LEU 75 CO 0.41 -1.47 0.77 0.21 0.23 0.00 0.00 176.35 176.50 1jea s ASN 76 N -0.81 6.22 0.00 2.29 2.47 -1.26 -4.65 114.94 119.20 1jea s ASN 76 Ca 0.69 -0.96 0.00 0.00 0.42 0.00 0.00 52.86 53.01 1jea s ASN 76 Cb -0.42 -2.35 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 1jea s ASN 76 CO 0.51 -1.12 0.00 -0.46 -3.72 0.00 0.00 177.10 172.30 1jea n ASN 77 N 6.77 1.04 -1.32 -4.21 0.23 -1.26 -5.06 115.26 111.45 1jea n ASN 77 Ca -0.05 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 54.10 1jea n ASN 77 Cb 0.45 0.00 0.31 0.00 -2.08 0.00 0.00 39.78 38.46 1jea n ASN 77 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1jea n SER 78 N 0.00 4.09 -4.41 0.53 7.64 -1.26 -4.66 113.62 115.55 1jea n SER 78 Ca 0.00 -2.18 -0.21 0.00 1.01 0.00 0.00 58.87 57.50 1jea n SER 78 Cb 0.00 -0.49 -0.10 0.00 -1.01 0.00 0.00 64.21 62.61 1jea n SER 78 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1jea s ILE 79 N -1.33 1.03 0.00 0.44 -4.36 -1.26 -0.09 121.20 115.63 1jea s ILE 79 Ca 0.46 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.85 1jea s ILE 79 Cb 0.26 -2.74 0.00 0.00 1.25 0.00 0.00 42.46 41.23 1jea s ILE 79 CO 0.27 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.06 1jea n GLY 80 N -0.65 3.13 0.00 6.27 0.00 -1.25 -4.58 105.19 108.12 1jea n GLY 80 Ca -0.02 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1jea n GLY 80 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1jea n VAL 81 N 0.00 0.00 -3.77 1.61 0.24 -1.26 -0.85 118.33 114.30 1jea n VAL 81 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 1jea n VAL 81 Cb 0.00 -0.10 -0.14 0.00 -1.47 0.00 0.00 33.84 32.13 1jea n VAL 81 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1jea s LEU 82 N 0.00 0.97 0.53 1.34 2.96 -1.23 -4.56 118.68 118.69 1jea s LEU 82 Ca 0.00 0.26 -0.04 0.00 -0.22 0.00 0.00 54.13 54.14 1jea s LEU 82 Cb 0.00 0.34 -0.00 0.00 0.50 0.00 0.00 46.19 47.03 1jea s LEU 82 CO 0.00 -0.12 0.81 -0.83 -1.32 0.00 0.00 176.35 174.89 1jea s GLY 83 N 0.86 1.58 0.17 7.98 0.00 -0.25 -4.69 107.32 112.97 1jea s GLY 83 Ca -0.07 -0.78 -0.12 0.00 0.00 0.00 0.00 44.72 43.75 1jea s GLY 83 CO -0.04 -0.55 1.74 -2.08 0.00 0.00 0.00 173.10 172.17 1jea h VAL 84 N 0.06 1.22 -2.55 1.40 2.07 -0.68 -3.35 116.25 114.42 1jea h VAL 84 Ca -0.46 -0.65 -0.60 0.00 0.82 0.00 0.00 66.70 65.81 1jea h VAL 84 Cb 1.25 0.57 -0.41 0.00 -1.52 0.00 0.00 31.29 31.17 1jea h VAL 84 CO 0.60 0.26 -0.67 0.00 0.02 0.00 0.00 177.57 177.77 1jea n ALA 85 N -2.35 3.53 0.26 1.67 0.00 0.99 -4.90 120.51 119.70 1jea n ALA 85 Ca 0.03 -4.37 0.09 0.00 0.00 0.00 0.00 53.44 49.19 1jea n ALA 85 Cb 0.14 -0.93 0.42 0.00 0.00 0.00 0.00 19.45 19.08 1jea n ALA 85 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1jea n PRO 86 N 1.56 0.11 0.00 0.00 -0.04 -1.09 -1.42 135.00 134.12 1jea n PRO 86 Ca 0.25 0.49 0.10 0.00 -0.04 0.00 0.00 63.50 64.30 1jea n PRO 86 Cb 0.40 -1.79 0.05 0.00 -0.04 0.00 0.00 33.50 32.12 1jea n PRO 86 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1jea n SER 87 N -2.02 2.35 -4.63 3.54 7.64 -0.31 -4.53 113.62 115.67 1jea n SER 87 Ca 0.01 -1.68 -0.40 0.00 1.01 0.00 0.00 58.87 57.81 1jea n SER 87 Cb 0.11 0.21 0.02 0.00 -1.01 0.00 0.00 64.21 63.54 1jea n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jea n ALA 88 N 0.63 0.37 -2.61 -0.43 0.00 -0.51 -3.95 120.51 114.01 1jea n ALA 88 Ca 0.10 0.17 -0.43 0.00 0.00 0.00 0.00 53.44 53.29 1jea n ALA 88 Cb 0.47 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 1jea n ALA 88 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1jea s GLU 89 N -2.25 3.88 -0.18 0.00 2.02 0.48 -4.97 118.70 117.67 1jea s GLU 89 Ca 0.66 0.73 -0.11 0.00 0.02 0.00 0.00 54.97 56.27 1jea s GLU 89 Cb -0.51 -3.81 -0.05 0.00 0.10 0.00 0.00 34.13 29.87 1jea s GLU 89 CO 0.54 -1.03 0.18 -1.17 0.02 0.00 0.00 175.26 173.80 1jea s LEU 90 N 3.75 4.23 -0.09 1.80 2.96 -1.26 -1.11 118.68 128.95 1jea s LEU 90 Ca 0.43 0.33 0.04 0.00 -0.22 0.00 0.00 54.13 54.71 1jea s LEU 90 Cb -0.11 -2.18 -0.00 0.00 0.50 0.00 0.00 46.19 44.40 1jea s LEU 90 CO 0.21 0.17 -0.24 -0.31 -1.32 0.00 0.00 176.35 174.85 1jea s TYR 91 N 0.32 2.55 -0.49 5.38 1.51 0.26 0.62 117.35 127.50 1jea s TYR 91 Ca 0.11 -1.00 -0.21 0.00 -1.01 0.00 0.00 57.07 54.96 1jea s TYR 91 Cb -0.12 -1.70 0.04 0.00 -0.11 0.00 0.00 41.96 40.08 1jea s TYR 91 CO 0.00 -0.39 0.72 0.00 -1.11 0.00 0.00 175.55 174.77 1jea s ALA 92 N 0.27 3.31 -0.38 3.71 0.00 0.22 -1.94 121.76 126.96 1jea s ALA 92 Ca -0.17 -1.39 -0.09 0.00 0.00 0.00 0.00 51.96 50.32 1jea s ALA 92 Cb -0.17 -3.43 0.05 0.00 0.00 0.00 0.00 23.12 19.56 1jea s ALA 92 CO 0.08 -2.02 0.19 0.08 0.00 0.00 0.00 175.76 174.09 1jea s VAL 93 N 3.06 4.19 -0.47 0.00 1.01 -0.72 -1.82 120.40 125.64 1jea s VAL 93 Ca 0.22 -1.12 -0.22 0.00 0.00 0.00 0.00 61.98 60.87 1jea s VAL 93 Cb -0.15 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 32.84 1jea s VAL 93 CO 0.17 -0.30 0.72 -0.75 0.00 0.00 0.00 175.10 174.94 1jea s LYS 94 N 1.46 3.30 0.00 2.72 2.20 -0.51 -1.67 119.74 127.23 1jea s LYS 94 Ca 0.01 -0.36 0.00 0.00 -0.36 0.00 0.00 55.97 55.26 1jea s LYS 94 Cb -0.20 -3.98 0.00 0.00 -1.51 0.00 0.00 37.83 32.13 1jea s LYS 94 CO 0.04 -1.14 0.00 1.33 -0.36 0.00 0.00 175.35 175.22 1jea n VAL 95 N 5.95 0.00 -5.19 4.02 0.24 -0.15 -0.19 118.33 123.01 1jea n VAL 95 Ca -0.01 -0.41 -0.30 0.00 -2.04 0.00 0.00 64.34 61.58 1jea n VAL 95 Cb 0.47 0.99 -0.16 0.00 -1.47 0.00 0.00 33.84 33.67 1jea n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1jea s LEU 96 N -1.71 2.04 0.93 1.34 1.43 -0.77 -4.28 118.68 117.66 1jea s LEU 96 Ca 0.00 -0.45 -0.15 0.00 -1.03 0.00 0.00 54.13 52.50 1jea s LEU 96 Cb 0.00 -1.25 0.18 0.00 0.03 0.00 0.00 46.19 45.15 1jea s LEU 96 CO 0.00 0.27 1.29 -0.83 0.23 0.00 0.00 176.35 177.32 1jea s GLY 97 N -0.43 1.75 0.41 -3.19 0.00 -0.72 -3.92 107.32 101.22 1jea s GLY 97 Ca 0.05 -1.12 0.16 0.00 0.00 0.00 0.00 44.72 43.81 1jea s GLY 97 CO 0.00 -0.40 1.87 0.00 0.00 0.00 0.00 173.10 174.57 1jea h ALA 98 N -1.52 2.14 0.00 3.20 0.00 -1.87 0.18 119.26 121.38 1jea h ALA 98 Ca -0.45 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1jea h ALA 98 Cb 1.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1jea h ALA 98 CO 0.43 -0.40 0.00 0.66 0.00 0.00 0.00 179.25 179.94 1jea h SER 99 N 0.44 0.00 0.00 0.00 4.64 -1.93 -3.38 113.55 113.32 1jea h SER 99 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1jea h SER 99 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1jea h SER 99 CO -0.17 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.40 1jea n GLY 100 N -0.24 0.69 3.55 -0.77 0.00 0.63 -5.08 105.19 103.97 1jea n GLY 100 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1jea n GLY 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jea s SER 101 N -2.78 4.04 0.35 1.61 1.04 -1.25 -4.77 113.70 111.93 1jea s SER 101 Ca 0.00 -0.82 -0.00 0.00 0.48 0.00 0.00 55.95 55.61 1jea s SER 101 Cb 0.00 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.56 1jea s SER 101 CO 0.00 0.03 0.45 0.61 0.98 0.00 0.00 173.24 175.31 1jea n GLY 102 N -0.62 2.26 3.97 7.32 0.00 -1.26 -1.76 105.19 115.10 1jea n GLY 102 Ca -0.07 -1.67 -0.21 0.00 0.00 0.00 0.00 46.02 44.08 1jea n GLY 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jea s SER 103 N -3.19 6.10 0.41 1.61 1.04 -1.26 -4.99 113.70 113.42 1jea s SER 103 Ca 0.31 0.08 0.16 0.00 0.48 0.00 0.00 55.95 56.98 1jea s SER 103 Cb -0.00 -1.60 0.88 0.00 0.10 0.00 0.00 66.02 65.40 1jea s SER 103 CO 0.22 -0.35 1.88 -0.37 0.98 0.00 0.00 173.24 175.60 1jea h VAL 104 N 0.86 1.07 0.08 5.02 -1.51 -1.98 -1.50 116.25 118.29 1jea h VAL 104 Ca -0.48 -1.10 -0.00 0.00 -1.23 0.00 0.00 66.70 63.89 1jea h VAL 104 Cb 1.24 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.02 1jea h VAL 104 CO 0.57 0.30 -0.04 -1.28 -1.23 0.00 0.00 177.57 175.89 1jea h SER 105 N 0.00 -0.09 -0.64 4.19 0.87 -1.98 0.83 113.55 116.73 1jea h SER 105 Ca -0.00 -0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.47 1jea h SER 105 Cb 0.59 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.55 1jea h SER 105 CO 0.04 -0.02 0.23 0.28 -0.53 0.00 0.00 176.83 176.83 1jea h SER 106 N -0.16 0.91 -0.37 6.23 0.02 -1.72 0.12 113.55 118.57 1jea h SER 106 Ca -0.01 -0.19 -0.05 0.00 -0.84 0.00 0.00 61.79 60.70 1jea h SER 106 Cb 0.13 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1jea h SER 106 CO 0.02 0.85 0.05 0.40 -1.14 0.00 0.00 176.83 177.00 1jea h ILE 107 N 0.91 1.24 -0.74 3.27 2.04 -1.05 -1.24 117.51 121.95 1jea h ILE 107 Ca 0.21 -0.89 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 1jea h ILE 107 Cb 0.24 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 1jea h ILE 107 CO -0.01 0.30 0.28 0.00 0.00 0.00 0.00 178.15 178.72 1jea h ALA 108 N 0.90 0.97 -0.57 1.87 0.00 0.95 -2.24 119.26 121.14 1jea h ALA 108 Ca 0.11 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1jea h ALA 108 Cb 0.39 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1jea h ALA 108 CO 0.01 0.60 0.38 1.96 0.00 0.00 0.00 179.25 182.20 1jea h GLN 109 N 1.08 0.71 -0.55 0.00 4.20 -0.53 -1.90 115.11 118.11 1jea h GLN 109 Ca 0.25 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.83 1jea h GLN 109 Cb 0.23 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1jea h GLN 109 CO -0.02 0.47 -0.00 0.78 -0.67 0.00 0.00 178.83 179.39 1jea h GLY 110 N 0.74 1.02 2.00 3.46 0.00 -0.66 -1.02 103.07 108.59 1jea h GLY 110 Ca 0.21 -0.72 -0.14 0.00 0.00 0.00 0.00 47.33 46.69 1jea h GLY 110 CO -0.05 0.66 -0.65 1.41 0.00 0.00 0.00 176.54 177.91 1jea h LEU 111 N 0.87 0.00 0.01 3.11 3.38 -1.09 0.07 115.31 121.66 1jea h LEU 111 Ca 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1jea h LEU 111 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1jea h LEU 111 CO 0.03 0.65 -0.01 -0.33 0.09 0.00 0.00 178.44 178.87 1jea h GLU 112 N 0.00 -0.02 -0.63 1.13 5.08 -1.17 -0.92 114.58 118.05 1jea h GLU 112 Ca -0.01 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.46 1jea h GLU 112 Cb 1.15 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.32 1jea h GLU 112 CO 0.08 0.30 0.22 2.35 -1.00 0.00 0.00 179.01 180.97 1jea h TRP 113 N -0.33 0.38 -0.32 4.33 7.01 -1.04 0.12 115.95 126.11 1jea h TRP 113 Ca -0.00 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 1jea h TRP 113 Cb 0.32 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.30 1jea h TRP 113 CO 0.03 0.07 0.15 0.00 -2.79 0.00 0.00 178.44 175.90 1jea h ALA 114 N 1.45 0.41 -0.81 2.65 0.00 -0.74 -0.03 119.26 122.20 1jea h ALA 114 Ca 0.33 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1jea h ALA 114 Cb 0.44 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1jea h ALA 114 CO -0.34 -0.01 0.36 0.78 0.00 0.00 0.00 179.25 180.04 1jea h GLY 115 N 0.38 1.27 2.00 0.00 0.00 -0.39 -2.30 103.07 104.04 1jea h GLY 115 Ca 0.11 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 1jea h GLY 115 CO -0.01 0.62 -0.10 3.43 0.00 0.00 0.00 176.54 180.47 1jea h ASN 116 N 1.17 0.00 -0.39 0.19 2.35 -0.32 -3.27 115.58 115.31 1jea h ASN 116 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1jea h ASN 116 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1jea h ASN 116 CO -0.03 0.10 0.00 0.59 -1.65 0.00 0.00 177.43 176.44 1jea n ASN 117 N -3.18 4.36 -2.88 5.81 4.13 -0.06 -4.97 115.26 118.46 1jea n ASN 117 Ca 0.02 -2.84 -0.21 0.00 1.68 0.00 0.00 54.58 53.23 1jea n ASN 117 Cb 0.44 -0.55 0.04 0.00 -1.54 0.00 0.00 39.78 38.17 1jea n ASN 117 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jea n GLY 118 N 0.04 -0.41 3.73 7.41 0.00 -1.09 -4.99 105.19 109.89 1jea n GLY 118 Ca 0.23 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 1jea n GLY 118 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jea s MET 119 N -5.73 4.39 0.05 1.61 -1.94 -0.91 -4.83 119.30 111.94 1jea s MET 119 Ca 0.33 2.00 -0.01 0.00 -1.71 0.00 0.00 55.69 56.31 1jea s MET 119 Cb -0.15 -3.23 -0.26 0.00 2.01 0.00 0.00 34.83 33.20 1jea s MET 119 CO 0.41 -0.27 1.03 0.45 -0.01 0.00 0.00 175.02 176.63 1jea h HIS 120 N 5.83 0.35 -3.86 -0.03 3.86 -0.65 -3.38 115.15 117.26 1jea h HIS 120 Ca -0.44 -0.26 -0.32 0.00 -1.16 0.00 0.00 60.37 58.19 1jea h HIS 120 Cb 1.21 -0.01 -0.29 0.00 1.06 0.00 0.00 27.41 29.38 1jea h HIS 120 CO 0.63 1.25 -0.75 0.08 0.86 0.00 0.00 177.93 180.00 1jea s VAL 121 N -2.65 0.38 -0.11 2.45 1.01 -0.81 -0.97 120.40 119.70 1jea s VAL 121 Ca -0.05 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 61.77 1jea s VAL 121 Cb 0.08 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 36.13 1jea s VAL 121 CO 0.86 0.12 -0.21 0.00 0.00 0.00 0.00 175.10 175.86 1jea s ALA 122 N -0.03 2.06 -0.32 5.51 0.00 0.40 -0.92 121.76 128.45 1jea s ALA 122 Ca 0.01 -0.94 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 1jea s ALA 122 Cb -0.03 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.23 1jea s ALA 122 CO -0.00 0.10 0.14 1.21 0.00 0.00 0.00 175.76 177.21 1jea s ASN 123 N 0.64 5.47 -0.61 0.00 2.47 0.53 -1.27 114.94 122.17 1jea s ASN 123 Ca -0.12 -0.70 0.04 0.00 0.42 0.00 0.00 52.86 52.50 1jea s ASN 123 Cb -0.16 -1.97 0.15 0.00 -1.45 0.00 0.00 41.25 37.82 1jea s ASN 123 CO 0.03 -0.24 0.38 -0.76 -3.72 0.00 0.00 177.10 172.79 1jea s LEU 124 N 1.56 4.34 -1.39 3.21 1.43 -0.56 -0.71 118.68 126.57 1jea s LEU 124 Ca 0.03 -3.43 -0.10 0.00 -1.03 0.00 0.00 54.13 49.60 1jea s LEU 124 Cb -0.18 -1.55 0.09 0.00 0.03 0.00 0.00 46.19 44.59 1jea s LEU 124 CO 0.05 -0.15 2.22 -1.20 0.23 0.00 0.00 176.35 177.50 1jea n SER 125 N 2.53 5.79 -3.84 2.29 7.64 -1.26 -1.95 113.62 124.83 1jea n SER 125 Ca 0.14 -2.97 -0.07 0.00 1.01 0.00 0.00 58.87 56.98 1jea n SER 125 Cb 0.34 -1.52 -0.02 0.00 -1.01 0.00 0.00 64.21 62.00 1jea n SER 125 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1jea s LEU 126 N 0.20 -0.27 0.00 -3.43 0.05 -1.26 -4.89 118.68 109.08 1jea s LEU 126 Ca 0.48 -0.59 0.00 0.00 0.05 0.00 0.00 54.13 54.08 1jea s LEU 126 Cb 0.14 2.71 0.00 0.00 -2.05 0.00 0.00 46.19 46.99 1jea s LEU 126 CO -0.05 -1.33 0.00 0.61 -0.55 0.00 0.00 176.35 175.03 1jea n GLY 127 N -0.46 0.26 3.14 -3.48 0.00 -1.26 -4.36 105.19 99.04 1jea n GLY 127 Ca -0.04 -0.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.94 1jea n GLY 127 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jea s SER 128 N 0.00 -0.11 0.45 1.61 0.15 0.29 -4.94 113.70 111.16 1jea s SER 128 Ca 0.00 0.06 0.25 0.00 0.70 0.00 0.00 55.95 56.96 1jea s SER 128 Cb 0.00 0.31 0.72 0.00 -1.71 0.00 0.00 66.02 65.34 1jea s SER 128 CO 0.00 -0.31 1.74 1.55 1.20 0.00 0.00 173.24 177.42 1jea h PRO 129 N 4.60 0.00 -5.95 5.44 0.13 -1.93 0.48 132.00 134.78 1jea h PRO 129 Ca -0.29 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.24 1jea h PRO 129 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 1jea h PRO 129 CO 0.39 0.11 -0.19 -1.12 -0.23 0.00 0.00 178.00 176.96 1jea s SER 130 N -6.09 6.78 0.61 1.44 0.01 -1.26 -4.73 113.70 110.47 1jea s SER 130 Ca 0.04 0.93 -0.15 0.00 1.31 0.00 0.00 55.95 58.08 1jea s SER 130 Cb 0.07 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 64.02 1jea s SER 130 CO 0.64 0.26 1.05 -2.16 0.41 0.00 0.00 173.24 173.43 1jea s PRO 131 N -0.72 3.30 -0.05 12.44 0.04 -1.26 -4.71 135.00 144.05 1jea s PRO 131 Ca 0.24 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.37 1jea s PRO 131 Cb -0.16 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.37 1jea s PRO 131 CO 0.13 -0.82 0.05 0.45 0.04 0.00 0.00 177.00 176.84 1jea s SER 132 N -3.07 1.23 0.30 6.66 0.15 -1.26 -5.04 113.70 112.67 1jea s SER 132 Ca 0.62 0.05 -0.00 0.00 0.70 0.00 0.00 55.95 57.31 1jea s SER 132 Cb -0.15 -0.20 0.47 0.00 -1.71 0.00 0.00 66.02 64.43 1jea s SER 132 CO 0.41 -0.24 1.89 0.00 1.20 0.00 0.00 173.24 176.50 1jea h ALA 133 N 8.42 1.33 -0.06 5.45 0.00 -1.99 -0.56 119.26 131.83 1jea h ALA 133 Ca -0.14 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1jea h ALA 133 Cb 1.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1jea h ALA 133 CO 0.17 0.51 0.02 1.15 0.00 0.00 0.00 179.25 181.10 1jea h THR 134 N 0.85 0.99 -0.11 0.00 2.02 -1.97 -2.47 112.91 112.22 1jea h THR 134 Ca 0.20 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.36 1jea h THR 134 Cb 0.14 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1jea h THR 134 CO -0.02 0.01 0.06 0.25 0.37 0.00 0.00 175.52 176.19 1jea h LEU 135 N 0.05 0.13 -0.89 2.58 5.85 -1.80 -2.77 115.31 118.46 1jea h LEU 135 Ca 0.03 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1jea h LEU 135 Cb 0.01 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 1jea h LEU 135 CO -0.03 0.17 0.58 -0.08 -0.34 0.00 0.00 178.44 178.74 1jea h GLU 136 N 0.08 1.08 -0.58 1.25 4.81 -1.00 -0.02 114.58 120.21 1jea h GLU 136 Ca 0.04 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1jea h GLU 136 Cb 0.07 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 1jea h GLU 136 CO -0.01 0.71 0.04 -0.56 -0.73 0.00 0.00 179.01 178.46 1jea h GLN 137 N 1.11 0.99 -0.53 1.92 3.07 -1.42 0.24 115.11 120.48 1jea h GLN 137 Ca 0.36 -0.28 -0.11 0.00 0.09 0.00 0.00 58.65 58.71 1jea h GLN 137 Cb 0.03 -0.11 -0.02 0.00 0.08 0.00 0.00 27.48 27.46 1jea h GLN 137 CO -0.13 0.95 -0.10 0.00 0.09 0.00 0.00 178.83 179.64 1jea h ALA 138 N 1.11 0.72 0.10 0.06 0.00 -1.16 0.30 119.26 120.40 1jea h ALA 138 Ca 0.17 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1jea h ALA 138 Cb 0.48 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jea h ALA 138 CO 0.02 0.63 -0.05 0.28 0.00 0.00 0.00 179.25 180.14 1jea h VAL 139 N 0.87 0.95 -0.52 0.00 2.07 -0.59 -0.64 116.25 118.38 1jea h VAL 139 Ca 0.14 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1jea h VAL 139 Cb 0.67 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1jea h VAL 139 CO 0.05 0.04 0.07 0.78 0.02 0.00 0.00 177.57 178.52 1jea h ASN 140 N -0.20 0.79 0.03 0.57 -0.26 -0.74 -1.62 115.58 114.15 1jea h ASN 140 Ca -0.01 -0.17 -0.00 0.00 -0.56 0.00 0.00 56.30 55.56 1jea h ASN 140 Cb 0.16 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.21 1jea h ASN 140 CO 0.02 0.82 -0.01 -1.28 -1.06 0.00 0.00 177.43 175.92 1jea h SER 141 N 0.79 -0.03 -0.97 5.81 0.87 -0.27 0.16 113.55 119.92 1jea h SER 141 Ca 0.16 -0.26 0.07 0.00 -1.23 0.00 0.00 61.79 60.54 1jea h SER 141 Cb 0.38 0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.28 1jea h SER 141 CO 0.01 0.24 0.62 0.00 -0.53 0.00 0.00 176.83 177.16 1jea h ALA 142 N 0.65 1.35 -0.72 6.23 0.00 -1.07 -1.00 119.26 124.70 1jea h ALA 142 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1jea h ALA 142 Cb 0.29 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1jea h ALA 142 CO 0.01 0.38 0.41 1.15 0.00 0.00 0.00 179.25 181.20 1jea h THR 143 N 1.11 1.22 0.00 0.00 2.02 -1.09 -1.18 112.91 114.98 1jea h THR 143 Ca 0.42 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1jea h THR 143 Cb 0.19 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1jea h THR 143 CO -0.18 0.23 0.00 -1.54 0.37 0.00 0.00 175.52 174.40 1jea n SER 144 N -4.49 0.00 -0.51 4.18 3.41 0.03 -2.20 113.62 114.04 1jea n SER 144 Ca 0.06 0.13 0.08 0.00 -0.26 0.00 0.00 58.87 58.88 1jea n SER 144 Cb 0.08 -0.37 0.29 0.00 -0.26 0.00 0.00 64.21 63.95 1jea n SER 144 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1jea n ARG 145 N -1.37 1.65 -0.99 4.33 5.12 -0.53 -4.92 116.66 119.96 1jea n ARG 145 Ca 0.10 -1.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.03 1jea n ARG 145 Cb 0.25 -1.32 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 1jea n ARG 145 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jea n GLY 146 N 1.04 0.39 3.79 -0.13 0.00 -0.93 -4.96 105.19 104.39 1jea n GLY 146 Ca 0.13 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.71 1jea n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jea s VAL 147 N -2.00 4.93 -0.28 1.61 1.01 -0.72 -4.44 120.40 120.50 1jea s VAL 147 Ca 0.00 1.06 -0.20 0.00 0.00 0.00 0.00 61.98 62.85 1jea s VAL 147 Cb 0.00 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1jea s VAL 147 CO 0.00 0.50 0.59 -0.22 0.00 0.00 0.00 175.10 175.97 1jea s LEU 148 N -0.63 4.11 -0.25 3.92 2.96 -0.14 -4.10 118.68 124.54 1jea s LEU 148 Ca 0.27 0.50 -0.15 0.00 -0.22 0.00 0.00 54.13 54.53 1jea s LEU 148 Cb -0.18 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.70 1jea s LEU 148 CO 0.15 -0.40 0.39 -0.69 -1.32 0.00 0.00 176.35 174.48 1jea s VAL 149 N 2.50 5.17 -0.20 1.68 1.01 -1.26 -0.46 120.40 128.84 1jea s VAL 149 Ca 0.24 0.63 -0.02 0.00 0.00 0.00 0.00 61.98 62.83 1jea s VAL 149 Cb -0.15 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 1jea s VAL 149 CO 0.10 0.17 -0.09 -0.69 0.00 0.00 0.00 175.10 174.59 1jea s VAL 150 N 1.93 3.00 0.11 2.92 1.01 -0.40 0.56 120.40 129.54 1jea s VAL 150 Ca 0.16 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1jea s VAL 150 Cb -0.15 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1jea s VAL 150 CO 0.09 0.47 -0.14 0.00 0.00 0.00 0.00 175.10 175.52 1jea s ALA 151 N 1.25 1.41 0.34 5.51 0.00 0.98 -1.50 121.76 129.75 1jea s ALA 151 Ca 0.03 -1.23 -0.27 0.00 0.00 0.00 0.00 51.96 50.49 1jea s ALA 151 Cb -0.14 -0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.81 1jea s ALA 151 CO -0.04 0.11 1.15 0.00 0.00 0.00 0.00 175.76 176.98 1jea s ALA 152 N -1.98 3.30 -0.29 0.00 0.00 -0.82 -1.09 121.76 120.88 1jea s ALA 152 Ca 0.07 0.96 0.24 0.00 0.00 0.00 0.00 51.96 53.23 1jea s ALA 152 Cb -0.06 -3.36 0.52 0.00 0.00 0.00 0.00 23.12 20.22 1jea s ALA 152 CO 0.03 -0.37 1.67 0.66 0.00 0.00 0.00 175.76 177.75 1jea h SER 153 N 3.21 0.00 -5.00 0.00 4.64 -0.54 -3.41 113.55 112.46 1jea h SER 153 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1jea h SER 153 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1jea h SER 153 CO 0.65 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 1jea n GLY 154 N 0.88 2.47 0.72 -0.77 0.00 -1.26 -1.27 105.19 105.95 1jea n GLY 154 Ca 0.03 -2.03 0.06 0.00 0.00 0.00 0.00 46.02 44.09 1jea n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jea n ASN 155 N 0.00 3.13 0.17 1.61 3.02 -1.25 -0.97 115.26 120.97 1jea n ASN 155 Ca 0.00 -3.22 0.04 0.00 -0.03 0.00 0.00 54.58 51.37 1jea n ASN 155 Cb 0.00 -0.53 0.21 0.00 -0.61 0.00 0.00 39.78 38.84 1jea n ASN 155 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1jea h SER 156 N 1.15 0.00 0.00 6.41 4.64 -1.89 -3.44 113.55 120.42 1jea h SER 156 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1jea h SER 156 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1jea h SER 156 CO 0.19 0.43 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 1jea n GLY 157 N 0.67 0.88 3.81 -0.77 0.00 -0.47 -4.97 105.19 104.34 1jea n GLY 157 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1jea n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jea s ALA 158 N -3.12 2.79 -0.01 4.61 0.00 -1.26 -4.78 121.76 120.00 1jea s ALA 158 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1jea s ALA 158 Cb 0.00 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1jea s ALA 158 CO 0.00 -0.74 1.25 0.41 0.00 0.00 0.00 175.76 176.68 1jea n GLY 159 N -1.15 2.19 3.32 0.00 0.00 -1.26 -1.28 105.19 107.00 1jea n GLY 159 Ca 0.08 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1jea n GLY 159 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jea s SER 160 N 1.15 -0.42 0.29 1.61 1.04 0.25 -4.22 113.70 113.41 1jea s SER 160 Ca 0.02 0.74 0.05 0.00 0.48 0.00 0.00 55.95 57.23 1jea s SER 160 Cb 0.01 0.77 -0.02 0.00 0.10 0.00 0.00 66.02 66.88 1jea s SER 160 CO 0.00 -0.22 0.43 0.27 0.98 0.00 0.00 173.24 174.70 1jea s ILE 165 N -0.08 4.87 0.86 -1.02 -4.36 -1.22 -4.29 121.20 115.96 1jea s ILE 165 Ca -0.03 -0.90 -0.12 0.00 -0.26 0.00 0.00 60.65 59.35 1jea s ILE 165 Cb -0.03 -3.73 0.11 0.00 1.25 0.00 0.00 42.46 40.06 1jea s ILE 165 CO 0.02 -0.32 1.16 -0.44 0.24 0.00 0.00 174.94 175.60 1jea s SER 166 N -4.05 3.99 -0.08 4.36 0.01 -0.40 -4.67 113.70 112.85 1jea s SER 166 Ca 0.38 0.89 -0.04 0.00 1.31 0.00 0.00 55.95 58.49 1jea s SER 166 Cb -0.09 -1.43 -0.04 0.00 0.21 0.00 0.00 66.02 64.67 1jea s SER 166 CO 0.31 -2.24 0.08 -0.31 0.41 0.00 0.00 173.24 171.49 1jea s TYR 167 N -3.41 3.39 -1.83 2.43 2.02 0.17 0.24 117.35 120.36 1jea s TYR 167 Ca 0.63 0.35 0.30 0.00 -0.37 0.00 0.00 57.07 57.98 1jea s TYR 167 Cb -0.13 -1.85 1.53 0.00 -0.40 0.00 0.00 41.96 41.11 1jea s TYR 167 CO 0.51 0.61 2.03 -0.35 -1.57 0.00 0.00 175.55 176.78 1jea n PRO 168 N 1.86 0.86 -0.18 -1.71 -0.04 -1.26 -0.55 135.00 133.98 1jea n PRO 168 Ca -0.18 -0.17 0.17 0.00 -0.04 0.00 0.00 63.50 63.27 1jea n PRO 168 Cb 0.54 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 33.02 1jea n PRO 168 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jea h ALA 169 N 3.80 2.16 -0.43 0.55 0.00 -1.58 -2.12 119.26 121.64 1jea h ALA 169 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1jea h ALA 169 Cb 0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1jea h ALA 169 CO 0.00 -0.38 0.29 -0.09 0.00 0.00 0.00 179.25 179.06 1jea h ARG 170 N 0.40 0.41 -6.74 0.00 9.65 -0.48 -3.38 114.38 114.23 1jea h ARG 170 Ca 0.39 -0.02 -0.56 0.00 -1.10 0.00 0.00 59.98 58.68 1jea h ARG 170 Cb 0.95 -0.09 0.10 0.00 -1.39 0.00 0.00 29.97 29.54 1jea h ARG 170 CO -0.13 0.27 0.59 0.66 2.80 0.00 0.00 179.97 184.16 1jea n TYR 171 N -4.48 2.40 -0.22 2.20 4.01 -0.80 -4.79 117.16 115.47 1jea n TYR 171 Ca 0.05 0.49 0.17 0.00 -0.16 0.00 0.00 57.90 58.45 1jea n TYR 171 Cb 0.19 -2.46 0.50 0.00 -0.31 0.00 0.00 39.34 37.26 1jea n TYR 171 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1jea h ALA 172 N 3.13 2.15 -0.00 -0.72 0.00 -1.89 -1.71 119.26 120.22 1jea h ALA 172 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1jea h ALA 172 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1jea h ALA 172 CO 0.67 -0.40 -0.16 0.09 0.00 0.00 0.00 179.25 179.45 1jea n ASN 173 N -4.50 0.39 -4.88 0.00 5.03 -1.26 -4.78 115.26 105.26 1jea n ASN 173 Ca 0.18 -0.30 -0.36 0.00 0.87 0.00 0.00 54.58 54.96 1jea n ASN 173 Cb 0.63 -0.10 -0.06 0.00 -1.02 0.00 0.00 39.78 39.23 1jea n ASN 173 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1jea s ALA 174 N -2.68 3.85 -0.48 5.41 0.00 -0.64 -4.52 121.76 122.71 1jea s ALA 174 Ca 0.23 -0.57 -0.22 0.00 0.00 0.00 0.00 51.96 51.39 1jea s ALA 174 Cb 0.19 -2.05 0.03 0.00 0.00 0.00 0.00 23.12 21.30 1jea s ALA 174 CO 0.53 0.62 0.77 1.41 0.00 0.00 0.00 175.76 179.08 1jea s MET 175 N -1.30 3.32 -0.17 0.00 1.75 0.19 -4.82 119.30 118.27 1jea s MET 175 Ca 0.21 -0.31 -0.26 0.00 -1.25 0.00 0.00 55.69 54.07 1jea s MET 175 Cb -0.13 -3.99 -0.01 0.00 2.84 0.00 0.00 34.83 33.54 1jea s MET 175 CO 0.10 -1.19 0.88 0.00 -0.65 0.00 0.00 175.02 174.16 1jea s ALA 176 N 3.24 3.52 -0.14 4.11 0.00 -1.26 -0.01 121.76 131.22 1jea s ALA 176 Ca 0.26 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.33 1jea s ALA 176 Cb -0.14 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 1jea s ALA 176 CO 0.20 -0.69 -0.16 0.08 0.00 0.00 0.00 175.76 175.18 1jea s VAL 177 N 2.26 2.65 0.42 0.00 1.01 -0.25 -1.08 120.40 125.41 1jea s VAL 177 Ca 0.40 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.67 1jea s VAL 177 Cb -0.17 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 1jea s VAL 177 CO 0.12 0.53 0.36 -0.83 0.00 0.00 0.00 175.10 175.28 1jea s GLY 178 N 0.57 2.16 -0.05 4.51 0.00 -0.60 0.21 107.32 114.13 1jea s GLY 178 Ca -0.10 -1.91 0.04 0.00 0.00 0.00 0.00 44.72 42.75 1jea s GLY 178 CO 0.04 -1.72 -0.17 0.00 0.00 0.00 0.00 173.10 171.25 1jea s ALA 179 N -2.49 2.56 0.36 3.20 0.00 -1.26 -1.32 121.76 122.81 1jea s ALA 179 Ca 0.47 -1.00 0.08 0.00 0.00 0.00 0.00 51.96 51.51 1jea s ALA 179 Cb -0.02 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 1jea s ALA 179 CO 0.27 0.53 0.15 0.95 0.00 0.00 0.00 175.76 177.66 1jea s THR 180 N -0.63 2.79 0.25 0.00 -4.23 -0.28 -0.60 115.64 112.94 1jea s THR 180 Ca 0.09 -1.71 0.03 0.00 -1.18 0.00 0.00 61.69 58.92 1jea s THR 180 Cb -0.11 -2.96 0.03 0.00 1.34 0.00 0.00 72.50 70.80 1jea s THR 180 CO 0.01 -0.13 0.21 -0.90 -0.54 0.00 0.00 174.62 173.27 1jea n ASP 181 N -1.17 1.69 0.12 3.99 5.68 0.40 -1.41 116.55 125.85 1jea n ASP 181 Ca -0.02 -1.85 0.11 0.00 -0.50 0.00 0.00 54.79 52.53 1jea n ASP 181 Cb 0.62 -0.04 0.47 0.00 -1.14 0.00 0.00 41.12 41.03 1jea n ASP 181 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jea n GLN 182 N -1.16 0.18 0.00 0.11 3.00 -1.26 -1.96 117.38 116.29 1jea n GLN 182 Ca 0.00 0.40 0.13 0.00 -0.01 0.00 0.00 57.00 57.52 1jea n GLN 182 Cb 0.29 -1.83 0.41 0.00 0.00 0.00 0.00 30.24 29.11 1jea n GLN 182 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1jea n ASN 183 N -2.16 0.85 -1.94 1.08 3.02 -1.26 -4.92 115.26 109.94 1jea n ASN 183 Ca 0.02 -0.74 -0.13 0.00 -0.03 0.00 0.00 54.58 53.70 1jea n ASN 183 Cb 0.23 0.10 0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1jea n ASN 183 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1jea n ASN 184 N -0.81 -4.25 -4.71 6.41 3.02 -0.83 -5.04 115.26 109.05 1jea n ASN 184 Ca 0.12 -0.20 -0.23 0.00 -0.03 0.00 0.00 54.58 54.24 1jea n ASN 184 Cb 0.33 -3.05 -0.06 0.00 -0.61 0.00 0.00 39.78 36.39 1jea n ASN 184 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1jea s ASN 185 N -2.93 4.92 0.13 6.41 0.01 -1.26 -4.90 114.94 117.32 1jea s ASN 185 Ca 0.22 -0.47 -0.31 0.00 -0.71 0.00 0.00 52.86 51.59 1jea s ASN 185 Cb -0.10 -1.07 -0.08 0.00 0.41 0.00 0.00 41.25 40.42 1jea s ASN 185 CO 0.27 -0.00 1.29 -0.60 -1.51 0.00 0.00 177.10 176.55 1jea s ARG 186 N -3.64 4.39 0.32 -0.60 3.52 -1.26 -0.45 118.95 121.23 1jea s ARG 186 Ca 0.31 1.96 -0.29 0.00 -0.13 0.00 0.00 55.73 57.59 1jea s ARG 186 Cb -0.07 -3.26 -0.10 0.00 -1.56 0.00 0.00 34.95 29.96 1jea s ARG 186 CO 0.22 -0.29 1.30 0.00 -0.81 0.00 0.00 175.30 175.72 1jea s ALA 187 N 0.66 3.50 0.50 6.12 0.00 0.23 -4.82 121.76 127.94 1jea s ALA 187 Ca 0.59 1.24 0.21 0.00 0.00 0.00 0.00 51.96 54.01 1jea s ALA 187 Cb -0.34 -3.47 1.27 0.00 0.00 0.00 0.00 23.12 20.57 1jea s ALA 187 CO 0.33 -0.62 1.98 0.66 0.00 0.00 0.00 175.76 178.11 1jea h SER 188 N 3.49 0.13 0.94 0.00 4.64 -1.93 -0.80 113.55 120.02 1jea h SER 188 Ca -0.49 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1jea h SER 188 Cb 1.23 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1jea h SER 188 CO 0.66 0.07 -0.07 2.22 -0.87 0.00 0.00 176.83 178.84 1jea n PHE 189 N -4.42 0.01 -2.28 4.77 1.16 -1.26 -4.33 117.46 111.11 1jea n PHE 189 Ca 0.10 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.26 1jea n PHE 189 Cb 0.54 -0.47 -0.02 0.00 -1.61 0.00 0.00 39.48 37.91 1jea n PHE 189 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1jea s SER 190 N -3.02 6.85 0.51 5.98 0.15 -0.31 -1.37 113.70 122.50 1jea s SER 190 Ca 0.14 1.89 -0.21 0.00 0.70 0.00 0.00 55.95 58.46 1jea s SER 190 Cb 0.19 -2.54 -0.06 0.00 -1.71 0.00 0.00 66.02 61.90 1jea s SER 190 CO 0.55 -0.81 1.15 -1.10 1.20 0.00 0.00 173.24 174.24 1jea s GLN 191 N 3.62 3.52 0.02 5.44 -0.21 -0.14 -4.50 119.66 127.41 1jea s GLN 191 Ca 0.61 1.71 0.00 0.00 0.02 0.00 0.00 55.36 57.70 1jea s GLN 191 Cb -0.26 -2.19 -0.00 0.00 1.00 0.00 0.00 33.01 31.57 1jea s GLN 191 CO 0.20 -0.74 0.03 2.48 -2.12 0.00 0.00 175.29 175.14 1jea n TYR 192 N -0.94 -0.39 0.00 0.91 4.11 -0.40 -4.81 117.16 115.63 1jea n TYR 192 Ca 0.10 -0.14 0.00 0.00 -0.00 0.00 0.00 57.90 57.86 1jea n TYR 192 Cb 0.49 0.03 0.00 0.00 -0.00 0.00 0.00 39.34 39.86 1jea n TYR 192 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1jea n GLY 193 N -0.03 -0.21 3.72 -7.48 0.00 0.79 -0.58 105.19 101.40 1jea n GLY 193 Ca 0.00 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 1jea n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jea s ALA 194 N -2.00 3.75 0.00 4.61 0.00 -1.26 -2.74 121.76 124.12 1jea s ALA 194 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1jea s ALA 194 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1jea s ALA 194 CO 0.00 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.39 1jea n GLY 195 N 3.43 0.69 3.68 0.00 0.00 -1.26 -4.56 105.19 107.18 1jea n GLY 195 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1jea n GLY 195 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jea s LEU 196 N 0.00 4.35 -0.21 0.99 2.96 -1.11 -4.36 118.68 121.30 1jea s LEU 196 Ca 0.00 2.40 0.07 0.00 -0.22 0.00 0.00 54.13 56.39 1jea s LEU 196 Cb 0.00 -3.56 -0.18 0.00 0.50 0.00 0.00 46.19 42.95 1jea s LEU 196 CO 0.00 -0.87 -0.10 0.47 -1.32 0.00 0.00 176.35 174.53 1jea n ASP 197 N 5.80 1.56 -3.77 3.68 8.00 -0.24 -4.37 116.55 127.20 1jea n ASP 197 Ca 0.16 -0.08 -0.04 0.00 0.71 0.00 0.00 54.79 55.54 1jea n ASP 197 Cb 0.41 0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.63 1jea n ASP 197 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1jea s ILE 198 N -2.45 0.00 0.22 0.53 2.07 -1.02 -0.99 121.20 119.56 1jea s ILE 198 Ca -0.23 -0.72 0.04 0.00 -1.41 0.00 0.00 60.65 58.33 1jea s ILE 198 Cb 0.07 -1.97 -0.05 0.00 0.13 0.00 0.00 42.46 40.64 1jea s ILE 198 CO 0.62 0.00 -0.03 0.68 -1.91 0.00 0.00 174.94 174.30 1jea s VAL 199 N -3.42 1.10 0.24 4.00 -7.23 -0.50 -1.56 120.40 113.02 1jea s VAL 199 Ca 0.12 -2.05 -0.20 0.00 -1.81 0.00 0.00 61.98 58.04 1jea s VAL 199 Cb -0.02 -2.25 0.03 0.00 0.56 0.00 0.00 36.38 34.70 1jea s VAL 199 CO 0.03 -0.41 0.65 0.00 -0.31 0.00 0.00 175.10 175.06 1jea s ALA 200 N -3.38 -1.18 0.20 1.32 0.00 -0.44 -2.05 121.76 116.24 1jea s ALA 200 Ca 0.26 -0.18 -0.33 0.00 0.00 0.00 0.00 51.96 51.72 1jea s ALA 200 Cb 0.05 0.88 -0.13 0.00 0.00 0.00 0.00 23.12 23.91 1jea s ALA 200 CO 0.07 -0.93 1.59 -2.30 0.00 0.00 0.00 175.76 174.19 1jea n PRO 201 N -0.42 2.33 -0.14 0.00 -0.02 -1.26 -1.12 135.00 134.37 1jea n PRO 201 Ca -0.07 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 1jea n PRO 201 Cb 0.61 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1jea n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jea n GLY 202 N 3.23 -1.47 3.36 -1.23 0.00 -0.50 -3.06 105.19 105.52 1jea n GLY 202 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1jea n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jea s VAL 203 N 0.00 2.88 -1.25 1.61 1.01 -1.23 0.55 120.40 123.97 1jea s VAL 203 Ca 0.00 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.20 1jea s VAL 203 Cb 0.00 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1jea s VAL 203 CO 0.00 0.54 0.73 0.59 0.00 0.00 0.00 175.10 176.96 1jea n ASN 204 N 3.32 -2.56 -4.59 3.32 5.03 -1.12 -4.91 115.26 113.75 1jea n ASN 204 Ca -0.18 -0.85 -0.40 0.00 0.87 0.00 0.00 54.58 54.01 1jea n ASN 204 Cb 0.53 -4.02 -0.08 0.00 -1.02 0.00 0.00 39.78 35.19 1jea n ASN 204 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1jea s VAL 205 N -3.61 5.06 0.00 2.41 1.01 0.18 -4.78 120.40 120.67 1jea s VAL 205 Ca 0.15 0.63 -0.23 0.00 0.00 0.00 0.00 61.98 62.52 1jea s VAL 205 Cb -0.04 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1jea s VAL 205 CO 0.82 -0.02 0.70 -1.58 0.00 0.00 0.00 175.10 175.02 1jea s GLN 206 N 2.31 4.43 0.28 2.72 0.74 -1.26 -0.76 119.66 128.13 1jea s GLN 206 Ca 0.19 0.93 -0.10 0.00 0.05 0.00 0.00 55.36 56.43 1jea s GLN 206 Cb -0.16 -3.38 0.04 0.00 1.10 0.00 0.00 33.01 30.62 1jea s GLN 206 CO 0.11 0.25 0.56 0.45 -0.55 0.00 0.00 175.29 176.11 1jea n SER 207 N 3.02 -1.62 -4.77 6.67 2.88 -0.36 -4.84 113.62 114.61 1jea n SER 207 Ca -0.03 -2.15 -0.40 0.00 -1.33 0.00 0.00 58.87 54.96 1jea n SER 207 Cb 0.51 2.70 -0.01 0.00 -0.75 0.00 0.00 64.21 66.65 1jea n SER 207 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1jea s THR 208 N -2.37 2.66 -0.03 2.46 -4.23 -1.26 -0.19 115.64 112.67 1jea s THR 208 Ca 0.12 0.63 -0.12 0.00 -1.18 0.00 0.00 61.69 61.13 1jea s THR 208 Cb -0.03 -3.39 0.02 0.00 1.34 0.00 0.00 72.50 70.44 1jea s THR 208 CO 0.09 0.13 0.27 -0.47 -0.54 0.00 0.00 174.62 174.10 1jea s TYR 209 N -1.19 -0.17 0.60 3.99 5.04 -0.27 -2.87 117.35 122.48 1jea s TYR 209 Ca 0.52 0.31 -0.19 0.00 -2.44 0.00 0.00 57.07 55.28 1jea s TYR 209 Cb -0.39 0.07 -0.04 0.00 0.35 0.00 0.00 41.96 41.95 1jea s TYR 209 CO 0.51 -0.31 1.10 -2.30 -1.34 0.00 0.00 175.55 173.21 1jea n PRO 210 N 1.70 1.06 -1.46 4.97 -0.02 -1.26 -1.79 135.00 138.21 1jea n PRO 210 Ca -0.20 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1jea n PRO 210 Cb 0.56 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1jea n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jea n GLY 211 N 1.13 0.91 4.01 -1.23 0.00 -1.26 -4.09 105.19 104.65 1jea n GLY 211 Ca 0.14 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 1jea n GLY 211 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jea n SER 212 N 1.28 -0.47 -1.13 1.61 7.64 -1.21 -4.96 113.62 116.38 1jea n SER 212 Ca 0.00 -1.03 0.00 0.00 1.01 0.00 0.00 58.87 58.85 1jea n SER 212 Cb 0.34 -2.90 0.00 0.00 -1.01 0.00 0.00 64.21 60.65 1jea n SER 212 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1jea n THR 213 N -4.42 0.00 -4.31 0.44 5.66 -0.74 -5.00 114.28 105.91 1jea n THR 213 Ca -0.28 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.54 1jea n THR 213 Cb 0.67 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.31 1jea n THR 213 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1jea s TYR 214 N -1.14 0.85 -0.03 1.09 2.02 -1.26 -1.11 117.35 117.77 1jea s TYR 214 Ca 0.00 -0.24 -0.18 0.00 -0.37 0.00 0.00 57.07 56.28 1jea s TYR 214 Cb 0.00 -0.53 0.04 0.00 -0.40 0.00 0.00 41.96 41.06 1jea s TYR 214 CO 0.00 -0.01 0.40 0.00 -1.57 0.00 0.00 175.55 174.37 1jea s ALA 215 N -0.50 -1.03 -0.16 3.71 0.00 0.74 -4.87 121.76 119.65 1jea s ALA 215 Ca 0.01 0.62 -0.07 0.00 0.00 0.00 0.00 51.96 52.52 1jea s ALA 215 Cb -0.05 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 1jea s ALA 215 CO 0.00 -0.28 0.09 -1.12 0.00 0.00 0.00 175.76 174.45 1jea s SER 216 N -1.17 5.92 0.22 0.00 0.01 -1.26 -1.22 113.70 116.20 1jea s SER 216 Ca -0.12 0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.37 1jea s SER 216 Cb -0.04 -1.97 -0.05 0.00 0.21 0.00 0.00 66.02 64.18 1jea s SER 216 CO 0.05 0.26 0.07 -0.76 0.41 0.00 0.00 173.24 173.27 1jea s LEU 217 N -0.12 1.70 -0.02 2.44 1.43 0.06 -4.81 118.68 119.37 1jea s LEU 217 Ca 0.08 -1.31 0.06 0.00 -1.03 0.00 0.00 54.13 51.93 1jea s LEU 217 Cb -0.12 0.08 -0.01 0.00 0.03 0.00 0.00 46.19 46.17 1jea s LEU 217 CO 0.01 -0.70 -0.20 0.20 0.23 0.00 0.00 176.35 175.89 1jea s ASN 218 N -3.23 2.33 0.00 2.29 0.01 -1.26 0.49 114.94 115.57 1jea s ASN 218 Ca 0.33 -0.36 0.00 0.00 -0.71 0.00 0.00 52.86 52.12 1jea s ASN 218 Cb 0.07 -0.32 0.00 0.00 0.41 0.00 0.00 41.25 41.41 1jea s ASN 218 CO 0.10 0.23 0.00 0.61 -1.51 0.00 0.00 177.10 176.53 1jea n GLY 219 N 2.67 2.62 0.19 0.66 0.00 0.19 -4.86 105.19 106.67 1jea n GLY 219 Ca -0.16 -1.36 0.14 0.00 0.00 0.00 0.00 46.02 44.65 1jea n GLY 219 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1jea h THR 220 N 1.00 0.00 -0.04 2.61 1.35 -1.85 -2.04 112.91 113.94 1jea h THR 220 Ca 0.00 -0.54 -0.05 0.00 -0.55 0.00 0.00 66.41 65.27 1jea h THR 220 Cb 0.00 1.47 -0.01 0.00 -1.73 0.00 0.00 68.15 67.89 1jea h THR 220 CO 0.00 0.00 -0.21 0.28 -0.25 0.00 0.00 175.52 175.34 1jea h SER 221 N 0.00 0.06 0.64 5.36 0.02 -1.90 0.11 113.55 117.84 1jea h SER 221 Ca 0.00 -0.01 -0.27 0.00 -0.84 0.00 0.00 61.79 60.67 1jea h SER 221 Cb 0.63 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 1jea h SER 221 CO 0.00 0.28 -1.43 0.24 -1.14 0.00 0.00 176.83 174.78 1jea h MET 222 N 0.06 0.08 -0.07 3.45 2.07 -1.69 -3.35 114.93 115.49 1jea h MET 222 Ca 0.01 -0.13 -0.04 0.00 -2.07 0.00 0.00 59.70 57.47 1jea h MET 222 Cb 0.41 0.05 -0.00 0.00 -1.87 0.00 0.00 31.60 30.19 1jea h MET 222 CO 0.03 0.86 -0.11 0.00 1.07 0.00 0.00 176.91 178.76 1jea h ALA 223 N 0.83 0.10 -0.83 6.32 0.00 -1.19 -3.36 119.26 121.14 1jea h ALA 223 Ca -0.19 -0.32 0.16 0.00 0.00 0.00 0.00 54.91 54.56 1jea h ALA 223 Cb 1.93 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 19.55 1jea h ALA 223 CO 0.12 -0.04 -0.26 1.15 0.00 0.00 0.00 179.25 180.22 1jea h THR 224 N -0.28 0.13 0.00 0.00 2.02 -0.92 -1.44 112.91 112.42 1jea h THR 224 Ca 0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1jea h THR 224 Cb 0.66 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1jea h THR 224 CO 0.02 0.00 -0.01 1.55 0.37 0.00 0.00 175.52 177.45 1jea h PRO 225 N -0.03 0.00 -0.45 6.66 0.13 -1.72 -0.76 132.00 135.83 1jea h PRO 225 Ca 0.37 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.36 1jea h PRO 225 Cb 0.60 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1jea h PRO 225 CO -0.86 0.01 -0.27 0.45 -0.23 0.00 0.00 178.00 177.10 1jea h HIS 226 N 0.00 1.13 -0.19 1.56 3.86 -1.42 -1.61 115.15 118.47 1jea h HIS 226 Ca -0.00 -0.29 -0.05 0.00 -1.16 0.00 0.00 60.37 58.87 1jea h HIS 226 Cb 0.10 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.31 1jea h HIS 226 CO 0.00 1.12 -0.08 0.28 0.86 0.00 0.00 177.93 180.11 1jea h VAL 227 N 0.82 1.30 -0.90 2.45 2.07 -1.22 -1.53 116.25 119.25 1jea h VAL 227 Ca 0.09 -1.11 0.14 0.00 0.82 0.00 0.00 66.70 66.65 1jea h VAL 227 Cb 0.85 1.63 -0.07 0.00 -1.52 0.00 0.00 31.29 32.18 1jea h VAL 227 CO 0.08 0.33 0.58 0.00 0.02 0.00 0.00 177.57 178.58 1jea h ALA 228 N 0.70 1.82 -0.19 1.67 0.00 -1.14 -0.76 119.26 121.37 1jea h ALA 228 Ca 0.04 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1jea h ALA 228 Cb 0.55 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1jea h ALA 228 CO 0.02 -0.06 -0.11 0.78 0.00 0.00 0.00 179.25 179.88 1jea h GLY 229 N 0.71 0.45 0.75 0.00 0.00 -1.15 -2.56 103.07 101.27 1jea h GLY 229 Ca 0.45 -0.42 0.06 0.00 0.00 0.00 0.00 47.33 47.42 1jea h GLY 229 CO -0.21 0.38 0.58 0.00 0.00 0.00 0.00 176.54 177.29 1jea h ALA 230 N 0.68 1.25 -0.73 3.60 0.00 -0.76 -1.11 119.26 122.19 1jea h ALA 230 Ca 0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1jea h ALA 230 Cb 0.61 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1jea h ALA 230 CO 0.03 0.36 0.29 0.00 0.00 0.00 0.00 179.25 179.93 1jea h ALA 231 N 1.41 1.13 -0.32 0.00 0.00 -0.96 -2.63 119.26 117.90 1jea h ALA 231 Ca 0.39 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 1jea h ALA 231 Cb 0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1jea h ALA 231 CO -0.16 0.62 -0.16 0.00 0.00 0.00 0.00 179.25 179.55 1jea h ALA 232 N 1.25 1.14 -0.21 0.00 0.00 -0.81 -0.07 119.26 120.57 1jea h ALA 232 Ca 0.24 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1jea h ALA 232 Cb 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1jea h ALA 232 CO -0.02 0.54 0.13 -0.07 0.00 0.00 0.00 179.25 179.83 1jea h LEU 233 N 0.51 0.25 -0.37 0.00 3.38 -1.13 0.47 115.31 118.42 1jea h LEU 233 Ca 0.09 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1jea h LEU 233 Cb 0.57 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1jea h LEU 233 CO 0.04 0.21 -0.02 0.58 0.09 0.00 0.00 178.44 179.34 1jea h VAL 234 N 0.26 1.26 -0.71 1.22 2.07 -1.25 -1.31 116.25 117.79 1jea h VAL 234 Ca 0.08 -1.03 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1jea h VAL 234 Cb 0.01 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1jea h VAL 234 CO -0.01 0.34 0.44 0.50 0.02 0.00 0.00 177.57 178.85 1jea h LYS 235 N 0.49 0.96 -0.51 1.57 1.63 -0.75 0.51 116.57 120.46 1jea h LYS 235 Ca 0.10 -0.08 -0.11 0.00 -0.85 0.00 0.00 60.65 59.72 1jea h LYS 235 Cb 0.49 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 1jea h LYS 235 CO 0.02 0.67 -0.11 0.37 -3.45 0.00 0.00 179.45 176.95 1jea h GLN 236 N 0.98 0.97 -0.22 1.90 4.15 -0.46 -2.30 115.11 120.12 1jea h GLN 236 Ca 0.26 -0.36 -0.12 0.00 0.77 0.00 0.00 58.65 59.20 1jea h GLN 236 Cb -0.05 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1jea h GLN 236 CO -0.05 1.03 -0.37 -0.22 -1.93 0.00 0.00 178.83 177.30 1jea h LYS 237 N 0.83 0.49 -2.28 1.69 1.63 -0.14 -3.36 116.57 115.43 1jea h LYS 237 Ca 0.13 -0.23 -0.59 0.00 -0.85 0.00 0.00 60.65 59.11 1jea h LYS 237 Cb 0.67 -0.01 -0.41 0.00 -0.60 0.00 0.00 32.23 31.88 1jea h LYS 237 CO 0.05 0.79 -0.73 0.09 -3.45 0.00 0.00 179.45 176.19 1jea n ASN 238 N -4.05 2.57 0.32 4.20 3.02 0.17 -4.96 115.26 116.53 1jea n ASN 238 Ca -0.01 -3.17 0.19 0.00 -0.03 0.00 0.00 54.58 51.56 1jea n ASN 238 Cb 0.48 -0.67 1.02 0.00 -0.61 0.00 0.00 39.78 40.01 1jea n ASN 238 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1jea h PRO 239 N 4.39 0.00 -0.00 3.52 0.13 -1.58 -0.23 132.00 138.22 1jea h PRO 239 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1jea h PRO 239 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1jea h PRO 239 CO 0.71 0.00 -0.29 -1.13 -0.23 0.00 0.00 178.00 177.06 1jea n SER 240 N -3.13 0.35 -4.78 1.44 3.41 -1.26 -4.91 113.62 104.75 1jea n SER 240 Ca -0.02 -0.05 -0.37 0.00 -0.26 0.00 0.00 58.87 58.16 1jea n SER 240 Cb 0.21 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 1jea n SER 240 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1jea s TRP 241 N -2.93 3.23 0.76 7.33 0.52 -0.10 -5.05 118.94 122.70 1jea s TRP 241 Ca 0.14 1.63 -0.07 0.00 0.02 0.00 0.00 56.10 57.82 1jea s TRP 241 Cb 0.18 -3.20 0.10 0.00 -1.15 0.00 0.00 33.47 29.41 1jea s TRP 241 CO 0.61 -0.79 1.07 -1.54 0.02 0.00 0.00 176.95 176.33 1jea s SER 242 N -1.44 4.36 0.18 2.95 1.04 -1.26 -4.89 113.70 114.64 1jea s SER 242 Ca 0.57 0.24 -0.14 0.00 0.48 0.00 0.00 55.95 57.10 1jea s SER 242 Cb -0.24 -0.71 0.15 0.00 0.10 0.00 0.00 66.02 65.32 1jea s SER 242 CO 0.31 -1.89 1.70 -0.55 0.98 0.00 0.00 173.24 173.79 1jea h ASN 243 N -0.80 -0.10 -0.52 7.02 7.08 -1.91 -1.56 115.58 124.80 1jea h ASN 243 Ca -0.43 0.09 -0.01 0.00 -3.08 0.00 0.00 56.30 52.88 1jea h ASN 243 Cb 1.29 0.15 -0.02 0.00 -2.08 0.00 0.00 38.32 37.65 1jea h ASN 243 CO 0.51 -0.02 0.28 0.58 -2.08 0.00 0.00 177.43 176.71 1jea h VAL 244 N 0.16 1.18 -0.77 6.14 2.07 -1.94 -1.23 116.25 121.85 1jea h VAL 244 Ca 0.22 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 1jea h VAL 244 Cb 0.31 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1jea h VAL 244 CO -0.33 0.19 0.31 1.56 0.02 0.00 0.00 177.57 179.31 1jea h GLN 245 N 0.69 1.16 -0.00 1.57 4.20 -1.83 -0.52 115.11 120.37 1jea h GLN 245 Ca 0.18 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 1jea h GLN 245 Cb 0.05 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.64 1jea h GLN 245 CO -0.03 0.94 -0.00 0.82 -0.67 0.00 0.00 178.83 179.89 1jea h ILE 246 N 1.13 1.25 -0.64 2.54 2.04 -0.85 -1.44 117.51 121.54 1jea h ILE 246 Ca 0.26 -0.74 0.09 0.00 1.00 0.00 0.00 64.86 65.47 1jea h ILE 246 Cb 0.22 1.75 -0.07 0.00 -0.74 0.00 0.00 36.82 37.97 1jea h ILE 246 CO -0.02 0.19 0.29 -0.09 0.00 0.00 0.00 178.15 178.52 1jea h ARG 247 N -0.30 0.49 -0.13 2.37 2.43 -1.16 -0.21 114.38 117.86 1jea h ARG 247 Ca 0.00 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 58.97 1jea h ARG 247 Cb 0.32 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1jea h ARG 247 CO 0.00 0.32 -0.65 -0.91 -1.51 0.00 0.00 179.97 177.22 1jea h ASN 248 N 0.50 0.56 -0.28 -3.80 2.35 -1.05 -2.81 115.58 111.04 1jea h ASN 248 Ca 0.32 -0.33 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 1jea h ASN 248 Cb 0.35 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1jea h ASN 248 CO -0.28 1.06 -0.10 -0.74 -1.65 0.00 0.00 177.43 175.73 1jea h HIS 249 N 0.35 0.75 -0.10 1.19 2.76 -0.45 -0.49 115.15 119.16 1jea h HIS 249 Ca -0.01 -0.12 0.01 0.00 -2.20 0.00 0.00 60.37 58.04 1jea h HIS 249 Cb 1.21 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.96 1jea h HIS 249 CO 0.05 0.76 0.04 -0.07 -1.30 0.00 0.00 177.93 177.41 1jea h LEU 250 N 0.63 0.06 -0.42 0.26 3.38 -1.00 -0.29 115.31 117.92 1jea h LEU 250 Ca 0.11 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1jea h LEU 250 Cb 0.54 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1jea h LEU 250 CO 0.03 0.05 0.14 0.11 0.09 0.00 0.00 178.44 178.86 1jea h LYS 251 N 0.10 0.65 -0.33 1.13 1.57 -1.37 -1.78 116.57 116.55 1jea h LYS 251 Ca 0.04 -0.14 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 1jea h LYS 251 Cb 0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1jea h LYS 251 CO -0.04 0.63 -0.12 -0.91 -0.57 0.00 0.00 179.45 178.45 1jea h ASN 252 N 0.54 0.55 -0.24 0.86 2.35 -1.03 -3.00 115.58 115.62 1jea h ASN 252 Ca 0.14 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1jea h ASN 252 Cb 0.25 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1jea h ASN 252 CO -0.01 0.70 0.00 0.35 -1.65 0.00 0.00 177.43 176.82 1jea n THR 253 N -4.19 0.30 -1.22 2.81 -2.24 -0.13 -4.97 114.28 104.64 1jea n THR 253 Ca 0.01 -0.59 -0.31 0.00 -2.27 0.00 0.00 64.05 60.88 1jea n THR 253 Cb 0.33 0.99 0.10 0.00 -2.10 0.00 0.00 70.33 69.66 1jea n THR 253 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jea s ALA 254 N -1.70 2.12 -0.24 6.98 0.00 -0.68 -4.51 121.76 123.72 1jea s ALA 254 Ca 0.35 0.40 -0.19 0.00 0.00 0.00 0.00 51.96 52.53 1jea s ALA 254 Cb 0.21 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 1jea s ALA 254 CO 0.31 -1.91 0.54 0.99 0.00 0.00 0.00 175.76 175.68 1jea s THR 255 N -2.73 5.06 0.26 0.00 2.01 0.94 -4.80 115.64 116.39 1jea s THR 255 Ca 0.64 0.95 -0.31 0.00 0.31 0.00 0.00 61.69 63.28 1jea s THR 255 Cb -0.19 -3.85 -0.13 0.00 0.01 0.00 0.00 72.50 68.33 1jea s THR 255 CO 0.54 0.10 1.44 -0.24 -0.69 0.00 0.00 174.62 175.77 1jea n SER 256 N 5.36 3.00 0.00 3.53 2.88 -1.26 -0.69 113.62 126.45 1jea n SER 256 Ca -0.04 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 1jea n SER 256 Cb 0.50 -1.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 1jea n SER 256 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1jea n LEU 257 N 2.04 1.12 0.00 2.46 4.77 -1.26 -4.88 117.00 121.25 1jea n LEU 257 Ca 0.10 -1.12 0.00 0.00 -0.03 0.00 0.00 56.01 54.96 1jea n LEU 257 Cb 0.33 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1jea n LEU 257 CO 0.63 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 1jea n GLY 258 N -0.15 0.68 1.35 -0.72 0.00 -1.26 -5.04 105.19 100.06 1jea n GLY 258 Ca 0.00 -2.09 -0.19 0.00 0.00 0.00 0.00 46.02 43.74 1jea n GLY 258 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jea n SER 259 N 0.99 -0.55 0.06 1.61 2.88 -1.26 -4.70 113.62 112.65 1jea n SER 259 Ca 0.00 0.44 0.13 0.00 -1.33 0.00 0.00 58.87 58.11 1jea n SER 259 Cb 0.00 -0.38 0.31 0.00 -0.75 0.00 0.00 64.21 63.39 1jea n SER 259 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1jea n THR 260 N -0.03 0.37 -0.08 2.46 -2.24 -1.26 -1.73 114.28 111.77 1jea n THR 260 Ca 0.07 -0.22 -0.05 0.00 -2.27 0.00 0.00 64.05 61.58 1jea n THR 260 Cb 0.10 -0.30 0.16 0.00 -2.10 0.00 0.00 70.33 68.20 1jea n THR 260 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1jea h ASN 261 N 0.00 0.71 0.25 3.42 -0.73 -1.88 0.15 115.58 117.51 1jea h ASN 261 Ca 0.00 -0.19 -0.34 0.00 1.87 0.00 0.00 56.30 57.64 1jea h ASN 261 Cb 0.69 -0.19 -0.04 0.00 0.27 0.00 0.00 38.32 39.06 1jea h ASN 261 CO 0.00 0.83 -1.93 0.18 -0.37 0.00 0.00 177.43 176.13 1jea n LEU 262 N -4.19 1.86 0.00 0.34 4.77 -1.18 -0.14 117.00 118.45 1jea n LEU 262 Ca 0.02 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1jea n LEU 262 Cb 0.34 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1jea n LEU 262 CO 0.42 0.66 0.21 -1.22 -1.33 0.00 0.00 177.39 176.13 1jea n TYR 263 N -3.27 0.00 -4.07 -1.77 4.01 -0.70 -4.84 117.16 106.52 1jea n TYR 263 Ca -0.27 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1jea n TYR 263 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1jea n TYR 263 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jea n GLY 264 N 0.07 2.78 0.30 2.72 0.00 0.53 -1.72 105.19 109.87 1jea n GLY 264 Ca 0.00 -0.34 0.15 0.00 0.00 0.00 0.00 46.02 45.83 1jea n GLY 264 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1jea h SER 265 N 8.15 0.00 -2.18 1.61 0.02 -1.32 -3.38 113.55 116.44 1jea h SER 265 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1jea h SER 265 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1jea h SER 265 CO 0.00 0.01 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 1jea n GLY 266 N -1.29 0.61 3.72 -3.77 0.00 -0.70 -4.10 105.19 99.66 1jea n GLY 266 Ca -0.03 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.43 1jea n GLY 266 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jea s LEU 267 N 0.00 4.39 0.45 0.99 2.96 0.14 -1.41 118.68 126.19 1jea s LEU 267 Ca 0.00 1.53 -0.24 0.00 -0.22 0.00 0.00 54.13 55.20 1jea s LEU 267 Cb 0.00 -3.40 -0.09 0.00 0.50 0.00 0.00 46.19 43.20 1jea s LEU 267 CO 0.00 -0.15 1.19 0.55 -1.32 0.00 0.00 176.35 176.62 1jea n VAL 268 N 3.52 2.74 -3.54 1.68 3.14 -0.87 -0.04 118.33 124.96 1jea n VAL 268 Ca 0.02 -0.50 -0.29 0.00 -2.96 0.00 0.00 64.34 60.61 1jea n VAL 268 Cb 0.51 -1.45 -0.14 0.00 -1.06 0.00 0.00 33.84 31.70 1jea n VAL 268 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 1jea s ASN 269 N -0.67 3.43 0.59 6.55 3.84 -1.26 -4.64 114.94 122.77 1jea s ASN 269 Ca 0.64 -1.65 0.37 0.00 0.21 0.00 0.00 52.86 52.43 1jea s ASN 269 Cb -0.50 -0.45 1.74 0.00 -0.55 0.00 0.00 41.25 41.49 1jea s ASN 269 CO 0.56 -0.39 2.12 0.00 -2.79 0.00 0.00 177.10 176.60 1jea h ALA 270 N 7.89 1.00 0.16 1.71 0.00 -1.58 0.73 119.26 129.17 1jea h ALA 270 Ca -0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1jea h ALA 270 Cb 0.99 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1jea h ALA 270 CO 0.39 0.00 -0.08 1.49 0.00 0.00 0.00 179.25 181.06 1jea h GLU 271 N 0.00 -0.21 -0.43 0.00 4.22 -1.71 -2.83 114.58 113.62 1jea h GLU 271 Ca -0.00 0.01 0.06 0.00 0.08 0.00 0.00 59.36 59.51 1jea h GLU 271 Cb 0.33 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1jea h GLU 271 CO 0.00 0.07 0.29 0.00 -2.18 0.00 0.00 179.01 177.19 1jea h ALA 272 N -0.73 1.98 0.00 2.92 0.00 -1.84 -2.79 119.26 118.81 1jea h ALA 272 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1jea h ALA 272 Cb 0.38 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jea h ALA 272 CO 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 179.25 179.18 1jea h ALA 273 N 1.77 0.98 -0.25 0.00 0.00 -0.90 -3.25 119.26 117.61 1jea h ALA 273 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1jea h ALA 273 Cb 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1jea h ALA 273 CO -0.04 0.05 0.00 0.25 0.00 0.00 0.00 179.25 179.51 1jea n THR 274 N -3.12 1.99 1.89 0.00 -2.24 -1.06 -4.82 114.28 106.92 1jea n THR 274 Ca 0.03 -1.72 0.16 0.00 -2.27 0.00 0.00 64.05 60.24 1jea n THR 274 Cb 0.48 -0.09 0.85 0.00 -2.10 0.00 0.00 70.33 69.47 1jea n THR 274 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36