#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3eob s VAL 2 N 0.00 3.20 -0.04 2.62 1.01 -1.26 -3.81 120.40 122.13 3eob s VAL 2 Ca 0.00 0.85 0.00 0.00 0.00 0.00 0.00 61.98 62.83 3eob s VAL 2 Cb 0.00 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.86 3eob s VAL 2 CO 0.00 0.06 -0.01 -1.10 0.00 0.00 0.00 175.10 174.05 3eob s GLN 3 N 1.22 0.41 -0.45 2.72 -1.52 0.27 -4.97 119.66 117.34 3eob s GLN 3 Ca 0.66 0.05 0.04 0.00 -1.95 0.00 0.00 55.36 54.16 3eob s GLN 3 Cb -0.38 -0.59 0.12 0.00 -0.22 0.00 0.00 33.01 31.95 3eob s GLN 3 CO 0.30 -0.14 0.20 -0.51 -0.25 0.00 0.00 175.29 174.88 3eob s LEU 4 N 1.11 4.14 0.11 2.90 1.43 -1.26 -0.01 118.68 127.10 3eob s LEU 4 Ca -0.08 -2.69 -0.16 0.00 -1.03 0.00 0.00 54.13 50.17 3eob s LEU 4 Cb -0.14 -1.53 -0.07 0.00 0.03 0.00 0.00 46.19 44.49 3eob s LEU 4 CO -0.02 -0.28 0.54 -0.69 0.23 0.00 0.00 176.35 176.14 3eob s VAL 5 N 0.17 4.83 0.23 -1.59 1.01 0.44 -3.94 120.40 121.55 3eob s VAL 5 Ca 0.15 0.96 0.11 0.00 0.00 0.00 0.00 61.98 63.20 3eob s VAL 5 Cb -0.24 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 3eob s VAL 5 CO -0.03 0.38 -0.19 -1.61 0.00 0.00 0.00 175.10 173.65 3eob s GLU 6 N -1.60 1.72 0.11 2.72 2.02 -1.26 0.57 118.70 122.97 3eob s GLU 6 Ca 0.34 -1.56 -0.26 0.00 0.02 0.00 0.00 54.97 53.50 3eob s GLU 6 Cb -0.17 -1.89 0.08 0.00 0.10 0.00 0.00 34.13 32.25 3eob s GLU 6 CO 0.19 0.38 0.97 -1.54 0.02 0.00 0.00 175.26 175.27 3eob s SER 7 N -3.06 -0.21 0.00 -0.19 1.04 -0.84 -4.98 113.70 105.46 3eob s SER 7 Ca 0.25 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.38 3eob s SER 7 Cb -0.07 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.49 3eob s SER 7 CO 0.13 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.16 3eob n GLY 8 N -0.42 1.21 3.92 7.32 0.00 -1.26 0.11 105.19 116.07 3eob n GLY 8 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 3eob n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3eob s GLY 9 N -2.16 1.68 0.00 -0.02 0.00 -1.26 -4.70 107.32 100.87 3eob s GLY 9 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.77 3eob s GLY 9 CO 0.00 -0.36 0.00 0.61 0.00 0.00 0.00 173.10 173.35 3eob n GLY 10 N -3.41 -0.50 3.61 0.20 0.00 -1.09 -4.96 105.19 99.04 3eob n GLY 10 Ca 0.11 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 3eob n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3eob s LEU 11 N 0.00 3.42 -0.00 0.99 1.98 -1.26 -0.16 118.68 123.64 3eob s LEU 11 Ca 0.00 0.03 -0.01 0.00 -2.89 0.00 0.00 54.13 51.26 3eob s LEU 11 Cb 0.00 -1.79 -0.00 0.00 0.66 0.00 0.00 46.19 45.05 3eob s LEU 11 CO 0.00 0.30 0.02 0.54 -1.89 0.00 0.00 176.35 175.32 3eob s VAL 12 N -0.43 0.03 0.40 1.68 0.11 -0.32 -4.96 120.40 116.90 3eob s VAL 12 Ca 0.07 -0.23 -0.24 0.00 -2.93 0.00 0.00 61.98 58.65 3eob s VAL 12 Cb -0.12 -0.11 -0.09 0.00 -1.53 0.00 0.00 36.38 34.53 3eob s VAL 12 CO 0.02 -0.13 1.07 -1.10 -3.33 0.00 0.00 175.10 171.64 3eob s GLN 13 N -0.37 4.16 0.48 1.54 -1.52 -1.26 -1.87 119.66 120.82 3eob s GLN 13 Ca -0.04 1.58 -0.24 0.00 -1.95 0.00 0.00 55.36 54.72 3eob s GLN 13 Cb -0.03 -2.59 -0.08 0.00 -0.22 0.00 0.00 33.01 30.10 3eob s GLN 13 CO -0.00 -0.17 1.32 -2.30 -0.25 0.00 0.00 175.29 173.89 3eob n PRO 14 N 0.00 1.86 -1.08 2.91 -0.02 -1.26 -0.92 135.00 136.49 3eob n PRO 14 Ca 0.05 0.67 -0.03 0.00 -2.02 0.00 0.00 63.50 62.17 3eob n PRO 14 Cb 0.49 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.46 3eob n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3eob n GLY 15 N 0.77 0.59 0.00 -1.23 0.00 -0.50 -4.93 105.19 99.89 3eob n GLY 15 Ca 0.08 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.65 3eob n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3eob n GLY 16 N -2.20 3.06 3.35 -0.02 0.00 -0.10 -4.48 105.19 104.81 3eob n GLY 16 Ca -0.03 -2.14 -0.20 0.00 0.00 0.00 0.00 46.02 43.65 3eob n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3eob s SER 17 N -0.87 1.77 -0.29 1.61 0.01 -1.26 -1.67 113.70 113.00 3eob s SER 17 Ca 0.00 -1.62 -0.21 0.00 1.31 0.00 0.00 55.95 55.43 3eob s SER 17 Cb 0.00 0.44 0.17 0.00 0.21 0.00 0.00 66.02 66.84 3eob s SER 17 CO 0.00 -0.93 1.20 -0.22 0.41 0.00 0.00 173.24 173.70 3eob s LEU 18 N -3.41 -0.25 -0.26 2.44 2.96 -1.11 -4.93 118.68 114.12 3eob s LEU 18 Ca 0.35 0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 54.67 3eob s LEU 18 Cb 0.04 1.42 0.03 0.00 0.50 0.00 0.00 46.19 48.18 3eob s LEU 18 CO 0.19 -0.07 -0.04 -0.60 -1.32 0.00 0.00 176.35 174.51 3eob s ARG 19 N 0.63 2.77 0.69 1.98 3.52 -1.26 -2.35 118.95 124.93 3eob s ARG 19 Ca -0.01 -1.03 -0.11 0.00 -0.13 0.00 0.00 55.73 54.45 3eob s ARG 19 Cb -0.04 -3.06 0.01 0.00 -1.56 0.00 0.00 34.95 30.31 3eob s ARG 19 CO -0.12 -0.45 1.07 -0.51 -0.81 0.00 0.00 175.30 174.48 3eob s LEU 20 N 1.32 2.95 0.03 -0.88 1.43 -0.51 -4.67 118.68 118.35 3eob s LEU 20 Ca -0.01 1.07 0.03 0.00 -1.03 0.00 0.00 54.13 54.19 3eob s LEU 20 Cb -0.17 -3.87 -0.02 0.00 0.03 0.00 0.00 46.19 42.16 3eob s LEU 20 CO -0.03 -1.30 -0.09 -0.44 0.23 0.00 0.00 176.35 174.72 3eob s SER 21 N -4.35 1.03 -0.32 2.29 0.01 0.12 -2.33 113.70 110.14 3eob s SER 21 Ca 0.57 -0.40 -0.01 0.00 1.31 0.00 0.00 55.95 57.43 3eob s SER 21 Cb -0.11 -0.04 0.11 0.00 0.21 0.00 0.00 66.02 66.19 3eob s SER 21 CO 0.51 -0.06 0.13 0.00 0.41 0.00 0.00 173.24 174.23 3eob s ALA 23 N 1.55 3.50 -0.03 0.00 0.00 0.19 -0.72 121.76 126.25 3eob s ALA 23 Ca 0.11 -0.67 -0.07 0.00 0.00 0.00 0.00 51.96 51.33 3eob s ALA 23 Cb -0.18 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 3eob s ALA 23 CO -0.23 -1.21 0.23 0.00 0.00 0.00 0.00 175.76 174.55 3eob s ALA 24 N 2.74 3.86 -0.01 0.00 0.00 -1.00 -0.42 121.76 126.93 3eob s ALA 24 Ca 0.27 -0.59 -0.02 0.00 0.00 0.00 0.00 51.96 51.61 3eob s ALA 24 Cb -0.14 -2.04 -0.00 0.00 0.00 0.00 0.00 23.12 20.93 3eob s ALA 24 CO 0.13 0.64 0.05 -1.12 0.00 0.00 0.00 175.76 175.46 3eob s SER 25 N -1.48 0.02 0.00 0.00 0.01 0.99 -4.89 113.70 108.34 3eob s SER 25 Ca 0.23 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.44 3eob s SER 25 Cb -0.13 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.22 3eob s SER 25 CO 0.13 -0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.26 3eob n GLY 26 N 2.54 0.59 3.55 3.44 0.00 -1.25 0.96 105.19 115.03 3eob n GLY 26 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 3eob n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3eob s TYR 27 N -2.00 0.61 -0.90 1.61 -0.85 -1.26 -4.38 117.35 110.17 3eob s TYR 27 Ca 0.00 -0.94 -0.25 0.00 -0.52 0.00 0.00 57.07 55.36 3eob s TYR 27 Cb 0.00 0.11 0.04 0.00 0.38 0.00 0.00 41.96 42.48 3eob s TYR 27 CO 0.00 -1.05 1.40 0.45 -1.52 0.00 0.00 175.55 174.82 3eob s SER 28 N -3.10 6.33 0.22 -0.18 0.15 -1.26 -4.89 113.70 110.97 3eob s SER 28 Ca 0.25 -1.02 0.04 0.00 0.70 0.00 0.00 55.95 55.93 3eob s SER 28 Cb -0.00 -2.57 0.61 0.00 -1.71 0.00 0.00 66.02 62.35 3eob s SER 28 CO 0.13 -1.67 1.05 0.33 1.20 0.00 0.00 173.24 174.28 3eob n PHE 29 N 9.22 0.52 1.62 3.44 -0.00 -1.26 -0.44 117.46 130.55 3eob n PHE 29 Ca 0.21 0.80 0.00 0.00 -0.00 0.00 0.00 57.45 58.47 3eob n PHE 29 Cb 0.50 -1.06 0.00 0.00 -0.00 0.00 0.00 39.48 38.92 3eob n PHE 29 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 3eob n THR 30 N -4.80 0.00 0.51 -2.13 -2.24 -1.26 -3.74 114.28 100.61 3eob n THR 30 Ca 0.18 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 62.01 3eob n THR 30 Cb 0.60 -0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.62 3eob n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3eob n GLY 31 N 0.33 -0.06 3.32 3.38 0.00 0.42 -4.22 105.19 108.35 3eob n GLY 31 Ca 0.00 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 3eob n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3eob s HIS 32 N -2.07 1.80 0.54 1.61 3.76 -1.25 -5.11 115.29 114.57 3eob s HIS 32 Ca 0.04 -0.46 -0.17 0.00 -0.15 0.00 0.00 55.06 54.32 3eob s HIS 32 Cb 0.08 -0.92 -0.06 0.00 1.11 0.00 0.00 32.58 32.79 3eob s HIS 32 CO 0.46 0.29 1.02 -1.58 -0.85 0.00 0.00 174.74 174.08 3eob s TRP 33 N -1.83 3.19 -0.05 1.40 0.52 -1.26 -4.41 118.94 116.51 3eob s TRP 33 Ca 0.13 1.51 0.04 0.00 0.02 0.00 0.00 56.10 57.80 3eob s TRP 33 Cb -0.07 -2.92 0.00 0.00 -1.15 0.00 0.00 33.47 29.33 3eob s TRP 33 CO 0.06 -0.73 -0.16 -1.64 0.02 0.00 0.00 176.95 174.50 3eob s MET 34 N -3.91 1.79 0.37 4.98 -1.94 -0.30 -2.16 119.30 118.13 3eob s MET 34 Ca 0.62 -0.57 0.08 0.00 -1.71 0.00 0.00 55.69 54.11 3eob s MET 34 Cb -0.13 -1.53 -0.06 0.00 2.01 0.00 0.00 34.83 35.12 3eob s MET 34 CO 0.31 0.19 0.03 -0.80 -0.01 0.00 0.00 175.02 174.75 3eob s ASN 35 N 0.17 4.12 -0.11 3.03 0.01 -0.62 -0.77 114.94 120.76 3eob s ASN 35 Ca -0.07 -1.09 0.00 0.00 -0.71 0.00 0.00 52.86 50.99 3eob s ASN 35 Cb -0.12 -0.48 0.02 0.00 0.41 0.00 0.00 41.25 41.08 3eob s ASN 35 CO 0.03 -0.33 -0.09 0.26 -1.51 0.00 0.00 177.10 175.46 3eob s TRP 36 N -2.58 1.61 -0.10 2.20 0.52 -0.70 -2.43 118.94 117.46 3eob s TRP 36 Ca 0.36 -0.80 0.01 0.00 0.02 0.00 0.00 56.10 55.69 3eob s TRP 36 Cb 0.03 -1.28 0.02 0.00 -1.15 0.00 0.00 33.47 31.09 3eob s TRP 36 CO 0.19 -0.51 -0.11 0.08 0.02 0.00 0.00 176.95 176.62 3eob s VAL 37 N 1.51 1.22 0.29 4.03 1.01 0.20 -1.35 120.40 127.31 3eob s VAL 37 Ca 0.02 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 61.61 3eob s VAL 37 Cb -0.13 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 3eob s VAL 37 CO -0.07 0.39 0.35 0.00 0.00 0.00 0.00 175.10 175.77 3eob s ARG 38 N 1.24 3.10 -0.21 2.72 1.70 -0.89 0.23 118.95 126.83 3eob s ARG 38 Ca -0.03 -1.00 -0.04 0.00 -0.47 0.00 0.00 55.73 54.19 3eob s ARG 38 Cb -0.14 -2.72 0.10 0.00 -0.57 0.00 0.00 34.95 31.61 3eob s ARG 38 CO -0.04 0.24 0.22 -1.14 -1.08 0.00 0.00 175.30 173.50 3eob s GLN 39 N -4.02 0.20 0.17 3.89 0.74 0.21 -1.83 119.66 119.01 3eob s GLN 39 Ca 0.39 0.12 -0.31 0.00 0.05 0.00 0.00 55.36 55.60 3eob s GLN 39 Cb -0.08 -1.19 -0.10 0.00 1.10 0.00 0.00 33.01 32.74 3eob s GLN 39 CO 0.28 -0.71 1.53 0.00 -0.55 0.00 0.00 175.29 175.84 3eob s ALA 40 N 2.31 3.74 -0.26 1.58 0.00 -1.26 -1.13 121.76 126.74 3eob s ALA 40 Ca 0.07 1.33 -0.23 0.00 0.00 0.00 0.00 51.96 53.13 3eob s ALA 40 Cb -0.16 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.26 3eob s ALA 40 CO -0.15 -0.75 0.99 -2.30 0.00 0.00 0.00 175.76 173.55 3eob n PRO 41 N 3.81 0.00 -2.75 0.00 -0.02 -1.26 0.54 135.00 135.31 3eob n PRO 41 Ca 0.13 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.40 3eob n PRO 41 Cb 0.39 -0.77 0.02 0.00 -0.02 0.00 0.00 33.50 33.12 3eob n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3eob n GLY 42 N 3.17 -0.45 0.00 -1.23 0.00 -1.26 -4.99 105.19 100.42 3eob n GLY 42 Ca 0.24 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.29 3eob n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3eob n LYS 43 N -3.50 0.82 -0.95 1.61 5.02 0.19 -5.15 118.16 116.19 3eob n LYS 43 Ca -0.16 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.83 3eob n LYS 43 Cb 0.64 0.00 0.26 0.00 -0.02 0.00 0.00 35.03 35.91 3eob n LYS 43 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3eob s GLY 44 N -0.98 1.56 0.15 0.72 0.00 -1.26 -4.70 107.32 102.81 3eob s GLY 44 Ca 0.00 -1.04 0.03 0.00 0.00 0.00 0.00 44.72 43.70 3eob s GLY 44 CO 0.00 -0.08 0.26 1.08 0.00 0.00 0.00 173.10 174.36 3eob s LEU 45 N -7.19 4.25 -0.02 0.66 1.43 -1.26 -3.98 118.68 112.57 3eob s LEU 45 Ca 0.72 0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.95 3eob s LEU 45 Cb -0.08 -2.83 0.01 0.00 0.03 0.00 0.00 46.19 43.32 3eob s LEU 45 CO 0.56 0.05 -0.05 -0.70 0.23 0.00 0.00 176.35 176.44 3eob s GLU 46 N -3.22 0.63 -0.09 1.70 2.12 -0.76 -5.03 118.70 114.05 3eob s GLU 46 Ca 0.34 -0.15 -0.17 0.00 0.36 0.00 0.00 54.97 55.35 3eob s GLU 46 Cb -0.11 -0.64 -0.05 0.00 0.26 0.00 0.00 34.13 33.60 3eob s GLU 46 CO 0.28 0.03 0.45 -0.46 -0.54 0.00 0.00 175.26 175.01 3eob s TRP 47 N 0.38 3.56 -0.22 5.30 -0.00 -1.26 -2.10 118.94 124.60 3eob s TRP 47 Ca -0.05 0.90 -0.18 0.00 -0.00 0.00 0.00 56.10 56.77 3eob s TRP 47 Cb -0.08 -2.48 -0.15 0.00 -0.00 0.00 0.00 33.47 30.76 3eob s TRP 47 CO -0.00 0.29 -0.04 0.28 -0.00 0.00 0.00 176.95 177.48 3eob n VAL 48 N 3.21 1.52 0.00 5.86 0.31 -0.46 -4.62 118.33 124.16 3eob n VAL 48 Ca -0.09 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 3eob n VAL 48 Cb 0.52 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.41 3eob n VAL 48 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3eob n GLY 49 N 1.39 -0.40 3.05 2.92 0.00 -1.23 -0.46 105.19 110.46 3eob n GLY 49 Ca -0.36 -1.18 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 3eob n GLY 49 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3eob s MET 50 N -2.00 0.50 0.07 1.61 0.23 0.12 -1.72 119.30 118.10 3eob s MET 50 Ca 0.00 -0.81 0.02 0.00 -1.03 0.00 0.00 55.69 53.87 3eob s MET 50 Cb 0.00 -0.10 -0.03 0.00 -1.53 0.00 0.00 34.83 33.16 3eob s MET 50 CO 0.00 -0.01 -0.07 -1.50 -2.03 0.00 0.00 175.02 171.41 3eob s ILE 51 N -1.88 0.61 -0.29 3.16 1.10 0.05 -0.84 121.20 123.11 3eob s ILE 51 Ca -0.08 -1.53 -0.02 0.00 -0.51 0.00 0.00 60.65 58.51 3eob s ILE 51 Cb -0.07 -1.17 0.04 0.00 0.15 0.00 0.00 42.46 41.41 3eob s ILE 51 CO -0.02 -0.65 -0.02 -2.28 -2.11 0.00 0.00 174.94 169.87 3eob s HIS 52 N -2.58 3.21 0.13 3.50 5.65 -0.25 -1.15 115.29 123.81 3eob s HIS 52 Ca 0.01 -1.80 -0.25 0.00 0.25 0.00 0.00 55.06 53.28 3eob s HIS 52 Cb -0.02 -2.09 -0.05 0.00 -1.18 0.00 0.00 32.58 29.24 3eob s HIS 52 CO -0.02 -0.78 1.25 -2.30 -0.65 0.00 0.00 174.74 172.23 3eob n PRO 53 N 4.63 -0.35 -0.32 2.88 -0.02 -1.26 0.10 135.00 140.67 3eob n PRO 53 Ca -0.14 1.23 0.31 0.00 -2.02 0.00 0.00 63.50 62.88 3eob n PRO 53 Cb 0.44 -1.81 0.56 0.00 -0.02 0.00 0.00 33.50 32.68 3eob n PRO 53 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3eob n SER 54 N -5.02 0.31 0.00 2.55 3.41 -1.26 -3.42 113.62 110.19 3eob n SER 54 Ca 0.02 1.52 0.00 0.00 -0.26 0.00 0.00 58.87 60.15 3eob n SER 54 Cb 0.22 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 3eob n SER 54 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3eob n ASP 55 N -5.04 0.00 -0.11 4.04 3.85 -0.82 -5.04 116.55 113.43 3eob n ASP 55 Ca 0.36 -0.77 -0.01 0.00 -0.71 0.00 0.00 54.79 53.65 3eob n ASP 55 Cb 1.24 0.00 -0.00 0.00 -1.35 0.00 0.00 41.12 41.01 3eob n ASP 55 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3eob n SER 56 N 0.00 -2.75 -4.76 -1.12 7.64 0.29 -4.99 113.62 107.93 3eob n SER 56 Ca 0.00 0.02 -0.41 0.00 1.01 0.00 0.00 58.87 59.49 3eob n SER 56 Cb 0.19 -0.77 -0.01 0.00 -1.01 0.00 0.00 64.21 62.61 3eob n SER 56 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3eob s GLU 57 N -2.54 4.16 0.07 1.43 2.12 -1.25 -4.63 118.70 118.06 3eob s GLU 57 Ca 0.00 2.50 0.04 0.00 0.36 0.00 0.00 54.97 57.87 3eob s GLU 57 Cb 0.00 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.34 3eob s GLU 57 CO 0.00 -0.53 -0.12 0.95 -0.54 0.00 0.00 175.26 175.02 3eob s THR 58 N -0.45 0.95 -0.09 -1.70 -4.23 -1.26 -1.10 115.64 107.76 3eob s THR 58 Ca 0.58 -1.37 -0.03 0.00 -1.18 0.00 0.00 61.69 59.69 3eob s THR 58 Cb -0.46 -1.07 0.05 0.00 1.34 0.00 0.00 72.50 72.36 3eob s THR 58 CO 0.52 -0.36 0.16 -0.60 -0.54 0.00 0.00 174.62 173.80 3eob s ARG 59 N -2.03 0.03 0.40 3.99 3.52 -0.02 -5.00 118.95 119.85 3eob s ARG 59 Ca -0.01 0.52 0.08 0.00 -0.13 0.00 0.00 55.73 56.18 3eob s ARG 59 Cb -0.08 -0.37 -0.03 0.00 -1.56 0.00 0.00 34.95 32.91 3eob s ARG 59 CO 0.01 -0.33 0.28 0.71 -0.81 0.00 0.00 175.30 175.16 3eob s TYR 60 N 2.29 2.68 0.01 5.12 1.51 -1.26 0.12 117.35 127.81 3eob s TYR 60 Ca 0.03 -0.51 -0.18 0.00 -1.01 0.00 0.00 57.07 55.40 3eob s TYR 60 Cb -0.12 -2.03 -0.06 0.00 -0.11 0.00 0.00 41.96 39.64 3eob s TYR 60 CO -0.06 0.04 0.53 1.21 -1.11 0.00 0.00 175.55 176.16 3eob s ASN 61 N -4.02 6.92 0.45 2.29 3.84 0.39 -4.92 114.94 119.90 3eob s ASN 61 Ca 0.44 1.10 0.11 0.00 0.21 0.00 0.00 52.86 54.73 3eob s ASN 61 Cb -0.01 -2.33 1.02 0.00 -0.55 0.00 0.00 41.25 39.39 3eob s ASN 61 CO 0.25 0.19 2.07 0.06 -2.79 0.00 0.00 177.10 176.89 3eob h GLN 62 N 5.23 0.24 -0.96 0.43 3.07 -1.94 -2.26 115.11 118.92 3eob h GLN 62 Ca -0.47 -0.02 0.22 0.00 0.09 0.00 0.00 58.65 58.47 3eob h GLN 62 Cb 1.21 -0.05 -0.08 0.00 0.08 0.00 0.00 27.48 28.64 3eob h GLN 62 CO 0.67 0.21 0.63 -0.22 0.09 0.00 0.00 178.83 180.20 3eob h LYS 63 N 0.24 0.40 -0.20 0.06 3.64 -1.94 -1.61 116.57 117.17 3eob h LYS 63 Ca 0.06 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3eob h LYS 63 Cb 0.06 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3eob h LYS 63 CO -0.01 0.27 0.00 1.19 -2.27 0.00 0.00 179.45 178.63 3eob n PHE 64 N -4.55 0.25 0.23 1.91 3.01 -0.86 -4.52 117.46 112.93 3eob n PHE 64 Ca 0.21 -0.15 0.12 0.00 1.01 0.00 0.00 57.45 58.64 3eob n PHE 64 Cb 0.76 -0.00 0.45 0.00 -0.01 0.00 0.00 39.48 40.67 3eob n PHE 64 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 3eob h LYS 65 N 3.75 0.00 0.04 -1.08 3.64 -1.15 0.17 116.57 121.94 3eob h LYS 65 Ca 0.00 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.11 3eob h LYS 65 Cb 0.84 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.69 3eob h LYS 65 CO 0.00 0.14 -1.10 -0.44 -2.27 0.00 0.00 179.45 175.78 3eob h ASP 66 N 0.00 0.88 0.00 4.20 3.45 -1.79 -3.40 116.42 119.76 3eob h ASP 66 Ca -0.00 -0.74 -0.20 0.00 0.43 0.00 0.00 57.03 56.52 3eob h ASP 66 Cb 0.77 -0.27 -0.04 0.00 -0.56 0.00 0.00 39.33 39.23 3eob h ASP 66 CO 0.02 1.54 -1.76 0.54 -1.57 0.00 0.00 179.24 178.01 3eob n ARG 67 N -3.83 1.68 -2.83 3.56 1.74 -1.22 -4.96 116.66 110.80 3eob n ARG 67 Ca -0.12 0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.57 3eob n ARG 67 Cb 0.91 -1.28 -0.04 0.00 -1.02 0.00 0.00 32.46 31.04 3eob n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3eob s PHE 68 N -2.27 3.43 -0.05 -1.55 0.40 0.04 -2.95 117.98 115.04 3eob s PHE 68 Ca -0.09 1.34 0.05 0.00 -0.60 0.00 0.00 56.93 57.63 3eob s PHE 68 Cb 0.04 -3.07 -0.02 0.00 0.51 0.00 0.00 43.02 40.48 3eob s PHE 68 CO 0.41 -0.26 -0.19 0.99 0.70 0.00 0.00 175.22 176.87 3eob s THR 69 N 2.20 2.61 0.03 0.64 2.01 0.16 -4.58 115.64 118.71 3eob s THR 69 Ca 0.41 -0.88 0.06 0.00 0.31 0.00 0.00 61.69 61.58 3eob s THR 69 Cb -0.17 -1.99 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 3eob s THR 69 CO 0.13 0.58 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.87 3eob s ILE 70 N -0.44 3.10 0.06 1.82 1.01 -1.26 0.24 121.20 125.72 3eob s ILE 70 Ca 0.05 -1.03 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 3eob s ILE 70 Cb -0.12 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 40.03 3eob s ILE 70 CO 0.02 0.36 0.09 -1.54 0.00 0.00 0.00 174.94 173.86 3eob n SER 71 N 1.56 -0.25 -3.84 3.58 3.41 -1.19 -4.98 113.62 111.90 3eob n SER 71 Ca -0.16 -1.29 -0.08 0.00 -0.26 0.00 0.00 58.87 57.09 3eob n SER 71 Cb 0.52 0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 64.89 3eob n SER 71 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3eob s VAL 72 N -2.57 0.00 -0.39 -3.33 0.11 -1.26 -2.67 120.40 110.28 3eob s VAL 72 Ca 0.04 -0.96 0.01 0.00 -2.93 0.00 0.00 61.98 58.14 3eob s VAL 72 Cb -0.00 -1.93 0.14 0.00 -1.53 0.00 0.00 36.38 33.06 3eob s VAL 72 CO 0.03 -0.01 0.22 -0.62 -3.33 0.00 0.00 175.10 171.39 3eob s ASP 73 N -2.92 3.32 0.43 3.54 2.15 -0.79 -4.99 116.67 117.41 3eob s ASP 73 Ca 0.12 -2.39 0.16 0.00 0.43 0.00 0.00 52.55 50.86 3eob s ASP 73 Cb -0.05 -0.72 1.05 0.00 -0.30 0.00 0.00 42.92 42.90 3eob s ASP 73 CO 0.05 -0.29 1.92 0.11 -0.17 0.00 0.00 175.17 176.79 3eob h LYS 74 N 6.90 0.41 -0.38 4.34 1.57 -1.90 -1.54 116.57 125.96 3eob h LYS 74 Ca 0.02 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 3eob h LYS 74 Cb 0.95 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 33.10 3eob h LYS 74 CO 0.37 0.27 -0.08 1.03 -0.57 0.00 0.00 179.45 180.47 3eob h SER 75 N 0.42 -0.32 0.08 0.86 0.87 -1.95 -2.67 113.55 110.83 3eob h SER 75 Ca 0.38 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.04 3eob h SER 75 Cb 0.86 0.22 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 3eob h SER 75 CO -0.12 -0.11 -0.21 0.29 -0.53 0.00 0.00 176.83 176.15 3eob n LYS 76 N -5.28 1.35 -2.87 2.24 5.02 -0.89 -4.95 118.16 112.79 3eob n LYS 76 Ca 0.02 -0.94 -0.22 0.00 -2.02 0.00 0.00 58.31 55.14 3eob n LYS 76 Cb 0.21 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 33.76 3eob n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3eob n ASN 77 N -0.00 -6.12 -4.43 4.39 4.13 -0.63 -4.83 115.26 107.76 3eob n ASN 77 Ca 0.13 -0.22 -0.33 0.00 1.68 0.00 0.00 54.58 55.84 3eob n ASN 77 Cb 0.42 -4.98 -0.14 0.00 -1.54 0.00 0.00 39.78 33.54 3eob n ASN 77 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3eob s THR 78 N -3.15 3.09 -0.15 3.41 2.01 -1.15 -2.38 115.64 117.31 3eob s THR 78 Ca 0.23 -0.68 -0.07 0.00 0.31 0.00 0.00 61.69 61.47 3eob s THR 78 Cb -0.10 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.12 3eob s THR 78 CO 0.29 0.56 0.11 -0.22 -0.69 0.00 0.00 174.62 174.66 3eob s LEU 79 N -0.25 4.12 0.28 4.42 2.96 0.10 -1.89 118.68 128.43 3eob s LEU 79 Ca 0.01 0.28 0.11 0.00 -0.22 0.00 0.00 54.13 54.32 3eob s LEU 79 Cb -0.13 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 3eob s LEU 79 CO 0.03 0.29 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.86 3eob s TYR 80 N -0.30 2.23 -0.15 5.38 1.51 -1.09 0.19 117.35 125.12 3eob s TYR 80 Ca 0.10 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 55.74 3eob s TYR 80 Cb -0.12 -1.01 0.06 0.00 -0.11 0.00 0.00 41.96 40.78 3eob s TYR 80 CO 0.01 0.66 0.13 -1.17 -1.11 0.00 0.00 175.55 174.07 3eob s LEU 81 N -3.50 0.16 -0.25 -1.29 2.96 -0.98 -3.19 118.68 112.59 3eob s LEU 81 Ca 0.29 -0.31 -0.17 0.00 -0.22 0.00 0.00 54.13 53.73 3eob s LEU 81 Cb -0.04 -0.02 -0.03 0.00 0.50 0.00 0.00 46.19 46.61 3eob s LEU 81 CO 0.14 -0.32 0.46 -1.58 -1.32 0.00 0.00 176.35 173.74 3eob s GLN 82 N 2.21 4.08 -0.14 1.98 2.00 0.14 -1.43 119.66 128.49 3eob s GLN 82 Ca 0.04 0.24 0.02 0.00 -2.00 0.00 0.00 55.36 53.65 3eob s GLN 82 Cb -0.15 -3.63 0.01 0.00 0.80 0.00 0.00 33.01 30.04 3eob s GLN 82 CO -0.08 -0.27 -0.20 -1.64 -0.50 0.00 0.00 175.29 172.59 3eob s MET 83 N 2.06 3.08 0.16 1.67 -1.94 -0.99 0.39 119.30 123.72 3eob s MET 83 Ca 0.19 -0.82 0.11 0.00 -1.71 0.00 0.00 55.69 53.46 3eob s MET 83 Cb -0.16 -2.49 -0.04 0.00 2.01 0.00 0.00 34.83 34.15 3eob s MET 83 CO 0.09 -0.01 -0.25 -0.80 -0.01 0.00 0.00 175.02 174.04 3eob s ASN 84 N 0.82 3.32 -1.39 3.03 0.01 -1.15 -2.75 114.94 116.82 3eob s ASN 84 Ca -0.06 -0.80 -0.01 0.00 -0.71 0.00 0.00 52.86 51.27 3eob s ASN 84 Cb -0.15 -0.23 0.01 0.00 0.41 0.00 0.00 41.25 41.28 3eob s ASN 84 CO -0.01 0.14 0.52 -1.20 -1.51 0.00 0.00 177.10 175.04 3eob n SER 85 N 0.61 -0.78 -4.74 -1.22 7.64 -0.67 -4.80 113.62 109.66 3eob n SER 85 Ca -0.15 -0.95 -0.36 0.00 1.01 0.00 0.00 58.87 58.42 3eob n SER 85 Cb 0.54 -3.35 0.05 0.00 -1.01 0.00 0.00 64.21 60.45 3eob n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3eob s LEU 86 N -6.90 3.59 0.32 -3.43 1.43 -1.13 -4.57 118.68 107.98 3eob s LEU 86 Ca 0.05 2.45 0.03 0.00 -1.03 0.00 0.00 54.13 55.63 3eob s LEU 86 Cb -0.03 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.55 3eob s LEU 86 CO 0.87 -1.81 0.12 0.00 0.23 0.00 0.00 176.35 175.75 3eob s ARG 87 N -3.44 1.64 0.35 1.70 1.70 -1.26 -1.40 118.95 118.24 3eob s ARG 87 Ca 0.79 -1.94 0.16 0.00 -0.47 0.00 0.00 55.73 54.27 3eob s ARG 87 Cb -0.32 -0.42 1.13 0.00 -0.57 0.00 0.00 34.95 34.76 3eob s ARG 87 CO 0.37 -0.36 1.65 0.00 -1.08 0.00 0.00 175.30 175.88 3eob h ALA 88 N 2.14 2.01 0.00 7.88 0.00 -1.97 0.22 119.26 129.53 3eob h ALA 88 Ca -0.37 0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 3eob h ALA 88 Cb 1.25 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 3eob h ALA 88 CO 0.59 -0.64 -0.46 1.05 0.00 0.00 0.00 179.25 179.78 3eob h GLU 89 N 0.28 0.00 0.00 0.00 4.11 -1.96 -3.04 114.58 113.97 3eob h GLU 89 Ca 0.75 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.18 3eob h GLU 89 Cb 1.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.02 3eob h GLU 89 CO -0.61 0.46 0.00 -0.25 0.07 0.00 0.00 179.01 178.68 3eob n ASP 90 N -3.70 0.00 -4.71 3.06 8.00 0.76 -4.66 116.55 115.29 3eob n ASP 90 Ca -0.01 -0.50 -0.42 0.00 0.71 0.00 0.00 54.79 54.58 3eob n ASP 90 Cb 0.53 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.60 3eob n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3eob s THR 91 N -2.00 4.24 -0.44 -3.53 2.01 -1.15 -4.87 115.64 109.89 3eob s THR 91 Ca 0.15 1.62 0.00 0.00 0.31 0.00 0.00 61.69 63.77 3eob s THR 91 Cb 0.07 -4.04 0.00 0.00 0.01 0.00 0.00 72.50 68.54 3eob s THR 91 CO 0.12 0.14 0.00 0.00 -0.69 0.00 0.00 174.62 174.18 3eob n ALA 92 N 3.81 0.00 -2.84 7.40 0.00 -0.82 -4.40 120.51 123.67 3eob n ALA 92 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.17 3eob n ALA 92 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.82 3eob n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3eob s VAL 93 N -2.36 4.60 -0.33 0.00 1.01 -0.29 -0.77 120.40 122.27 3eob s VAL 93 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 3eob s VAL 93 Cb 0.00 -3.05 0.02 0.00 0.00 0.00 0.00 36.38 33.35 3eob s VAL 93 CO 0.00 0.48 0.13 -0.31 0.00 0.00 0.00 175.10 175.40 3eob s TYR 94 N 0.27 3.21 0.19 5.22 1.51 -0.03 0.65 117.35 128.36 3eob s TYR 94 Ca 0.02 -1.08 0.04 0.00 -1.01 0.00 0.00 57.07 55.05 3eob s TYR 94 Cb -0.13 -2.32 -0.03 0.00 -0.11 0.00 0.00 41.96 39.37 3eob s TYR 94 CO 0.01 -0.63 0.29 0.71 -1.11 0.00 0.00 175.55 174.81 3eob s TYR 95 N 1.49 3.41 -0.05 2.71 1.51 0.14 -2.75 117.35 123.81 3eob s TYR 95 Ca 0.01 0.04 0.05 0.00 -1.01 0.00 0.00 57.07 56.17 3eob s TYR 95 Cb -0.18 -1.60 -0.01 0.00 -0.11 0.00 0.00 41.96 40.06 3eob s TYR 95 CO 0.04 0.49 -0.21 0.00 -1.11 0.00 0.00 175.55 174.76 3eob s ALA 97 N -0.02 0.22 0.64 0.00 0.00 -1.02 -1.48 121.76 120.11 3eob s ALA 97 Ca -0.05 0.05 -0.15 0.00 0.00 0.00 0.00 51.96 51.81 3eob s ALA 97 Cb -0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.81 3eob s ALA 97 CO 0.03 -0.02 1.11 0.50 0.00 0.00 0.00 175.76 177.38 3eob s ARG 98 N 0.49 2.89 0.02 0.00 3.52 -0.40 -1.60 118.95 123.88 3eob s ARG 98 Ca -0.05 1.39 -0.05 0.00 -0.13 0.00 0.00 55.73 56.89 3eob s ARG 98 Cb -0.07 -1.96 -0.01 0.00 -1.56 0.00 0.00 34.95 31.35 3eob s ARG 98 CO -0.01 -1.18 0.09 0.20 -0.81 0.00 0.00 175.30 173.59 3eob s GLY 99 N -2.55 0.14 -0.34 8.12 0.00 -0.92 -2.97 107.32 108.81 3eob s GLY 99 Ca 0.67 -0.42 -0.17 0.00 0.00 0.00 0.00 44.72 44.80 3eob s GLY 99 CO 0.40 -0.55 0.47 -0.42 0.00 0.00 0.00 173.10 173.00 3eob s ILE 100 N -2.04 5.06 -2.49 0.90 1.09 -0.36 -4.00 121.20 119.37 3eob s ILE 100 Ca -0.10 0.31 0.27 0.00 -1.10 0.00 0.00 60.65 60.03 3eob s ILE 100 Cb -0.05 -3.91 0.53 0.00 -1.06 0.00 0.00 42.46 37.97 3eob s ILE 100 CO -0.02 -0.15 1.70 0.00 -0.10 0.00 0.00 174.94 176.37 3eob n TYR 101 N 5.62 0.03 -0.06 3.97 9.36 -1.26 -2.96 117.16 131.86 3eob n TYR 101 Ca -0.06 -0.01 -0.11 0.00 3.32 0.00 0.00 57.90 61.04 3eob n TYR 101 Cb 0.49 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.16 3eob n TYR 101 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3eob h PHE 102 N 2.44 0.31 -3.19 2.98 0.04 -1.92 -3.44 116.94 114.15 3eob h PHE 102 Ca 0.00 -0.02 -0.66 0.00 2.80 0.00 0.00 57.97 60.09 3eob h PHE 102 Cb 0.52 -0.09 -0.15 0.00 2.20 0.00 0.00 35.95 38.43 3eob h PHE 102 CO 0.01 0.35 -0.58 0.71 -0.60 0.00 0.00 178.31 178.20 3eob s TYR 103 N -5.58 3.25 0.00 -0.55 1.51 -1.26 -4.95 117.35 109.77 3eob s TYR 103 Ca -0.14 0.17 0.00 0.00 -1.01 0.00 0.00 57.07 56.09 3eob s TYR 103 Cb 0.07 -1.91 0.00 0.00 -0.11 0.00 0.00 41.96 40.01 3eob s TYR 103 CO 0.71 0.38 0.00 0.41 -1.11 0.00 0.00 175.55 175.94 3eob n GLY 104 N 2.64 0.31 0.15 0.71 0.00 -1.26 -3.90 105.19 103.84 3eob n GLY 104 Ca -0.18 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3eob n GLY 104 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3eob n THR 105 N 0.00 0.00 -3.64 2.61 -2.24 -1.26 -5.13 114.28 104.62 3eob n THR 105 Ca 0.00 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 3eob n THR 105 Cb 0.00 -0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 67.71 3eob n THR 105 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3eob s THR 106 N -0.13 0.00 0.02 4.28 2.01 -1.25 -4.44 115.64 116.13 3eob s THR 106 Ca 0.00 0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.04 3eob s THR 106 Cb 0.00 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 3eob s THR 106 CO 0.00 0.00 -0.12 -0.72 -0.69 0.00 0.00 174.62 173.09 3eob s TYR 107 N 1.25 1.10 -0.11 4.92 -0.85 -1.16 -4.97 117.35 117.54 3eob s TYR 107 Ca -0.07 -0.28 -0.13 0.00 -0.52 0.00 0.00 57.07 56.07 3eob s TYR 107 Cb -0.05 -0.68 -0.05 0.00 0.38 0.00 0.00 41.96 41.57 3eob s TYR 107 CO -0.15 0.00 0.30 -0.06 -1.52 0.00 0.00 175.55 174.13 3eob s PHE 108 N -0.58 3.56 -0.02 -3.49 0.40 -1.26 -1.22 117.98 115.36 3eob s PHE 108 Ca 0.02 0.70 0.06 0.00 -0.60 0.00 0.00 56.93 57.12 3eob s PHE 108 Cb -0.06 -2.26 -0.09 0.00 0.51 0.00 0.00 43.02 41.11 3eob s PHE 108 CO 0.00 0.43 0.11 -0.40 0.70 0.00 0.00 175.22 176.07 3eob n ASP 109 N 2.82 3.57 -3.86 1.36 5.75 -1.16 -4.94 116.55 120.10 3eob n ASP 109 Ca -0.14 0.00 -0.30 0.00 -0.01 0.00 0.00 54.79 54.35 3eob n ASP 109 Cb 0.53 1.14 -0.16 0.00 -1.03 0.00 0.00 41.12 41.60 3eob n ASP 109 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 3eob s TYR 110 N -2.37 2.15 0.49 2.11 2.02 -1.25 -5.03 117.35 115.48 3eob s TYR 110 Ca -0.02 -1.74 0.07 0.00 -0.37 0.00 0.00 57.07 55.01 3eob s TYR 110 Cb 0.03 -1.67 0.04 0.00 -0.40 0.00 0.00 41.96 39.97 3eob s TYR 110 CO 0.25 -0.79 0.68 -1.58 -1.57 0.00 0.00 175.55 172.54 3eob s TRP 111 N 1.47 2.36 0.37 2.71 0.52 -1.26 -1.27 118.94 123.84 3eob s TRP 111 Ca 0.01 -0.44 0.07 0.00 0.02 0.00 0.00 56.10 55.76 3eob s TRP 111 Cb -0.18 -2.41 -0.01 0.00 -1.15 0.00 0.00 33.47 29.72 3eob s TRP 111 CO -0.11 -0.74 0.40 0.20 0.02 0.00 0.00 176.95 176.72 3eob s GLY 112 N -4.47 1.84 0.56 0.98 0.00 -0.55 -4.57 107.32 101.12 3eob s GLY 112 Ca 0.58 -1.66 0.33 0.00 0.00 0.00 0.00 44.72 43.97 3eob s GLY 112 CO 0.36 -1.54 2.10 0.06 0.00 0.00 0.00 173.10 174.08 3eob h GLN 113 N 1.01 0.00 0.00 2.90 -0.00 -1.90 -3.44 115.11 113.67 3eob h GLN 113 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 3eob h GLN 113 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.74 3eob h GLN 113 CO 0.54 0.06 0.00 0.41 -0.00 0.00 0.00 178.83 179.84 3eob n GLY 114 N -0.48 2.49 2.71 0.06 0.00 -1.26 -5.05 105.19 103.65 3eob n GLY 114 Ca -0.01 -1.85 -0.20 0.00 0.00 0.00 0.00 46.02 43.96 3eob n GLY 114 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3eob s THR 115 N -2.62 -0.02 -0.40 2.61 -1.32 -1.11 -4.89 115.64 107.90 3eob s THR 115 Ca 0.00 0.34 -0.26 0.00 -1.21 0.00 0.00 61.69 60.55 3eob s THR 115 Cb 0.00 -0.20 0.02 0.00 -1.51 0.00 0.00 72.50 70.81 3eob s THR 115 CO 0.00 0.18 0.96 -0.22 -2.21 0.00 0.00 174.62 173.33 3eob s LEU 116 N 1.92 3.95 -0.26 9.08 0.20 -1.26 -0.85 118.68 131.46 3eob s LEU 116 Ca 0.02 0.50 -0.09 0.00 0.69 0.00 0.00 54.13 55.26 3eob s LEU 116 Cb -0.12 -3.30 -0.04 0.00 -0.43 0.00 0.00 46.19 42.30 3eob s LEU 116 CO -0.03 -0.94 0.11 -0.69 -0.29 0.00 0.00 176.35 174.51 3eob s VAL 117 N 3.66 4.67 -0.20 1.68 1.01 0.05 -2.66 120.40 128.61 3eob s VAL 117 Ca 0.39 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 3eob s VAL 117 Cb -0.11 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 3eob s VAL 117 CO 0.22 0.31 -0.07 -0.89 0.00 0.00 0.00 175.10 174.66 3eob s THR 118 N 1.67 3.25 -0.49 3.92 2.01 0.77 -1.94 115.64 124.82 3eob s THR 118 Ca 0.07 -0.55 -0.09 0.00 0.31 0.00 0.00 61.69 61.43 3eob s THR 118 Cb -0.15 -2.45 0.13 0.00 0.01 0.00 0.00 72.50 70.03 3eob s THR 118 CO 0.06 0.45 0.37 -0.69 -0.69 0.00 0.00 174.62 174.12 3eob s VAL 119 N 1.22 4.24 0.09 3.82 1.01 -1.26 -1.18 120.40 128.34 3eob s VAL 119 Ca 0.03 -1.87 -0.15 0.00 0.00 0.00 0.00 61.98 59.98 3eob s VAL 119 Cb -0.14 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.48 3eob s VAL 119 CO -0.02 -0.79 0.36 -0.55 0.00 0.00 0.00 175.10 174.09 3eob s SER 120 N 2.57 -0.18 -0.11 3.32 0.15 -0.78 -4.41 113.70 114.26 3eob s SER 120 Ca 0.07 -0.26 0.09 0.00 0.70 0.00 0.00 55.95 56.54 3eob s SER 120 Cb -0.25 0.42 0.44 0.00 -1.71 0.00 0.00 66.02 64.92 3eob s SER 120 CO -0.01 -0.75 1.21 -1.54 1.20 0.00 0.00 173.24 173.35 3eob n SER 121 N 0.12 3.36 -4.58 5.45 3.41 -1.26 -4.04 113.62 116.09 3eob n SER 121 Ca -0.17 -2.42 -0.27 0.00 -0.26 0.00 0.00 58.87 55.75 3eob n SER 121 Cb 0.62 -0.54 0.12 0.00 -0.26 0.00 0.00 64.21 64.15 3eob n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3eob s ALA 122 N -1.88 2.87 0.05 7.33 0.00 -1.26 -5.08 121.76 123.79 3eob s ALA 122 Ca 0.30 -1.16 0.03 0.00 0.00 0.00 0.00 51.96 51.13 3eob s ALA 122 Cb 0.21 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 3eob s ALA 122 CO 0.11 -1.80 -0.01 -1.12 0.00 0.00 0.00 175.76 172.94 3eob s SER 123 N -4.71 5.00 0.45 0.00 0.01 -1.26 -4.99 113.70 108.20 3eob s SER 123 Ca 0.67 -0.12 -0.25 0.00 1.31 0.00 0.00 55.95 57.56 3eob s SER 123 Cb -0.07 -1.23 -0.08 0.00 0.21 0.00 0.00 66.02 64.86 3eob s SER 123 CO 0.48 0.22 1.34 0.42 0.41 0.00 0.00 173.24 176.11 3eob s THR 124 N -1.19 2.40 -0.00 1.44 -4.23 -1.26 -4.73 115.64 108.07 3eob s THR 124 Ca 0.22 0.34 0.00 0.00 -1.18 0.00 0.00 61.69 61.08 3eob s THR 124 Cb -0.12 -3.19 0.00 0.00 1.34 0.00 0.00 72.50 70.53 3eob s THR 124 CO 0.14 0.03 -0.01 -0.75 -0.54 0.00 0.00 174.62 173.50 3eob s LYS 125 N -2.48 0.11 0.22 3.99 2.36 0.12 -4.91 119.74 119.14 3eob s LYS 125 Ca 0.62 -0.02 -0.29 0.00 -2.55 0.00 0.00 55.97 53.72 3eob s LYS 125 Cb -0.39 -0.15 -0.09 0.00 -1.05 0.00 0.00 37.83 36.16 3eob s LYS 125 CO 0.49 -0.00 0.92 0.20 1.55 0.00 0.00 175.35 178.51 3eob s GLY 126 N 0.14 3.08 0.65 5.54 0.00 -1.26 -2.81 107.32 112.66 3eob s GLY 126 Ca -0.01 0.58 -0.11 0.00 0.00 0.00 0.00 44.72 45.18 3eob s GLY 126 CO -0.00 1.16 1.04 2.56 0.00 0.00 0.00 173.10 177.86 3eob s PRO 127 N -1.08 3.33 -0.07 2.90 0.04 -1.25 -4.59 135.00 134.30 3eob s PRO 127 Ca 0.41 0.80 0.05 0.00 0.04 0.00 0.00 61.00 62.30 3eob s PRO 127 Cb -0.25 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.24 3eob s PRO 127 CO 0.31 -0.78 -0.22 0.45 0.04 0.00 0.00 177.00 176.80 3eob s SER 128 N -4.06 2.80 -0.29 6.66 0.15 -0.70 -4.95 113.70 113.33 3eob s SER 128 Ca 0.56 -0.48 -0.08 0.00 0.70 0.00 0.00 55.95 56.65 3eob s SER 128 Cb -0.12 -0.95 -0.01 0.00 -1.71 0.00 0.00 66.02 63.23 3eob s SER 128 CO 0.54 0.19 0.11 -0.69 1.20 0.00 0.00 173.24 174.60 3eob s VAL 129 N 0.07 4.44 -0.18 4.45 1.01 -1.26 -0.78 120.40 128.16 3eob s VAL 129 Ca -0.09 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 3eob s VAL 129 Cb -0.15 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 3eob s VAL 129 CO 0.05 0.17 -0.03 -0.36 0.00 0.00 0.00 175.10 174.93 3eob s PHE 130 N 1.60 3.01 0.34 5.22 0.40 -0.71 -4.93 117.98 122.91 3eob s PHE 130 Ca 0.05 -0.45 -0.29 0.00 -0.60 0.00 0.00 56.93 55.64 3eob s PHE 130 Cb -0.16 -2.01 -0.10 0.00 0.51 0.00 0.00 43.02 41.25 3eob s PHE 130 CO 0.05 -0.18 1.37 -1.25 0.70 0.00 0.00 175.22 175.90 3eob s PRO 131 N 0.73 4.28 -0.93 0.24 0.04 -1.26 -1.03 135.00 137.07 3eob s PRO 131 Ca -0.01 2.33 -0.03 0.00 0.04 0.00 0.00 61.00 63.32 3eob s PRO 131 Cb -0.14 -3.04 0.23 0.00 0.04 0.00 0.00 34.50 31.58 3eob s PRO 131 CO 0.02 -0.30 0.83 -0.51 0.04 0.00 0.00 177.00 177.09 3eob s LEU 132 N -1.82 5.68 0.67 -3.56 1.43 0.48 -4.87 118.68 116.69 3eob s LEU 132 Ca 0.50 -3.70 -0.17 0.00 -1.03 0.00 0.00 54.13 49.74 3eob s LEU 132 Cb -0.42 -1.96 -0.00 0.00 0.03 0.00 0.00 46.19 43.84 3eob s LEU 132 CO 0.56 -0.20 1.19 0.00 0.23 0.00 0.00 176.35 178.12 3eob n ALA 133 N 2.40 0.67 -1.62 4.21 0.00 -1.26 -0.29 120.51 124.62 3eob n ALA 133 Ca 0.22 -0.07 -0.33 0.00 0.00 0.00 0.00 53.44 53.26 3eob n ALA 133 Cb 0.37 -2.26 0.02 0.00 0.00 0.00 0.00 19.45 17.59 3eob n ALA 133 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3eob s PRO 134 N -3.37 3.14 0.49 0.00 0.04 -1.26 -4.82 135.00 129.21 3eob s PRO 134 Ca 0.79 1.28 -0.19 0.00 0.04 0.00 0.00 61.00 62.93 3eob s PRO 134 Cb -0.37 -2.00 -0.13 0.00 0.04 0.00 0.00 34.50 32.03 3eob s PRO 134 CO 0.44 -0.97 0.15 0.45 0.04 0.00 0.00 177.00 177.11 3eob n SER 135 N -2.14 -2.56 -0.81 6.66 2.88 -1.26 -5.10 113.62 111.28 3eob n SER 135 Ca 0.09 0.74 0.01 0.00 -1.33 0.00 0.00 58.87 58.38 3eob n SER 135 Cb 0.52 -0.96 0.08 0.00 -0.75 0.00 0.00 64.21 63.10 3eob n SER 135 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3eob n SER 136 N 1.86 2.04 -2.36 -3.46 2.88 -1.26 -5.13 113.62 108.19 3eob n SER 136 Ca 0.10 -2.20 -0.31 0.00 -1.33 0.00 0.00 58.87 55.13 3eob n SER 136 Cb 0.45 -0.54 0.05 0.00 -0.75 0.00 0.00 64.21 63.42 3eob n SER 136 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3eob n GLY 142 N 0.13 5.27 2.97 0.46 0.00 -1.26 -5.31 105.19 107.45 3eob n GLY 142 Ca 0.06 -2.03 -0.22 0.00 0.00 0.00 0.00 46.02 43.83 3eob n GLY 142 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3eob s THR 143 N -4.06 0.83 0.17 2.61 2.01 -1.26 -2.83 115.64 113.10 3eob s THR 143 Ca 0.54 -0.32 0.08 0.00 0.31 0.00 0.00 61.69 62.30 3eob s THR 143 Cb 0.43 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 72.12 3eob s THR 143 CO -0.11 0.28 -0.17 0.00 -0.69 0.00 0.00 174.62 173.93 3eob s ALA 144 N 0.60 1.94 0.10 7.40 0.00 -0.54 -4.88 121.76 126.38 3eob s ALA 144 Ca -0.10 -1.50 0.06 0.00 0.00 0.00 0.00 51.96 50.42 3eob s ALA 144 Cb -0.13 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 3eob s ALA 144 CO 0.02 0.18 -0.15 0.00 0.00 0.00 0.00 175.76 175.80 3eob s ALA 145 N -2.25 1.46 -0.04 0.00 0.00 -1.26 0.27 121.76 119.94 3eob s ALA 145 Ca 0.16 -1.19 -0.04 0.00 0.00 0.00 0.00 51.96 50.89 3eob s ALA 145 Cb -0.05 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.96 3eob s ALA 145 CO 0.06 0.18 0.11 -0.48 0.00 0.00 0.00 175.76 175.63 3eob s LEU 146 N -2.11 1.58 0.00 0.00 0.05 -0.28 -4.31 118.68 113.61 3eob s LEU 146 Ca 0.05 0.15 0.05 0.00 0.05 0.00 0.00 54.13 54.43 3eob s LEU 146 Cb -0.08 0.43 -0.02 0.00 -2.05 0.00 0.00 46.19 44.47 3eob s LEU 146 CO 0.03 -0.09 0.18 0.61 -0.55 0.00 0.00 176.35 176.53 3eob n GLY 147 N 2.76 3.23 3.05 -3.48 0.00 0.61 -1.71 105.19 109.65 3eob n GLY 147 Ca -0.14 -1.95 -0.28 0.00 0.00 0.00 0.00 46.02 43.65 3eob n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eob s LEU 149 N 0.91 4.69 -0.76 0.00 2.96 -0.20 -1.02 118.68 125.27 3eob s LEU 149 Ca -0.09 -0.97 -0.19 0.00 -0.22 0.00 0.00 54.13 52.66 3eob s LEU 149 Cb -0.15 -2.02 0.12 0.00 0.50 0.00 0.00 46.19 44.63 3eob s LEU 149 CO -0.00 -0.38 0.94 -0.69 -1.32 0.00 0.00 176.35 174.90 3eob s VAL 150 N 1.56 4.74 0.36 1.68 1.01 -0.81 -1.73 120.40 127.21 3eob s VAL 150 Ca 0.02 -1.21 -0.02 0.00 0.00 0.00 0.00 61.98 60.76 3eob s VAL 150 Cb -0.19 -4.65 -0.04 0.00 0.00 0.00 0.00 36.38 31.50 3eob s VAL 150 CO 0.07 -1.35 0.60 -0.75 0.00 0.00 0.00 175.10 173.67 3eob s LYS 151 N 2.78 3.54 0.00 2.72 2.20 0.04 -2.97 119.74 128.06 3eob s LYS 151 Ca 0.23 -0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.72 3eob s LYS 151 Cb -0.13 -2.59 0.00 0.00 -1.51 0.00 0.00 37.83 33.59 3eob s LYS 151 CO -0.00 0.09 0.00 -0.25 -0.36 0.00 0.00 175.35 174.83 3eob n ASP 152 N -1.64 -3.12 -3.60 1.43 8.00 -1.00 -1.72 116.55 114.91 3eob n ASP 152 Ca -0.03 0.60 -0.13 0.00 0.71 0.00 0.00 54.79 55.95 3eob n ASP 152 Cb 0.55 -0.94 -0.06 0.00 -0.02 0.00 0.00 41.12 40.65 3eob n ASP 152 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3eob s TYR 153 N 0.00 -0.57 -0.09 1.24 -0.85 -1.06 -3.74 117.35 112.28 3eob s TYR 153 Ca 0.00 1.23 -0.16 0.00 -0.52 0.00 0.00 57.07 57.62 3eob s TYR 153 Cb 0.00 0.37 0.04 0.00 0.38 0.00 0.00 41.96 42.74 3eob s TYR 153 CO 0.00 -0.37 0.39 0.12 -1.52 0.00 0.00 175.55 174.17 3eob s PHE 154 N -0.33 -0.36 0.00 -3.49 5.36 -1.12 -1.13 117.98 116.90 3eob s PHE 154 Ca -0.02 0.75 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 3eob s PHE 154 Cb -0.03 0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.80 3eob s PHE 154 CO 0.01 -0.33 0.00 -0.35 -1.46 0.00 0.00 175.22 173.09 3eob n PRO 155 N 2.01 3.52 -3.26 10.12 -0.04 -1.26 0.10 135.00 146.18 3eob n PRO 155 Ca -0.17 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.09 3eob n PRO 155 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 3eob n PRO 155 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3eob s GLU 156 N 2.94 3.03 0.51 0.54 2.02 -1.26 -4.86 118.70 121.61 3eob s GLU 156 Ca 0.00 -0.94 0.02 0.00 0.02 0.00 0.00 54.97 54.07 3eob s GLU 156 Cb 0.00 -2.75 0.02 0.00 0.10 0.00 0.00 34.13 31.51 3eob s GLU 156 CO 0.00 -0.09 0.20 -0.35 0.02 0.00 0.00 175.26 175.04 3eob n PRO 157 N -1.79 0.75 -4.92 0.39 -0.04 -1.26 -4.89 135.00 123.23 3eob n PRO 157 Ca 0.02 -3.47 -0.28 0.00 -0.04 0.00 0.00 63.50 59.73 3eob n PRO 157 Cb 0.58 0.65 -0.16 0.00 -0.04 0.00 0.00 33.50 34.53 3eob n PRO 157 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3eob s VAL 158 N -2.71 1.59 -0.05 0.52 -7.23 -1.26 -4.13 120.40 107.12 3eob s VAL 158 Ca 0.16 -0.78 -0.00 0.00 -1.81 0.00 0.00 61.98 59.54 3eob s VAL 158 Cb -0.01 -1.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.52 3eob s VAL 158 CO 0.10 0.45 -0.00 0.42 -0.31 0.00 0.00 175.10 175.76 3eob s THR 159 N 0.21 4.22 -0.02 5.32 -4.23 -0.95 -4.99 115.64 115.20 3eob s THR 159 Ca -0.09 -0.40 -0.00 0.00 -1.18 0.00 0.00 61.69 60.01 3eob s THR 159 Cb -0.14 -2.82 0.03 0.00 1.34 0.00 0.00 72.50 70.91 3eob s THR 159 CO 0.04 0.51 0.03 -0.69 -0.54 0.00 0.00 174.62 173.97 3eob s VAL 160 N -0.97 -0.05 0.20 2.29 1.01 -1.26 -2.06 120.40 119.57 3eob s VAL 160 Ca 0.16 0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.39 3eob s VAL 160 Cb -0.11 -0.10 -0.05 0.00 0.00 0.00 0.00 36.38 36.12 3eob s VAL 160 CO 0.06 0.10 0.03 -0.94 0.00 0.00 0.00 175.10 174.35 3eob s SER 161 N 1.19 1.26 -0.06 3.32 1.04 -1.15 -4.94 113.70 114.35 3eob s SER 161 Ca -0.08 -1.24 0.06 0.00 0.48 0.00 0.00 55.95 55.17 3eob s SER 161 Cb -0.13 0.12 -0.01 0.00 0.10 0.00 0.00 66.02 66.10 3eob s SER 161 CO -0.03 -0.61 -0.24 0.26 0.98 0.00 0.00 173.24 173.60 3eob s TRP 162 N -3.66 2.47 -1.29 5.02 0.52 -1.26 0.18 118.94 120.91 3eob s TRP 162 Ca 0.29 -0.71 -0.05 0.00 0.02 0.00 0.00 56.10 55.64 3eob s TRP 162 Cb 0.06 -1.62 -0.00 0.00 -1.15 0.00 0.00 33.47 30.76 3eob s TRP 162 CO 0.07 -0.21 0.64 0.09 0.02 0.00 0.00 176.95 177.56 3eob n ASN 163 N 2.98 -1.97 -1.61 2.95 4.13 0.11 -0.97 115.26 120.87 3eob n ASN 163 Ca -0.18 -0.91 -0.20 0.00 1.68 0.00 0.00 54.58 54.97 3eob n ASN 163 Cb 0.52 -3.65 -0.08 0.00 -1.54 0.00 0.00 39.78 35.02 3eob n ASN 163 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3eob n SER 164 N -2.96 -5.29 0.00 6.41 7.64 -1.26 -1.25 113.62 116.90 3eob n SER 164 Ca -0.25 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.10 3eob n SER 164 Cb 0.66 -4.68 0.00 0.00 -1.01 0.00 0.00 64.21 59.18 3eob n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3eob n GLY 165 N -0.40 0.76 0.09 0.23 0.00 -0.15 -4.92 105.19 100.80 3eob n GLY 165 Ca -0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.94 3eob n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eob n ALA 166 N -0.40 2.12 -4.03 4.61 0.00 -0.38 -4.51 120.51 117.92 3eob n ALA 166 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 53.44 53.11 3eob n ALA 166 Cb 0.00 -1.44 -0.15 0.00 0.00 0.00 0.00 19.45 17.86 3eob n ALA 166 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3eob s LEU 167 N -4.16 4.49 -0.06 0.00 2.96 -1.19 -4.96 118.68 115.76 3eob s LEU 167 Ca 0.10 -2.01 0.08 0.00 -0.22 0.00 0.00 54.13 52.07 3eob s LEU 167 Cb 0.13 -1.61 -0.11 0.00 0.50 0.00 0.00 46.19 45.10 3eob s LEU 167 CO 0.52 -0.34 0.07 0.35 -1.32 0.00 0.00 176.35 175.62 3eob n THR 168 N 4.29 0.42 -2.26 3.68 -2.24 -1.26 -4.43 114.28 112.47 3eob n THR 168 Ca 0.01 -0.31 -0.39 0.00 -2.27 0.00 0.00 64.05 61.09 3eob n THR 168 Cb 0.42 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 68.10 3eob n THR 168 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3eob s SER 169 N -3.76 6.56 -1.72 3.42 0.01 -1.26 -3.20 113.70 113.75 3eob s SER 169 Ca -0.04 2.40 0.00 0.00 1.31 0.00 0.00 55.95 59.62 3eob s SER 169 Cb 0.03 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3eob s SER 169 CO 0.34 -0.65 0.00 0.61 0.41 0.00 0.00 173.24 173.95 3eob n GLY 170 N 0.69 1.60 3.58 3.44 0.00 -1.26 -4.78 105.19 108.45 3eob n GLY 170 Ca 0.04 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.44 3eob n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3eob s VAL 171 N -2.61 5.07 -0.19 1.61 1.01 -1.20 -1.48 120.40 122.62 3eob s VAL 171 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.07 3eob s VAL 171 Cb 0.00 -3.39 0.04 0.00 0.00 0.00 0.00 36.38 33.04 3eob s VAL 171 CO 0.00 0.31 -0.09 -1.00 0.00 0.00 0.00 175.10 174.32 3eob s HIS 172 N 1.44 2.20 -0.38 5.22 3.76 -0.04 -5.02 115.29 122.47 3eob s HIS 172 Ca 0.07 -1.42 -0.05 0.00 -0.15 0.00 0.00 55.06 53.50 3eob s HIS 172 Cb -0.15 -1.54 0.08 0.00 1.11 0.00 0.00 32.58 32.07 3eob s HIS 172 CO 0.07 -0.70 0.16 0.99 -0.85 0.00 0.00 174.74 174.41 3eob s THR 173 N 1.47 3.60 0.48 1.30 2.01 -1.26 -0.69 115.64 122.54 3eob s THR 173 Ca -0.00 -1.55 -0.21 0.00 0.31 0.00 0.00 61.69 60.24 3eob s THR 173 Cb -0.16 -3.22 -0.08 0.00 0.01 0.00 0.00 72.50 69.05 3eob s THR 173 CO -0.08 -0.42 1.09 -0.36 -0.69 0.00 0.00 174.62 174.16 3eob s PHE 174 N 1.30 2.93 0.42 4.92 0.40 -0.89 -4.98 117.98 122.09 3eob s PHE 174 Ca 0.02 1.57 -0.24 0.00 -0.60 0.00 0.00 56.93 57.68 3eob s PHE 174 Cb -0.22 -3.21 -0.11 0.00 0.51 0.00 0.00 43.02 40.00 3eob s PHE 174 CO -0.00 -1.14 0.94 -2.30 0.70 0.00 0.00 175.22 173.42 3eob n PRO 175 N -0.77 1.21 -2.05 0.24 -0.02 -1.26 -4.28 135.00 128.07 3eob n PRO 175 Ca 0.09 0.43 -0.42 0.00 -2.02 0.00 0.00 63.50 61.58 3eob n PRO 175 Cb 0.51 -1.95 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 3eob n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3eob s ALA 176 N -1.30 3.68 -0.19 3.55 0.00 -1.26 -4.72 121.76 121.52 3eob s ALA 176 Ca 0.64 1.21 -0.08 0.00 0.00 0.00 0.00 51.96 53.73 3eob s ALA 176 Cb -0.57 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 18.92 3eob s ALA 176 CO 0.57 -0.77 0.07 0.54 0.00 0.00 0.00 175.76 176.16 3eob s VAL 177 N 1.43 4.78 -0.27 0.00 0.11 0.19 -4.88 120.40 121.76 3eob s VAL 177 Ca 0.68 -0.04 -0.28 0.00 -2.93 0.00 0.00 61.98 59.41 3eob s VAL 177 Cb -0.40 -3.16 0.01 0.00 -1.53 0.00 0.00 36.38 31.30 3eob s VAL 177 CO 0.31 0.45 1.01 -0.22 -3.33 0.00 0.00 175.10 173.31 3eob s LEU 178 N 0.47 4.04 0.14 2.54 2.96 -1.26 -1.68 118.68 125.89 3eob s LEU 178 Ca 0.03 1.17 0.03 0.00 -0.22 0.00 0.00 54.13 55.14 3eob s LEU 178 Cb -0.13 -3.46 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 3eob s LEU 178 CO 0.01 -0.72 0.25 0.00 -1.32 0.00 0.00 176.35 174.56 3eob s GLN 179 N 3.29 3.34 0.55 1.98 -2.07 -0.76 -5.00 119.66 121.00 3eob s GLN 179 Ca 0.42 -0.63 0.40 0.00 -1.82 0.00 0.00 55.36 53.73 3eob s GLN 179 Cb -0.14 -2.91 1.57 0.00 -1.09 0.00 0.00 33.01 30.44 3eob s GLN 179 CO 0.10 0.52 1.72 0.66 -1.32 0.00 0.00 175.29 176.97 3eob h SER 180 N 2.29 0.00 -0.42 12.60 4.64 -1.96 0.44 113.55 131.13 3eob h SER 180 Ca -0.48 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.86 3eob h SER 180 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 3eob h SER 180 CO 0.68 0.00 0.28 0.77 -0.87 0.00 0.00 176.83 177.69 3eob h SER 181 N 0.00 0.42 0.00 4.97 4.64 -2.02 -3.45 113.55 118.11 3eob h SER 181 Ca 0.64 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.96 3eob h SER 181 Cb 2.65 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 64.64 3eob h SER 181 CO -0.01 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 3eob n GLY 182 N -1.49 0.82 3.97 -0.77 0.00 0.15 -5.11 105.19 102.76 3eob n GLY 182 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 3eob n GLY 182 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3eob s LEU 183 N 0.00 3.58 0.35 0.99 1.43 -1.24 -4.88 118.68 118.90 3eob s LEU 183 Ca 0.00 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 52.65 3eob s LEU 183 Cb 0.00 -2.47 -0.02 0.00 0.03 0.00 0.00 46.19 43.73 3eob s LEU 183 CO 0.00 -0.72 0.33 -0.31 0.23 0.00 0.00 176.35 175.88 3eob s TYR 184 N -2.39 2.90 -0.17 0.29 1.51 -0.29 -1.83 117.35 117.39 3eob s TYR 184 Ca 0.53 -0.32 -0.28 0.00 -1.01 0.00 0.00 57.07 55.99 3eob s TYR 184 Cb -0.08 -1.88 0.09 0.00 -0.11 0.00 0.00 41.96 39.98 3eob s TYR 184 CO 0.31 0.11 0.79 0.45 -1.11 0.00 0.00 175.55 176.11 3eob s SER 185 N -4.04 -0.61 0.31 2.29 0.15 -0.67 -2.38 113.70 108.74 3eob s SER 185 Ca 0.43 0.91 -0.19 0.00 0.70 0.00 0.00 55.95 57.80 3eob s SER 185 Cb -0.06 0.83 0.03 0.00 -1.71 0.00 0.00 66.02 65.11 3eob s SER 185 CO 0.27 -0.39 0.72 -1.48 1.20 0.00 0.00 173.24 173.56 3eob s LEU 186 N -0.49 -0.12 0.42 3.45 0.05 -1.16 0.53 118.68 121.36 3eob s LEU 186 Ca -0.04 -0.80 0.03 0.00 0.05 0.00 0.00 54.13 53.37 3eob s LEU 186 Cb -0.02 2.68 -0.03 0.00 -2.05 0.00 0.00 46.19 46.77 3eob s LEU 186 CO 0.04 -1.44 0.07 -0.94 -0.55 0.00 0.00 176.35 173.53 3eob s SER 187 N -2.98 3.17 -0.28 1.48 1.04 -1.26 -1.92 113.70 112.96 3eob s SER 187 Ca 0.13 -1.58 0.01 0.00 0.48 0.00 0.00 55.95 54.99 3eob s SER 187 Cb -0.05 0.30 0.16 0.00 0.10 0.00 0.00 66.02 66.53 3eob s SER 187 CO 0.09 -0.80 0.43 -0.55 0.98 0.00 0.00 173.24 173.39 3eob s SER 188 N -3.67 0.03 0.29 7.02 0.15 -0.19 -2.08 113.70 115.26 3eob s SER 188 Ca 0.23 -0.04 0.09 0.00 0.70 0.00 0.00 55.95 56.93 3eob s SER 188 Cb 0.04 1.27 -0.04 0.00 -1.71 0.00 0.00 66.02 65.58 3eob s SER 188 CO 0.12 -0.32 0.08 0.68 1.20 0.00 0.00 173.24 175.00 3eob s VAL 189 N 2.59 3.45 -0.06 4.45 -7.23 0.13 -0.84 120.40 122.90 3eob s VAL 189 Ca 0.12 -1.75 -0.08 0.00 -1.81 0.00 0.00 61.98 58.45 3eob s VAL 189 Cb -0.13 -2.98 0.02 0.00 0.56 0.00 0.00 36.38 33.84 3eob s VAL 189 CO -0.25 -0.30 0.21 0.54 -0.31 0.00 0.00 175.10 174.99 3eob s VAL 190 N -2.33 0.02 -0.26 1.32 0.11 -0.69 -0.86 120.40 117.71 3eob s VAL 190 Ca 0.34 -0.19 -0.08 0.00 -2.93 0.00 0.00 61.98 59.11 3eob s VAL 190 Cb -0.05 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.40 3eob s VAL 190 CO 0.22 -0.11 0.10 0.42 -3.33 0.00 0.00 175.10 172.40 3eob s THR 191 N -0.34 4.55 0.35 5.04 -4.23 -0.55 -1.13 115.64 119.33 3eob s THR 191 Ca -0.04 -0.09 0.07 0.00 -1.18 0.00 0.00 61.69 60.44 3eob s THR 191 Cb -0.03 -3.14 -0.07 0.00 1.34 0.00 0.00 72.50 70.60 3eob s THR 191 CO 0.01 0.32 -0.01 0.68 -0.54 0.00 0.00 174.62 175.08 3eob s VAL 192 N 1.63 1.81 0.74 2.29 -7.23 0.14 -4.75 120.40 115.03 3eob s VAL 192 Ca 0.06 -2.06 -0.15 0.00 -1.81 0.00 0.00 61.98 58.02 3eob s VAL 192 Cb -0.15 -2.78 0.02 0.00 0.56 0.00 0.00 36.38 34.02 3eob s VAL 192 CO 0.05 -0.10 0.99 -2.65 -0.31 0.00 0.00 175.10 173.08 3eob n PRO 193 N -0.80 0.44 0.00 4.82 -0.02 -1.26 -1.47 135.00 136.70 3eob n PRO 193 Ca -0.04 0.21 0.14 0.00 -2.02 0.00 0.00 63.50 61.78 3eob n PRO 193 Cb 0.66 -2.25 0.61 0.00 -0.02 0.00 0.00 33.50 32.50 3eob n PRO 193 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3eob n SER 194 N -1.91 0.04 -0.02 2.55 3.41 -1.13 -3.76 113.62 112.79 3eob n SER 194 Ca 0.13 0.50 -0.17 0.00 -0.26 0.00 0.00 58.87 59.07 3eob n SER 194 Cb 0.50 -0.51 -0.14 0.00 -0.26 0.00 0.00 64.21 63.80 3eob n SER 194 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3eob n SER 195 N -1.53 1.64 0.30 4.04 3.41 -1.26 -4.23 113.62 115.99 3eob n SER 195 Ca 0.07 0.22 0.20 0.00 -0.26 0.00 0.00 58.87 59.10 3eob n SER 195 Cb 0.34 -0.49 0.93 0.00 -0.26 0.00 0.00 64.21 64.73 3eob n SER 195 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3eob h SER 196 N 0.04 0.00 -3.95 4.04 4.64 -1.95 -3.44 113.55 112.92 3eob h SER 196 Ca -0.41 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.36 3eob h SER 196 Cb 2.03 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 64.30 3eob h SER 196 CO 0.07 0.01 0.23 0.18 -0.87 0.00 0.00 176.83 176.44 3eob n LEU 197 N -3.11 4.11 0.00 5.97 4.77 -1.26 0.22 117.00 127.69 3eob n LEU 197 Ca -0.01 0.66 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 3eob n LEU 197 Cb 0.20 -1.46 0.00 0.00 -2.33 0.00 0.00 43.42 39.83 3eob n LEU 197 CO 0.24 -1.80 0.00 0.61 -1.33 0.00 0.00 177.39 175.11 3eob n GLY 198 N 0.90 1.38 0.12 -0.72 0.00 -1.26 -4.43 105.19 101.17 3eob n GLY 198 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 3eob n GLY 198 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3eob n THR 199 N 0.00 1.45 -3.50 2.61 5.66 -1.03 -4.93 114.28 114.54 3eob n THR 199 Ca 0.00 -0.70 -0.37 0.00 -3.05 0.00 0.00 64.05 59.92 3eob n THR 199 Cb 0.00 -0.99 -0.06 0.00 -1.55 0.00 0.00 70.33 67.73 3eob n THR 199 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3eob s GLN 200 N -2.51 4.07 -0.08 1.09 -1.52 0.13 -5.07 119.66 115.78 3eob s GLN 200 Ca -0.24 0.29 -0.20 0.00 -1.95 0.00 0.00 55.36 53.26 3eob s GLN 200 Cb 0.08 -3.32 -0.04 0.00 -0.22 0.00 0.00 33.01 29.50 3eob s GLN 200 CO 0.71 0.45 0.58 0.99 -0.25 0.00 0.00 175.29 177.76 3eob s THR 201 N -0.25 5.10 -0.20 -0.19 2.01 -1.26 -4.77 115.64 116.07 3eob s THR 201 Ca 0.21 1.18 0.01 0.00 0.31 0.00 0.00 61.69 63.41 3eob s THR 201 Cb -0.15 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.48 3eob s THR 201 CO 0.09 0.31 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.87 3eob s TYR 202 N 0.56 2.75 -0.03 4.92 1.51 -1.26 -4.98 117.35 120.83 3eob s TYR 202 Ca 0.31 -1.74 0.03 0.00 -1.01 0.00 0.00 57.07 54.66 3eob s TYR 202 Cb -0.17 -1.83 0.00 0.00 -0.11 0.00 0.00 41.96 39.86 3eob s TYR 202 CO 0.14 -0.80 -0.11 0.42 -1.11 0.00 0.00 175.55 174.10 3eob s ILE 203 N 1.29 0.94 0.35 2.71 1.01 -1.26 0.99 121.20 127.22 3eob s ILE 203 Ca 0.01 -0.45 0.07 0.00 0.00 0.00 0.00 60.65 60.28 3eob s ILE 203 Cb -0.15 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 3eob s ILE 203 CO -0.10 0.28 0.46 0.00 0.00 0.00 0.00 174.94 175.59 3eob s ASN 205 N -4.18 3.87 -0.49 0.00 0.01 0.13 -2.00 114.94 112.28 3eob s ASN 205 Ca 0.46 -1.27 -0.16 0.00 -0.71 0.00 0.00 52.86 51.18 3eob s ASN 205 Cb -0.09 -1.14 0.08 0.00 0.41 0.00 0.00 41.25 40.51 3eob s ASN 205 CO 0.31 -0.27 0.44 -0.69 -1.51 0.00 0.00 177.10 175.38 3eob s VAL 206 N 1.41 5.18 -0.27 1.60 1.01 0.83 -2.95 120.40 127.22 3eob s VAL 206 Ca -0.03 -1.04 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 3eob s VAL 206 Cb -0.19 -4.18 0.03 0.00 0.00 0.00 0.00 36.38 32.04 3eob s VAL 206 CO -0.08 -0.65 -0.01 0.21 0.00 0.00 0.00 175.10 174.56 3eob s ASN 207 N 2.74 4.62 -0.39 3.32 2.47 -0.87 -1.05 114.94 125.78 3eob s ASN 207 Ca 0.05 -0.90 -0.11 0.00 0.42 0.00 0.00 52.86 52.32 3eob s ASN 207 Cb -0.24 -1.73 0.04 0.00 -1.45 0.00 0.00 41.25 37.87 3eob s ASN 207 CO 0.07 -0.17 0.23 -2.28 -3.72 0.00 0.00 177.10 171.23 3eob s HIS 208 N 1.36 3.26 0.00 0.43 5.65 -0.78 -2.24 115.29 122.98 3eob s HIS 208 Ca -0.00 -1.08 -0.25 0.00 0.25 0.00 0.00 55.06 53.98 3eob s HIS 208 Cb -0.17 -2.57 -0.19 0.00 -1.18 0.00 0.00 32.58 28.47 3eob s HIS 208 CO -0.02 -0.70 1.37 0.87 -0.65 0.00 0.00 174.74 175.61 3eob h LYS 209 N 8.45 -0.03 -0.47 2.88 1.57 -1.88 -0.28 116.57 126.81 3eob h LYS 209 Ca -0.25 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.63 3eob h LYS 209 Cb 1.10 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 33.32 3eob h LYS 209 CO 0.70 0.34 -0.14 -1.35 -0.57 0.00 0.00 179.45 178.43 3eob h PRO 210 N -0.40 -0.03 -0.80 3.15 0.11 -1.90 -0.71 132.00 131.43 3eob h PRO 210 Ca -0.00 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.98 3eob h PRO 210 Cb 0.38 0.01 -0.08 0.00 0.11 0.00 0.00 31.00 31.42 3eob h PRO 210 CO 0.00 -0.02 0.17 0.45 -0.21 0.00 0.00 178.00 178.39 3eob n SER 211 N -5.36 4.19 -3.73 -2.05 2.88 -1.24 -4.94 113.62 103.37 3eob n SER 211 Ca 0.04 -2.86 -0.21 0.00 -1.33 0.00 0.00 58.87 54.50 3eob n SER 211 Cb 0.27 -0.68 -0.01 0.00 -0.75 0.00 0.00 64.21 63.03 3eob n SER 211 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3eob n ASN 212 N 0.06 -1.07 -4.09 -3.46 3.02 -0.27 -4.80 115.26 104.64 3eob n ASN 212 Ca 0.29 -0.68 -0.34 0.00 -0.03 0.00 0.00 54.58 53.81 3eob n ASN 212 Cb 1.10 -0.83 -0.13 0.00 -0.61 0.00 0.00 39.78 39.31 3eob n ASN 212 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3eob s THR 213 N -4.03 2.93 -0.66 3.41 2.01 -0.17 -4.99 115.64 114.14 3eob s THR 213 Ca 0.16 -2.06 -0.17 0.00 0.31 0.00 0.00 61.69 59.93 3eob s THR 213 Cb -0.09 -3.01 0.15 0.00 0.01 0.00 0.00 72.50 69.56 3eob s THR 213 CO 0.52 -0.59 0.68 -0.54 -0.69 0.00 0.00 174.62 174.00 3eob s LYS 214 N 1.08 3.21 -0.14 4.92 1.02 -1.26 -1.86 119.74 126.71 3eob s LYS 214 Ca 0.07 -1.80 -0.04 0.00 0.02 0.00 0.00 55.97 54.23 3eob s LYS 214 Cb -0.21 -4.37 -0.03 0.00 -0.52 0.00 0.00 37.83 32.70 3eob s LYS 214 CO -0.05 -1.42 -0.02 0.08 -0.92 0.00 0.00 175.35 173.02 3eob s VAL 215 N 1.63 4.07 -0.17 3.17 1.01 -0.22 -4.98 120.40 124.91 3eob s VAL 215 Ca 0.12 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 3eob s VAL 215 Cb -0.21 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 3eob s VAL 215 CO -0.00 0.52 0.01 -1.81 0.00 0.00 0.00 175.10 173.81 3eob s ASP 216 N 0.06 5.13 -0.17 3.32 1.01 -1.26 -0.12 116.67 124.64 3eob s ASP 216 Ca 0.01 -0.06 -0.00 0.00 0.71 0.00 0.00 52.55 53.21 3eob s ASP 216 Cb -0.13 -1.86 0.04 0.00 1.01 0.00 0.00 42.92 41.98 3eob s ASP 216 CO 0.02 0.16 -0.06 -0.75 0.21 0.00 0.00 175.17 174.75 3eob s LYS 217 N 0.44 1.52 -0.20 8.23 2.47 -0.85 -4.99 119.74 126.37 3eob s LYS 217 Ca -0.01 -0.58 -0.19 0.00 -1.56 0.00 0.00 55.97 53.64 3eob s LYS 217 Cb -0.14 -2.08 -0.03 0.00 -1.46 0.00 0.00 37.83 34.12 3eob s LYS 217 CO 0.02 -0.44 0.53 0.21 0.16 0.00 0.00 175.35 175.83 3eob s LYS 218 N 1.60 4.20 -0.14 4.03 2.20 -1.26 -0.26 119.74 130.10 3eob s LYS 218 Ca 0.00 0.43 -0.24 0.00 -0.36 0.00 0.00 55.97 55.80 3eob s LYS 218 Cb -0.15 -3.56 -0.02 0.00 -1.51 0.00 0.00 37.83 32.59 3eob s LYS 218 CO -0.08 -0.14 0.78 0.08 -0.36 0.00 0.00 175.35 175.63 3eob s VAL 219 N 1.62 4.94 0.00 4.02 1.01 0.28 -4.95 120.40 127.31 3eob s VAL 219 Ca 0.24 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3eob s VAL 219 Cb -0.15 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.13 3eob s VAL 219 CO 0.10 0.09 0.00 -0.62 0.00 0.00 0.00 175.10 174.67