#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tbr s VAL 17 N 0.00 5.47 -1.43 1.39 1.01 -0.14 -3.88 120.40 122.81 1tbr s VAL 17 Ca 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.03 1tbr s VAL 17 Cb 0.00 -3.45 0.05 0.00 0.00 0.00 0.00 36.38 32.98 1tbr s VAL 17 CO 0.00 0.54 0.99 -0.62 0.00 0.00 0.00 175.10 176.02 1tbr n GLU 18 N 1.71 -6.13 -2.64 2.72 -0.58 -1.26 -2.47 120.64 111.98 1tbr n GLU 18 Ca -0.17 0.68 -0.13 0.00 -0.42 0.00 0.00 57.16 57.11 1tbr n GLU 18 Cb 0.54 -5.56 0.01 0.00 -0.57 0.00 0.00 31.44 25.85 1tbr n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tbr n GLY 19 N -1.73 2.76 3.15 0.62 0.00 -1.26 -4.61 105.19 104.12 1tbr n GLY 19 Ca -0.04 -2.23 -0.14 0.00 0.00 0.00 0.00 46.02 43.61 1tbr n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1tbr s GLN 20 N -3.22 0.78 0.28 1.61 -2.07 -0.31 -4.91 119.66 111.82 1tbr s GLN 20 Ca 0.19 -1.09 -0.30 0.00 -1.82 0.00 0.00 55.36 52.34 1tbr s GLN 20 Cb -0.01 -0.44 -0.11 0.00 -1.09 0.00 0.00 33.01 31.35 1tbr s GLN 20 CO 0.12 0.06 1.57 -0.51 -1.32 0.00 0.00 175.29 175.21 1tbr s ASP 21 N -2.32 6.43 0.62 12.60 1.01 -1.26 -0.55 116.67 133.20 1tbr s ASP 21 Ca 0.03 2.89 -0.14 0.00 0.71 0.00 0.00 52.55 56.04 1tbr s ASP 21 Cb -0.03 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.24 1tbr s ASP 21 CO -0.01 -0.87 1.05 0.00 0.21 0.00 0.00 175.17 175.55 1tbr s ALA 22 N 0.03 2.76 0.48 5.23 0.00 0.05 -4.81 121.76 125.50 1tbr s ALA 22 Ca 0.63 0.26 -0.12 0.00 0.00 0.00 0.00 51.96 52.73 1tbr s ALA 22 Cb -0.47 -3.20 -0.06 0.00 0.00 0.00 0.00 23.12 19.40 1tbr s ALA 22 CO 0.46 -0.89 0.87 -1.21 0.00 0.00 0.00 175.76 174.99 1tbr s GLU 23 N -4.43 3.77 0.22 0.00 2.02 -1.26 -4.92 118.70 114.10 1tbr s GLU 23 Ca 0.61 0.61 -0.31 0.00 0.02 0.00 0.00 54.97 55.91 1tbr s GLU 23 Cb -0.15 -2.27 -0.11 0.00 0.10 0.00 0.00 34.13 31.70 1tbr s GLU 23 CO 0.43 -0.20 1.58 0.08 0.02 0.00 0.00 175.26 177.17 1tbr s VAL 24 N -2.60 2.37 -1.16 2.63 1.01 -1.26 -2.22 120.40 119.17 1tbr s VAL 24 Ca 0.53 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.80 1tbr s VAL 24 Cb -0.10 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.09 1tbr s VAL 24 CO 0.36 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1tbr n GLY 25 N 3.09 0.52 0.16 4.51 0.00 -1.26 -4.89 105.19 107.32 1tbr n GLY 25 Ca 0.11 -0.41 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 1tbr n GLY 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tbr h LEU 26 N 0.00 0.35 -6.48 0.99 5.85 -1.84 -3.38 115.31 110.81 1tbr h LEU 26 Ca -0.27 -0.22 -0.59 0.00 0.84 0.00 0.00 57.88 57.63 1tbr h LEU 26 Cb 1.03 -0.10 -0.40 0.00 0.37 0.00 0.00 40.66 41.56 1tbr h LEU 26 CO 0.35 0.93 -0.85 -1.20 -0.34 0.00 0.00 178.44 177.34 1tbr n SER 27 N -3.82 1.00 0.12 1.25 7.64 -1.26 -4.97 113.62 113.58 1tbr n SER 27 Ca -0.03 -2.76 0.06 0.00 1.01 0.00 0.00 58.87 57.15 1tbr n SER 27 Cb 0.68 -0.63 0.33 0.00 -1.01 0.00 0.00 64.21 63.57 1tbr n SER 27 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1tbr n PRO 28 N 2.15 0.08 0.00 1.43 -0.02 -1.26 -1.01 135.00 136.37 1tbr n PRO 28 Ca 0.26 0.54 0.09 0.00 -2.02 0.00 0.00 63.50 62.36 1tbr n PRO 28 Cb 0.45 -1.95 0.04 0.00 -0.02 0.00 0.00 33.50 32.02 1tbr n PRO 28 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1tbr n TRP 29 N -1.93 0.00 -2.10 6.00 2.14 -0.98 -0.90 117.44 119.67 1tbr n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1tbr n TRP 29 Cb 0.20 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.67 1tbr n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1tbr s GLN 30 N -1.82 4.26 0.17 -2.67 2.00 -0.18 -1.11 119.66 120.32 1tbr s GLN 30 Ca 0.18 2.13 0.09 0.00 -2.00 0.00 0.00 55.36 55.76 1tbr s GLN 30 Cb 0.15 -3.46 -0.04 0.00 0.80 0.00 0.00 33.01 30.45 1tbr s GLN 30 CO 0.34 -0.59 -0.13 0.08 -0.50 0.00 0.00 175.29 174.50 1tbr s VAL 31 N 2.04 3.02 -0.12 1.34 1.01 -0.62 -4.20 120.40 122.86 1tbr s VAL 31 Ca 0.67 -1.69 0.03 0.00 0.00 0.00 0.00 61.98 60.99 1tbr s VAL 31 Cb -0.36 -2.47 0.01 0.00 0.00 0.00 0.00 36.38 33.55 1tbr s VAL 31 CO 0.29 -0.08 -0.22 -0.32 0.00 0.00 0.00 175.10 174.78 1tbr s MET 32 N -2.71 2.90 -0.33 2.72 1.75 -0.42 -2.00 119.30 121.21 1tbr s MET 32 Ca 0.23 -0.82 -0.16 0.00 -1.25 0.00 0.00 55.69 53.69 1tbr s MET 32 Cb -0.09 -2.30 -0.01 0.00 2.84 0.00 0.00 34.83 35.27 1tbr s MET 32 CO 0.14 0.04 0.42 -0.51 -0.65 0.00 0.00 175.02 174.46 1tbr s LEU 33 N 0.68 4.33 -0.11 4.11 1.43 -0.25 -0.85 118.68 128.01 1tbr s LEU 33 Ca -0.11 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1tbr s LEU 33 Cb -0.16 -2.45 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 1tbr s LEU 33 CO 0.02 -0.36 -0.08 0.12 0.23 0.00 0.00 176.35 176.28 1tbr s PHE 34 N 2.17 2.92 0.04 0.29 5.36 -0.55 -0.76 117.98 127.46 1tbr s PHE 34 Ca 0.15 -0.26 -0.23 0.00 -0.96 0.00 0.00 56.93 55.62 1tbr s PHE 34 Cb -0.16 -1.82 -0.06 0.00 -0.34 0.00 0.00 43.02 40.64 1tbr s PHE 34 CO 0.12 0.06 0.70 0.50 -1.46 0.00 0.00 175.22 175.14 1tbr s ARG 35 N -0.12 4.43 -0.01 10.12 3.52 0.62 -1.04 118.95 136.48 1tbr s ARG 35 Ca 0.01 0.95 -0.25 0.00 -0.13 0.00 0.00 55.73 56.31 1tbr s ARG 35 Cb -0.13 -3.34 -0.18 0.00 -1.56 0.00 0.00 34.95 29.73 1tbr s ARG 35 CO 0.03 0.35 1.25 0.87 -0.81 0.00 0.00 175.30 176.99 1tbr h LYS 36 N 5.48 -0.15 -3.18 5.12 1.57 -1.82 -2.70 116.57 120.89 1tbr h LYS 36 Ca -0.45 0.01 -0.48 0.00 -1.87 0.00 0.00 60.65 57.86 1tbr h LYS 36 Cb 1.20 0.03 -0.41 0.00 0.08 0.00 0.00 32.23 33.14 1tbr h LYS 36 CO 0.70 0.23 -0.76 -1.12 -0.57 0.00 0.00 179.45 177.93 1tbr s SER 37 N -5.43 2.63 0.66 0.86 0.01 -1.26 -2.97 113.70 108.20 1tbr s SER 37 Ca -0.15 -0.74 -0.11 0.00 1.31 0.00 0.00 55.95 56.26 1tbr s SER 37 Cb 0.02 -0.36 -0.01 0.00 0.21 0.00 0.00 66.02 65.87 1tbr s SER 37 CO 0.61 -0.35 1.05 -2.16 0.41 0.00 0.00 173.24 172.80 1tbr s PRO 37 N 2.05 3.24 -0.58 12.44 0.04 -1.26 -5.04 135.00 145.88 1tbr s PRO 37 Ca 0.02 0.88 -0.27 0.00 0.04 0.00 0.00 61.00 61.67 1tbr s PRO 37 Cb -0.16 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 1tbr s PRO 37 CO -0.11 -0.86 1.76 -0.65 0.04 0.00 0.00 177.00 177.18 1tbr s GLN 38 N -5.05 2.84 0.08 4.56 1.11 -1.16 -4.52 119.66 117.52 1tbr s GLN 38 Ca 0.57 0.64 -0.03 0.00 0.01 0.00 0.00 55.36 56.54 1tbr s GLN 38 Cb -0.13 -4.32 -0.03 0.00 -1.01 0.00 0.00 33.01 27.53 1tbr s GLN 38 CO 0.54 -2.48 0.05 -1.21 0.01 0.00 0.00 175.29 172.20 1tbr s GLU 39 N 6.58 0.74 0.01 2.91 2.02 -1.02 -4.95 118.70 125.00 1tbr s GLU 39 Ca 0.65 -1.18 -0.30 0.00 0.02 0.00 0.00 54.97 54.16 1tbr s GLU 39 Cb -0.13 0.26 -0.04 0.00 0.10 0.00 0.00 34.13 34.32 1tbr s GLU 39 CO 0.22 -0.19 1.07 -1.17 0.02 0.00 0.00 175.26 175.22 1tbr s LEU 40 N -2.92 4.35 -0.07 1.80 2.96 -1.26 -0.28 118.68 123.26 1tbr s LEU 40 Ca 0.09 1.78 -0.07 0.00 -0.22 0.00 0.00 54.13 55.71 1tbr s LEU 40 Cb 0.07 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1tbr s LEU 40 CO -0.08 -0.37 -0.14 -0.11 -1.32 0.00 0.00 176.35 174.33 1tbr n LEU 41 N 4.08 0.79 0.00 -0.68 7.94 0.06 -4.89 117.00 124.31 1tbr n LEU 41 Ca 0.08 0.14 -0.08 0.00 -1.11 0.00 0.00 56.01 55.03 1tbr n LEU 41 Cb 0.49 -0.60 0.01 0.00 0.53 0.00 0.00 43.42 43.86 1tbr n LEU 41 CO 0.53 -0.41 0.37 0.00 -1.11 0.00 0.00 177.39 176.78 1tbr n GLY 43 N -0.44 2.04 2.05 0.00 0.00 0.47 -1.10 105.19 108.22 1tbr n GLY 43 Ca -0.06 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1tbr n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tbr n ALA 44 N -2.45 -1.73 -3.16 4.61 0.00 -0.85 -3.59 120.51 113.35 1tbr n ALA 44 Ca -0.11 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.76 1tbr n ALA 44 Cb 0.46 0.15 -0.10 0.00 0.00 0.00 0.00 19.45 19.96 1tbr n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tbr s SER 45 N -2.41 -0.13 -0.31 0.00 1.04 -0.68 -1.59 113.70 109.61 1tbr s SER 45 Ca 0.14 0.11 -0.20 0.00 0.48 0.00 0.00 55.95 56.48 1tbr s SER 45 Cb -0.01 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.44 1tbr s SER 45 CO 0.01 -0.30 0.63 -0.22 0.98 0.00 0.00 173.24 174.33 1tbr s LEU 46 N -0.89 4.15 -0.00 2.42 2.96 -0.27 -0.82 118.68 126.24 1tbr s LEU 46 Ca -0.10 0.40 0.21 0.00 -0.22 0.00 0.00 54.13 54.43 1tbr s LEU 46 Cb -0.05 -2.81 -0.20 0.00 0.50 0.00 0.00 46.19 43.64 1tbr s LEU 46 CO 0.02 -0.48 0.87 2.30 -1.32 0.00 0.00 176.35 177.73 1tbr n ILE 47 N 5.40 0.01 -3.13 6.68 -5.35 -0.42 -2.32 119.36 120.24 1tbr n ILE 47 Ca -0.01 -0.09 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 1tbr n ILE 47 Cb 0.49 0.77 0.00 0.00 -1.74 0.00 0.00 39.64 39.16 1tbr n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1tbr n SER 48 N -1.64 0.00 0.09 7.28 3.41 -1.22 -4.67 113.62 116.88 1tbr n SER 48 Ca 0.03 -0.96 0.12 0.00 -0.26 0.00 0.00 58.87 57.80 1tbr n SER 48 Cb 0.37 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 64.78 1tbr n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1tbr n ASP 49 N -0.80 0.57 0.00 4.04 5.68 -1.26 -3.97 116.55 120.81 1tbr n ASP 49 Ca 0.00 0.60 0.00 0.00 -0.50 0.00 0.00 54.79 54.89 1tbr n ASP 49 Cb 0.00 -0.73 0.00 0.00 -1.14 0.00 0.00 41.12 39.25 1tbr n ASP 49 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1tbr n ARG 50 N -2.08 2.12 -5.00 0.11 1.85 -1.26 -1.50 116.66 110.90 1tbr n ARG 50 Ca 0.04 -0.11 -0.32 0.00 -1.00 0.00 0.00 57.85 56.46 1tbr n ARG 50 Cb 0.30 -0.49 -0.14 0.00 -1.05 0.00 0.00 32.46 31.09 1tbr n ARG 50 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1tbr s TRP 51 N -0.34 2.54 0.06 2.89 0.52 -1.25 -0.64 118.94 122.72 1tbr s TRP 51 Ca 0.00 -0.28 0.08 0.00 0.02 0.00 0.00 56.10 55.92 1tbr s TRP 51 Cb 0.00 -1.55 -0.03 0.00 -1.15 0.00 0.00 33.47 30.74 1tbr s TRP 51 CO 0.00 0.12 -0.21 0.08 0.02 0.00 0.00 176.95 176.96 1tbr s VAL 52 N -0.72 1.66 -0.05 4.03 1.01 -0.56 -1.30 120.40 124.48 1tbr s VAL 52 Ca 0.11 -1.31 0.06 0.00 0.00 0.00 0.00 61.98 60.85 1tbr s VAL 52 Cb -0.10 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 1tbr s VAL 52 CO 0.01 0.11 -0.23 -0.22 0.00 0.00 0.00 175.10 174.77 1tbr s LEU 53 N -1.42 2.03 0.00 3.92 2.96 0.00 -1.10 118.68 125.07 1tbr s LEU 53 Ca 0.07 -0.47 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 1tbr s LEU 53 Cb -0.09 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.33 1tbr s LEU 53 CO 0.03 0.23 0.25 0.41 -1.32 0.00 0.00 176.35 175.95 1tbr n THR 54 N 2.93 0.00 -3.32 3.68 -1.04 -0.52 -1.69 114.28 114.31 1tbr n THR 54 Ca -0.17 -1.29 -0.39 0.00 -2.04 0.00 0.00 64.05 60.16 1tbr n THR 54 Cb 0.52 0.72 -0.08 0.00 -1.82 0.00 0.00 70.33 69.68 1tbr n THR 54 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tbr s ALA 55 N -2.54 3.56 0.55 2.41 0.00 -1.26 -1.74 121.76 122.74 1tbr s ALA 55 Ca 0.21 -0.56 0.37 0.00 0.00 0.00 0.00 51.96 51.98 1tbr s ALA 55 Cb 0.00 -2.75 1.55 0.00 0.00 0.00 0.00 23.12 21.92 1tbr s ALA 55 CO 0.15 -0.49 1.79 0.00 0.00 0.00 0.00 175.76 177.21 1tbr h ALA 56 N 7.66 3.11 0.00 0.00 0.00 -1.68 0.55 119.26 128.91 1tbr h ALA 56 Ca -0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1tbr h ALA 56 Cb 1.16 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1tbr h ALA 56 CO 0.71 -1.47 0.00 -2.39 0.00 0.00 0.00 179.25 176.10 1tbr n HIS 57 N -4.14 0.00 0.10 0.00 1.44 -1.26 -1.76 115.22 109.60 1tbr n HIS 57 Ca 0.25 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.79 1tbr n HIS 57 Cb 1.26 -0.16 -0.14 0.00 0.12 0.00 0.00 29.99 31.06 1tbr n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1tbr n LEU 59 N -3.53 2.55 -3.91 0.00 4.77 -0.89 -4.90 117.00 111.09 1tbr n LEU 59 Ca -0.12 0.19 -0.27 0.00 -0.03 0.00 0.00 56.01 55.78 1tbr n LEU 59 Cb 1.04 -1.05 -0.17 0.00 -2.33 0.00 0.00 43.42 40.91 1tbr n LEU 59 CO 0.54 0.77 -0.44 -0.22 -1.33 0.00 0.00 177.39 176.70 1tbr s LEU 60 N -7.11 1.22 0.22 2.23 2.96 -0.72 -0.65 118.68 116.82 1tbr s LEU 60 Ca -0.26 -0.30 -0.22 0.00 -0.22 0.00 0.00 54.13 53.13 1tbr s LEU 60 Cb 0.07 -0.83 0.04 0.00 0.50 0.00 0.00 46.19 45.97 1tbr s LEU 60 CO 0.70 -0.11 0.69 -0.47 -1.32 0.00 0.00 176.35 175.85 1tbr s TYR 60 N 1.62 -0.33 0.00 5.38 5.04 -0.10 -4.29 117.35 124.67 1tbr s TYR 60 Ca 0.03 -0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.65 1tbr s TYR 60 Cb -0.13 0.64 0.00 0.00 0.35 0.00 0.00 41.96 42.82 1tbr s TYR 60 CO -0.07 -1.04 0.00 -2.30 -1.34 0.00 0.00 175.55 170.80 1tbr n PRO 60 N -0.42 0.00 0.00 4.97 -0.02 -1.26 -2.37 135.00 135.90 1tbr n PRO 60 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1tbr n PRO 60 Cb 0.62 -0.06 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 1tbr n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1tbr n TRP 60 N 0.06 0.00 -1.30 6.00 8.01 -1.26 -4.96 117.44 124.00 1tbr n TRP 60 Ca 0.00 -0.33 -0.10 0.00 -1.31 0.00 0.00 57.50 55.76 1tbr n TRP 60 Cb 0.00 -0.03 -0.04 0.00 -2.01 0.00 0.00 31.31 29.22 1tbr n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1tbr n ASP 60 N -0.33 -4.51 -4.70 -0.99 8.00 -1.21 -4.96 116.55 107.85 1tbr n ASP 60 Ca 0.00 0.26 -0.41 0.00 0.71 0.00 0.00 54.79 55.35 1tbr n ASP 60 Cb 0.18 -2.92 -0.04 0.00 -0.02 0.00 0.00 41.12 38.31 1tbr n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1tbr s LYS 60 N -2.76 4.41 -0.29 -1.24 2.20 -1.00 -4.96 119.74 116.09 1tbr s LYS 60 Ca 0.00 1.03 -0.02 0.00 -0.36 0.00 0.00 55.97 56.62 1tbr s LYS 60 Cb 0.00 -3.50 0.19 0.00 -1.51 0.00 0.00 37.83 33.01 1tbr s LYS 60 CO 0.00 -0.11 0.78 1.21 -0.36 0.00 0.00 175.35 176.88 1tbr s ASN 60 N 0.97 -1.11 -0.08 1.43 3.04 -1.22 -0.92 114.94 117.04 1tbr s ASN 60 Ca 0.40 0.18 -0.04 0.00 0.04 0.00 0.00 52.86 53.45 1tbr s ASN 60 Cb -0.18 1.73 -0.04 0.00 -1.54 0.00 0.00 41.25 41.22 1tbr s ASN 60 CO 0.18 -0.20 0.10 -0.36 -3.04 0.00 0.00 177.10 173.78 1tbr s PHE 60 N 2.89 3.44 0.39 0.43 0.08 0.18 -5.01 117.98 120.37 1tbr s PHE 60 Ca 0.17 0.38 0.08 0.00 0.12 0.00 0.00 56.93 57.68 1tbr s PHE 60 Cb -0.07 -1.86 -0.02 0.00 -0.57 0.00 0.00 43.02 40.50 1tbr s PHE 60 CO -0.24 0.64 0.40 0.95 -0.10 0.00 0.00 175.22 176.87 1tbr s THR 60 N -1.05 3.00 -0.09 0.64 -4.23 -1.26 -4.89 115.64 107.77 1tbr s THR 60 Ca 0.17 -1.26 0.11 0.00 -1.18 0.00 0.00 61.69 59.53 1tbr s THR 60 Cb -0.12 -3.07 0.11 0.00 1.34 0.00 0.00 72.50 70.76 1tbr s THR 60 CO 0.06 -0.05 1.21 1.33 -0.54 0.00 0.00 174.62 176.63 1tbr n VAL 61 N -1.58 0.71 0.65 2.29 0.24 -1.26 -0.26 118.33 119.12 1tbr n VAL 61 Ca 0.03 0.70 0.11 0.00 -2.04 0.00 0.00 64.34 63.14 1tbr n VAL 61 Cb 0.61 -1.70 0.04 0.00 -1.47 0.00 0.00 33.84 31.31 1tbr n VAL 61 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1tbr n ASP 62 N -1.92 0.63 -0.07 -1.34 8.00 -1.26 -4.21 116.55 116.38 1tbr n ASP 62 Ca -0.01 -0.27 0.14 0.00 0.71 0.00 0.00 54.79 55.37 1tbr n ASP 62 Cb 0.30 0.74 0.67 0.00 -0.02 0.00 0.00 41.12 42.81 1tbr n ASP 62 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1tbr n ASP 63 N -1.88 0.30 -3.60 -2.24 9.92 0.64 -4.90 116.55 114.80 1tbr n ASP 63 Ca 0.02 -0.45 -0.10 0.00 -0.53 0.00 0.00 54.79 53.73 1tbr n ASP 63 Cb 0.42 -0.13 -0.02 0.00 -0.64 0.00 0.00 41.12 40.74 1tbr n ASP 63 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 1tbr s LEU 64 N -2.49 -0.33 0.35 0.64 0.05 -1.26 -2.54 118.68 113.11 1tbr s LEU 64 Ca 0.29 -0.25 0.05 0.00 0.05 0.00 0.00 54.13 54.27 1tbr s LEU 64 Cb 0.20 2.51 -0.07 0.00 -2.05 0.00 0.00 46.19 46.78 1tbr s LEU 64 CO 0.47 -1.07 0.04 -0.76 -0.55 0.00 0.00 176.35 174.47 1tbr s LEU 65 N -2.82 2.43 -0.02 1.48 1.43 -0.20 -4.51 118.68 116.48 1tbr s LEU 65 Ca 0.05 -1.37 0.07 0.00 -1.03 0.00 0.00 54.13 51.86 1tbr s LEU 65 Cb -0.02 -0.57 -0.02 0.00 0.03 0.00 0.00 46.19 45.60 1tbr s LEU 65 CO -0.06 -0.54 -0.23 -0.69 0.23 0.00 0.00 176.35 175.06 1tbr s VAL 66 N -3.08 2.34 -0.23 -1.59 1.01 0.26 -1.48 120.40 117.63 1tbr s VAL 66 Ca 0.36 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1tbr s VAL 66 Cb 0.09 -1.86 0.05 0.00 0.00 0.00 0.00 36.38 34.66 1tbr s VAL 66 CO 0.16 0.54 -0.09 -0.13 0.00 0.00 0.00 175.10 175.59 1tbr s ARG 67 N -0.76 1.95 0.04 2.72 0.52 -0.03 -0.78 118.95 122.61 1tbr s ARG 67 Ca 0.11 -1.02 0.04 0.00 -0.52 0.00 0.00 55.73 54.34 1tbr s ARG 67 Cb -0.10 -2.60 -0.04 0.00 0.52 0.00 0.00 34.95 32.74 1tbr s ARG 67 CO 0.00 -0.52 -0.05 0.42 0.02 0.00 0.00 175.30 175.17 1tbr s ILE 68 N 1.32 3.76 0.00 1.52 1.01 0.62 -1.30 121.20 128.14 1tbr s ILE 68 Ca -0.05 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 59.72 1tbr s ILE 68 Cb -0.18 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.59 1tbr s ILE 68 CO -0.07 0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1tbr n GLY 69 N 1.17 0.73 3.77 6.18 0.00 -1.26 -0.39 105.19 115.40 1tbr n GLY 69 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1tbr n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tbr s LYS 70 N -0.54 1.71 0.03 1.61 1.02 -1.26 -4.48 119.74 117.83 1tbr s LYS 70 Ca 0.00 0.65 0.00 0.00 0.02 0.00 0.00 55.97 56.64 1tbr s LYS 70 Cb 0.00 -1.87 0.00 0.00 -0.52 0.00 0.00 37.83 35.44 1tbr s LYS 70 CO 0.00 -1.89 0.00 1.58 -0.92 0.00 0.00 175.35 174.12 1tbr n HIS 71 N -3.62 -0.27 -3.08 3.18 -0.00 -1.26 -4.93 115.22 105.25 1tbr n HIS 71 Ca 0.07 0.05 -0.37 0.00 -0.00 0.00 0.00 57.72 57.47 1tbr n HIS 71 Cb 0.56 0.43 -0.06 0.00 -0.00 0.00 0.00 29.99 30.92 1tbr n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1tbr s SER 72 N -5.02 7.11 0.26 0.26 0.15 -1.26 -0.73 113.70 114.47 1tbr s SER 72 Ca 0.00 1.46 0.24 0.00 0.70 0.00 0.00 55.95 58.35 1tbr s SER 72 Cb 0.00 -2.43 0.34 0.00 -1.71 0.00 0.00 66.02 62.21 1tbr s SER 72 CO 0.00 0.05 1.42 0.08 1.20 0.00 0.00 173.24 175.99 1tbr h ARG 73 N 3.53 0.00 0.00 5.44 0.11 -1.79 -3.41 114.38 118.25 1tbr h ARG 73 Ca -0.48 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.49 1tbr h ARG 73 Cb 1.19 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.26 1tbr h ARG 73 CO 0.65 0.00 -1.17 0.25 0.10 0.00 0.00 179.97 179.80 1tbr n THR 74 N -2.60 1.29 -1.76 0.08 -2.24 -1.26 -5.02 114.28 102.76 1tbr n THR 74 Ca 0.03 0.05 -0.41 0.00 -2.27 0.00 0.00 64.05 61.45 1tbr n THR 74 Cb 0.50 -1.99 -0.01 0.00 -2.10 0.00 0.00 70.33 66.72 1tbr n THR 74 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1tbr n ARG 75 N -4.06 2.72 -2.31 -0.78 0.63 -1.26 -4.93 116.66 106.66 1tbr n ARG 75 Ca -0.19 0.96 -0.43 0.00 -0.92 0.00 0.00 57.85 57.27 1tbr n ARG 75 Cb 0.50 -2.72 -0.02 0.00 0.45 0.00 0.00 32.46 30.66 1tbr n ARG 75 CO 0.00 0.00 0.00 -0.47 -2.51 0.00 0.00 177.63 174.65 1tbr s TYR 76 N -0.54 2.37 -1.24 -0.14 5.04 -1.26 -4.86 117.35 116.71 1tbr s TYR 76 Ca 0.59 0.69 -0.10 0.00 -2.44 0.00 0.00 57.07 55.80 1tbr s TYR 76 Cb -0.48 -4.22 0.18 0.00 0.35 0.00 0.00 41.96 37.79 1tbr s TYR 76 CO 0.56 -2.09 1.67 0.39 -1.34 0.00 0.00 175.55 174.74 1tbr n GLU 77 N 7.98 3.60 -0.49 4.97 1.02 -1.26 -4.87 120.64 131.59 1tbr n GLU 77 Ca 0.17 -3.75 0.41 0.00 -0.02 0.00 0.00 57.16 53.97 1tbr n GLU 77 Cb 0.48 -2.92 0.68 0.00 -0.02 0.00 0.00 31.44 29.66 1tbr n GLU 77 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1tbr n ARG 77 N 4.23 -0.03 0.18 3.49 1.85 -1.26 -1.01 116.66 124.10 1tbr n ARG 77 Ca 0.37 1.23 0.12 0.00 -1.00 0.00 0.00 57.85 58.58 1tbr n ARG 77 Cb 0.38 -2.46 0.23 0.00 -1.05 0.00 0.00 32.46 29.56 1tbr n ARG 77 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 177.63 177.40 1tbr h LYS 78 N 0.00 0.00 0.00 2.89 3.64 -2.02 -3.40 116.57 117.67 1tbr h LYS 78 Ca 0.88 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.26 1tbr h LYS 78 Cb 2.88 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.70 1tbr h LYS 78 CO -0.43 0.00 -0.44 1.33 -2.27 0.00 0.00 179.45 177.63 1tbr n VAL 79 N -2.85 0.00 -2.17 2.00 0.24 -0.47 -5.11 118.33 109.97 1tbr n VAL 79 Ca 0.04 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.97 1tbr n VAL 79 Cb 0.50 -0.41 -0.00 0.00 -1.47 0.00 0.00 33.84 32.46 1tbr n VAL 79 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1tbr s GLU 80 N -1.44 3.67 -0.03 7.34 2.12 -0.18 -4.70 118.70 125.49 1tbr s GLU 80 Ca 0.00 1.87 0.02 0.00 0.36 0.00 0.00 54.97 57.22 1tbr s GLU 80 Cb 0.00 -2.41 0.01 0.00 0.26 0.00 0.00 34.13 31.99 1tbr s GLU 80 CO 0.00 -0.65 -0.07 0.15 -0.54 0.00 0.00 175.26 174.16 1tbr s LYS 81 N -2.69 0.79 -0.06 4.30 -0.14 0.48 -4.88 119.74 117.53 1tbr s LYS 81 Ca 0.64 -0.21 0.03 0.00 -1.36 0.00 0.00 55.97 55.07 1tbr s LYS 81 Cb -0.31 -0.76 -0.03 0.00 -1.68 0.00 0.00 37.83 35.05 1tbr s LYS 81 CO 0.38 0.05 -0.13 0.42 -0.76 0.00 0.00 175.35 175.31 1tbr s ILE 82 N 0.34 3.13 0.11 2.17 1.01 -1.26 -0.27 121.20 126.43 1tbr s ILE 82 Ca -0.05 -0.69 -0.03 0.00 0.00 0.00 0.00 60.65 59.88 1tbr s ILE 82 Cb -0.09 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 1tbr s ILE 82 CO 0.00 0.59 0.07 -0.44 0.00 0.00 0.00 174.94 175.16 1tbr s SER 83 N -0.69 0.32 0.21 3.58 0.01 0.04 -4.97 113.70 112.20 1tbr s SER 83 Ca 0.10 -1.06 0.09 0.00 1.31 0.00 0.00 55.95 56.40 1tbr s SER 83 Cb -0.11 0.29 -0.04 0.00 0.21 0.00 0.00 66.02 66.36 1tbr s SER 83 CO 0.01 -0.71 -0.08 -0.04 0.41 0.00 0.00 173.24 172.83 1tbr s MET 84 N -3.98 2.09 0.04 12.44 -1.94 -1.26 -0.58 119.30 126.11 1tbr s MET 84 Ca 0.16 -1.36 -0.19 0.00 -1.71 0.00 0.00 55.69 52.59 1tbr s MET 84 Cb 0.07 -2.12 -0.06 0.00 2.01 0.00 0.00 34.83 34.72 1tbr s MET 84 CO -0.03 0.40 0.56 -0.51 -0.01 0.00 0.00 175.02 175.43 1tbr s LEU 85 N -3.14 4.48 -0.20 -0.03 1.43 -1.26 -0.48 118.68 119.49 1tbr s LEU 85 Ca 0.27 1.19 -0.15 0.00 -1.03 0.00 0.00 54.13 54.41 1tbr s LEU 85 Cb -0.08 -2.87 -0.10 0.00 0.03 0.00 0.00 46.19 43.18 1tbr s LEU 85 CO 0.17 0.22 -0.13 -0.67 0.23 0.00 0.00 176.35 176.16 1tbr n ASP 86 N 2.08 1.88 -3.85 2.29 2.03 0.20 -4.65 116.55 116.52 1tbr n ASP 86 Ca -0.10 0.46 -0.13 0.00 0.52 0.00 0.00 54.79 55.54 1tbr n ASP 86 Cb 0.51 -0.86 -0.14 0.00 -0.72 0.00 0.00 41.12 39.90 1tbr n ASP 86 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1tbr s LYS 87 N -2.46 0.03 -0.14 -0.67 1.02 -1.19 -4.95 119.74 111.38 1tbr s LYS 87 Ca -0.26 0.03 -0.04 0.00 0.02 0.00 0.00 55.97 55.72 1tbr s LYS 87 Cb 0.06 -0.09 -0.03 0.00 -0.52 0.00 0.00 37.83 37.25 1tbr s LYS 87 CO 0.42 -0.03 -0.01 0.42 -0.92 0.00 0.00 175.35 175.23 1tbr s ILE 88 N 0.24 4.12 -0.23 2.17 1.01 -1.26 -0.39 121.20 126.86 1tbr s ILE 88 Ca -0.02 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.35 1tbr s ILE 88 Cb -0.03 -2.79 0.06 0.00 0.01 0.00 0.00 42.46 39.71 1tbr s ILE 88 CO -0.01 0.52 -0.05 -0.31 0.00 0.00 0.00 174.94 175.10 1tbr s TYR 89 N 0.00 2.31 -0.15 3.97 2.02 0.53 -4.99 117.35 121.04 1tbr s TYR 89 Ca 0.02 -1.70 -0.08 0.00 -0.37 0.00 0.00 57.07 54.94 1tbr s TYR 89 Cb -0.13 -1.55 -0.04 0.00 -0.40 0.00 0.00 41.96 39.84 1tbr s TYR 89 CO 0.02 -0.77 0.12 0.42 -1.57 0.00 0.00 175.55 173.78 1tbr s ILE 90 N 1.42 5.35 0.09 2.71 1.01 -1.26 -0.41 121.20 130.11 1tbr s ILE 90 Ca -0.05 0.16 -0.34 0.00 0.00 0.00 0.00 60.65 60.41 1tbr s ILE 90 Cb -0.19 -3.38 -0.13 0.00 0.01 0.00 0.00 42.46 38.77 1tbr s ILE 90 CO -0.06 0.54 1.65 1.57 0.00 0.00 0.00 174.94 178.63 1tbr n HIS 91 N 2.72 2.26 0.27 3.97 -0.00 -1.00 -4.85 115.22 118.59 1tbr n HIS 91 Ca -0.18 0.21 0.11 0.00 -0.00 0.00 0.00 57.72 57.87 1tbr n HIS 91 Cb 0.54 -2.57 0.75 0.00 -0.00 0.00 0.00 29.99 28.71 1tbr n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1tbr h PRO 92 N 6.74 0.00 -0.99 1.57 0.13 -1.93 -2.40 132.00 135.12 1tbr h PRO 92 Ca -0.46 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.15 1tbr h PRO 92 Cb 1.26 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.09 1tbr h PRO 92 CO 0.90 0.05 0.65 0.54 -0.23 0.00 0.00 178.00 179.92 1tbr n ARG 93 N -4.05 2.26 -2.49 0.86 5.12 -1.26 -4.94 116.66 112.16 1tbr n ARG 93 Ca -0.03 -3.02 -0.43 0.00 -1.93 0.00 0.00 57.85 52.44 1tbr n ARG 93 Cb 0.14 -2.18 -0.02 0.00 -1.16 0.00 0.00 32.46 29.24 1tbr n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1tbr s TYR 94 N -3.32 2.99 -0.74 -1.55 5.04 -0.91 -4.63 117.35 114.23 1tbr s TYR 94 Ca 0.57 1.14 -0.11 0.00 -2.44 0.00 0.00 57.07 56.23 1tbr s TYR 94 Cb 0.48 -3.45 0.19 0.00 0.35 0.00 0.00 41.96 39.54 1tbr s TYR 94 CO 0.10 -1.35 0.65 1.21 -1.34 0.00 0.00 175.55 174.82 1tbr s ASN 95 N 1.77 6.26 0.27 4.32 3.84 -0.27 -4.89 114.94 126.24 1tbr s ASN 95 Ca 0.52 -2.67 0.23 0.00 0.21 0.00 0.00 52.86 51.15 1tbr s ASN 95 Cb -0.20 -2.10 0.15 0.00 -0.55 0.00 0.00 41.25 38.55 1tbr s ASN 95 CO 0.12 -0.53 1.25 4.11 -2.79 0.00 0.00 177.10 179.26 1tbr h TRP 96 N 7.64 0.00 0.00 0.43 5.08 -1.94 -0.29 115.95 126.87 1tbr h TRP 96 Ca 0.04 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 59.97 1tbr h TRP 96 Cb 1.02 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.17 1tbr h TRP 96 CO 0.91 0.00 -0.28 -0.22 -1.28 0.00 0.00 178.44 177.58 1tbr h LYS 97 N 0.00 0.00 0.00 0.12 3.64 -2.00 -3.43 116.57 114.90 1tbr h LYS 97 Ca 0.00 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1tbr h LYS 97 Cb 0.97 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1tbr h LYS 97 CO 0.00 0.19 -0.92 -1.91 -2.27 0.00 0.00 179.45 174.53 1tbr n GLU 97 N -3.12 0.27 -0.43 1.90 2.13 -1.25 -4.99 120.64 115.15 1tbr n GLU 97 Ca 0.03 0.11 0.00 0.00 0.66 0.00 0.00 57.16 57.96 1tbr n GLU 97 Cb 0.61 -0.96 0.00 0.00 0.27 0.00 0.00 31.44 31.36 1tbr n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1tbr n ASN 98 N -3.84 0.00 -3.67 4.31 6.94 -1.24 -4.88 115.26 112.89 1tbr n ASN 98 Ca -0.14 -1.33 -0.22 0.00 -0.02 0.00 0.00 54.58 52.87 1tbr n ASN 98 Cb 0.40 -0.07 0.04 0.00 -2.36 0.00 0.00 39.78 37.79 1tbr n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1tbr n LEU 99 N 0.00 -3.26 -4.77 -4.53 4.77 -0.13 -4.95 117.00 104.12 1tbr n LEU 99 Ca 0.00 -0.83 -0.39 0.00 -0.03 0.00 0.00 56.01 54.76 1tbr n LEU 99 Cb 0.57 -2.68 -0.06 0.00 -2.33 0.00 0.00 43.42 38.92 1tbr n LEU 99 CO 0.00 0.39 0.49 -0.62 -1.33 0.00 0.00 177.39 176.32 1tbr s ASP 100 N -4.22 7.39 -1.35 -1.43 2.15 -1.13 -3.88 116.67 114.20 1tbr s ASP 100 Ca 0.07 1.64 -0.06 0.00 0.43 0.00 0.00 52.55 54.63 1tbr s ASP 100 Cb -0.02 -2.50 0.02 0.00 -0.30 0.00 0.00 42.92 40.12 1tbr s ASP 100 CO 0.81 0.18 1.03 0.54 -0.17 0.00 0.00 175.17 177.56 1tbr n ARG 101 N 1.73 -6.70 -2.44 4.34 1.74 -1.26 -1.11 116.66 112.96 1tbr n ARG 101 Ca -0.05 0.76 -0.38 0.00 -0.77 0.00 0.00 57.85 57.40 1tbr n ARG 101 Cb 0.49 -5.70 -0.03 0.00 -1.02 0.00 0.00 32.46 26.20 1tbr n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1tbr s ASP 102 N -3.73 6.27 -0.05 0.55 -1.08 -1.25 -4.37 116.67 113.01 1tbr s ASP 102 Ca 0.37 -1.75 -0.17 0.00 -0.52 0.00 0.00 52.55 50.48 1tbr s ASP 102 Cb -0.17 -2.57 0.03 0.00 -1.46 0.00 0.00 42.92 38.75 1tbr s ASP 102 CO 0.76 -1.74 0.38 -0.51 0.52 0.00 0.00 175.17 174.58 1tbr s ILE 103 N 6.12 0.04 -0.20 4.11 2.07 -1.26 -3.85 121.20 128.22 1tbr s ILE 103 Ca 0.55 -0.32 -0.18 0.00 -1.41 0.00 0.00 60.65 59.29 1tbr s ILE 103 Cb 0.01 -0.66 0.05 0.00 0.13 0.00 0.00 42.46 41.99 1tbr s ILE 103 CO 0.01 -0.17 0.54 0.00 -1.91 0.00 0.00 174.94 173.40 1tbr s ALA 104 N -1.00 -1.33 0.01 1.50 0.00 -0.71 -2.37 121.76 117.86 1tbr s ALA 104 Ca -0.11 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.39 1tbr s ALA 104 Cb -0.04 -0.89 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 1tbr s ALA 104 CO 0.04 -0.26 0.07 -0.51 0.00 0.00 0.00 175.76 175.11 1tbr s LEU 105 N 0.36 3.85 -0.06 0.00 1.43 0.45 -1.44 118.68 123.26 1tbr s LEU 105 Ca -0.01 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.23 1tbr s LEU 105 Cb -0.04 -2.27 0.01 0.00 0.03 0.00 0.00 46.19 43.92 1tbr s LEU 105 CO -0.00 0.26 -0.13 -0.76 0.23 0.00 0.00 176.35 175.95 1tbr s LEU 106 N -1.80 1.70 -0.23 1.79 1.43 -0.26 -0.34 118.68 120.96 1tbr s LEU 106 Ca 0.23 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 52.94 1tbr s LEU 106 Cb -0.12 -0.83 -0.04 0.00 0.03 0.00 0.00 46.19 45.23 1tbr s LEU 106 CO 0.15 0.05 0.13 -0.75 0.23 0.00 0.00 176.35 176.16 1tbr s LYS 107 N 0.53 3.95 0.22 1.70 2.20 0.48 -1.49 119.74 127.33 1tbr s LYS 107 Ca -0.12 -0.33 -0.30 0.00 -0.36 0.00 0.00 55.97 54.86 1tbr s LYS 107 Cb -0.15 -3.44 -0.09 0.00 -1.51 0.00 0.00 37.83 32.64 1tbr s LYS 107 CO 0.03 0.03 1.24 -0.51 -0.36 0.00 0.00 175.35 175.78 1tbr s LEU 108 N 1.11 4.45 0.36 5.43 1.43 0.19 0.59 118.68 132.24 1tbr s LEU 108 Ca 0.06 2.36 0.11 0.00 -1.03 0.00 0.00 54.13 55.63 1tbr s LEU 108 Cb -0.14 -3.62 0.88 0.00 0.03 0.00 0.00 46.19 43.34 1tbr s LEU 108 CO 0.04 -0.42 1.84 0.50 0.23 0.00 0.00 176.35 178.54 1tbr h LYS 109 N 4.90 0.61 -3.56 1.70 3.64 -1.04 -3.41 116.57 119.39 1tbr h LYS 109 Ca -0.45 -0.04 -0.22 0.00 -1.27 0.00 0.00 60.65 58.67 1tbr h LYS 109 Cb 1.22 -0.14 -0.28 0.00 -0.41 0.00 0.00 32.23 32.62 1tbr h LYS 109 CO 0.74 0.40 -0.64 1.03 -2.27 0.00 0.00 179.45 178.71 1tbr s ARG 110 N -5.65 0.07 0.25 1.90 0.52 -1.26 -4.95 118.95 109.83 1tbr s ARG 110 Ca -0.10 0.10 -0.31 0.00 -0.52 0.00 0.00 55.73 54.90 1tbr s ARG 110 Cb 0.23 0.03 -0.12 0.00 0.52 0.00 0.00 34.95 35.60 1tbr s ARG 110 CO 0.79 -0.02 1.58 -2.30 0.02 0.00 0.00 175.30 175.38 1tbr n PRO 111 N 3.10 2.52 -2.51 3.54 -0.02 -1.26 -4.93 135.00 135.43 1tbr n PRO 111 Ca -0.13 0.90 -0.28 0.00 -2.02 0.00 0.00 63.50 61.97 1tbr n PRO 111 Cb 0.59 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1tbr n PRO 111 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1tbr s ILE 112 N 0.34 4.77 -0.16 4.25 -5.25 -0.56 -5.02 121.20 119.57 1tbr s ILE 112 Ca 0.69 0.27 -0.17 0.00 -0.99 0.00 0.00 60.65 60.45 1tbr s ILE 112 Cb -0.55 -3.83 -0.04 0.00 2.95 0.00 0.00 42.46 40.99 1tbr s ILE 112 CO 0.44 -0.86 0.46 -1.61 -1.79 0.00 0.00 174.94 171.58 1tbr s GLU 113 N -4.82 4.25 0.68 0.37 2.02 -1.26 -4.88 118.70 115.06 1tbr s GLU 113 Ca 0.49 0.36 -0.11 0.00 0.02 0.00 0.00 54.97 55.73 1tbr s GLU 113 Cb -0.10 -3.50 0.00 0.00 0.10 0.00 0.00 34.13 30.63 1tbr s GLU 113 CO 0.46 0.02 1.06 -0.51 0.02 0.00 0.00 175.26 176.31 1tbr s LEU 114 N 1.08 3.16 0.00 1.80 1.43 -1.26 -4.92 118.68 119.97 1tbr s LEU 114 Ca 0.23 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 54.94 1tbr s LEU 114 Cb -0.15 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.58 1tbr s LEU 114 CO 0.09 -1.38 0.00 -1.54 0.23 0.00 0.00 176.35 173.76 1tbr n SER 115 N -3.03 0.00 0.23 2.29 3.41 -0.42 -4.93 113.62 111.17 1tbr n SER 115 Ca 0.07 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.82 1tbr n SER 115 Cb 0.54 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 64.83 1tbr n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1tbr h ASP 116 N 0.00 0.00 -0.01 4.04 5.19 -1.99 -3.27 116.42 120.38 1tbr h ASP 116 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1tbr h ASP 116 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1tbr h ASP 116 CO 0.00 0.04 -0.14 -1.22 -3.12 0.00 0.00 179.24 174.79 1tbr n TYR 117 N -3.12 0.00 -3.74 4.55 4.02 -1.26 -4.89 117.16 112.73 1tbr n TYR 117 Ca 0.03 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.62 1tbr n TYR 117 Cb 0.46 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.63 1tbr n TYR 117 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1tbr s ILE 118 N -1.18 0.78 -0.15 -0.72 1.01 -1.23 -4.31 121.20 115.40 1tbr s ILE 118 Ca 0.09 -1.11 -0.13 0.00 0.00 0.00 0.00 60.65 59.50 1tbr s ILE 118 Cb 0.08 -1.46 0.04 0.00 0.01 0.00 0.00 42.46 41.13 1tbr s ILE 118 CO 0.21 -0.50 0.39 -2.28 0.00 0.00 0.00 174.94 172.76 1tbr s HIS 119 N 1.69 -0.44 0.54 3.97 2.46 -0.08 -1.30 115.29 122.14 1tbr s HIS 119 Ca 0.05 1.06 -0.19 0.00 0.47 0.00 0.00 55.06 56.46 1tbr s HIS 119 Cb -0.17 0.15 -0.06 0.00 -0.13 0.00 0.00 32.58 32.37 1tbr s HIS 119 CO -0.19 -0.22 1.09 -1.25 -2.47 0.00 0.00 174.74 171.70 1tbr s PRO 120 N 0.32 3.44 0.19 2.88 0.04 -1.26 -2.31 135.00 138.30 1tbr s PRO 120 Ca -0.01 1.47 0.02 0.00 0.04 0.00 0.00 61.00 62.53 1tbr s PRO 120 Cb -0.03 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 1tbr s PRO 120 CO -0.01 -0.75 0.34 0.54 0.04 0.00 0.00 177.00 177.16 1tbr s VAL 121 N -1.95 5.27 0.43 -0.36 0.11 -0.98 -4.91 120.40 118.00 1tbr s VAL 121 Ca 0.70 -0.66 -0.04 0.00 -2.93 0.00 0.00 61.98 59.05 1tbr s VAL 121 Cb -0.20 -3.77 -0.04 0.00 -1.53 0.00 0.00 36.38 30.83 1tbr s VAL 121 CO 0.27 -0.19 0.71 0.00 -3.33 0.00 0.00 175.10 172.56 1tbr s LEU 123 N -4.52 4.35 0.71 0.00 1.43 -1.26 -0.54 118.68 118.85 1tbr s LEU 123 Ca 0.46 0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 53.87 1tbr s LEU 123 Cb -0.10 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 44.01 1tbr s LEU 123 CO 0.41 0.39 1.09 -2.16 0.23 0.00 0.00 176.35 176.32 1tbr s PRO 124 N -1.14 2.59 0.48 1.29 0.04 -1.26 -4.89 135.00 132.11 1tbr s PRO 124 Ca 0.16 1.24 0.03 0.00 0.04 0.00 0.00 61.00 62.48 1tbr s PRO 124 Cb -0.12 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1tbr s PRO 124 CO 0.06 -1.40 0.01 0.16 0.04 0.00 0.00 177.00 175.87 1tbr s ASP 125 N -3.07 4.06 0.18 6.66 -4.77 -1.26 -4.92 116.67 113.55 1tbr s ASP 125 Ca 0.63 -1.56 -0.24 0.00 -3.30 0.00 0.00 52.55 48.09 1tbr s ASP 125 Cb -0.18 0.22 0.07 0.00 -1.09 0.00 0.00 42.92 41.93 1tbr s ASP 125 CO 0.49 -0.72 1.57 0.50 0.70 0.00 0.00 175.17 177.71 1tbr h LYS 126 N 1.48 -0.19 -0.21 2.11 1.63 -1.98 -2.42 116.57 116.99 1tbr h LYS 126 Ca -0.44 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.40 1tbr h LYS 126 Cb 1.29 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.94 1tbr h LYS 126 CO 0.76 -0.13 0.06 1.96 -3.45 0.00 0.00 179.45 178.66 1tbr h GLN 127 N -0.20 0.15 -0.86 1.90 4.20 -2.04 -1.05 115.11 117.21 1tbr h GLN 127 Ca 0.20 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1tbr h GLN 127 Cb 0.56 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1tbr h GLN 127 CO -0.71 0.10 0.00 2.41 -0.67 0.00 0.00 178.83 179.96 1tbr n THR 128 N -5.06 0.11 0.00 -0.54 -1.04 -0.91 -0.33 114.28 106.51 1tbr n THR 128 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1tbr n THR 128 Cb 0.08 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.26 1tbr n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tbr n ALA 129 N 0.57 0.00 -0.03 2.41 0.00 -0.40 -0.88 120.51 122.18 1tbr n ALA 129 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1tbr n ALA 129 Cb 0.09 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.76 1tbr n ALA 129 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1tbr h LYS 129 N 0.00 0.59 0.02 0.00 1.57 -0.93 -3.36 116.57 114.46 1tbr h LYS 129 Ca 0.00 -0.18 -0.35 0.00 -1.87 0.00 0.00 60.65 58.25 1tbr h LYS 129 Cb 0.00 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.20 1tbr h LYS 129 CO 0.00 0.70 -2.16 1.28 -0.57 0.00 0.00 179.45 178.69 1tbr n LEU 129 N -4.19 1.38 -4.06 2.94 4.77 -0.06 -4.68 117.00 113.09 1tbr n LEU 129 Ca 0.01 0.11 -0.39 0.00 -0.03 0.00 0.00 56.01 55.71 1tbr n LEU 129 Cb 0.33 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 1tbr n LEU 129 CO 0.41 0.63 2.08 0.18 -1.33 0.00 0.00 177.39 179.37 1tbr n LEU 130 N -3.07 4.68 -4.16 2.23 4.77 -1.26 -4.86 117.00 115.32 1tbr n LEU 130 Ca -0.32 -3.46 -0.26 0.00 -0.03 0.00 0.00 56.01 51.94 1tbr n LEU 130 Cb 1.07 -1.52 -0.16 0.00 -2.33 0.00 0.00 43.42 40.49 1tbr n LEU 130 CO 0.40 -0.26 -0.51 -1.00 -1.33 0.00 0.00 177.39 174.69 1tbr s HIS 131 N 5.85 1.74 0.50 -1.77 3.76 -1.26 -4.95 115.29 119.16 1tbr s HIS 131 Ca 0.57 -0.45 -0.22 0.00 -0.15 0.00 0.00 55.06 54.81 1tbr s HIS 131 Cb 0.09 -1.16 -0.09 0.00 1.11 0.00 0.00 32.58 32.53 1tbr s HIS 131 CO 0.07 -0.13 0.91 0.00 -0.85 0.00 0.00 174.74 174.74 1tbr n ALA 132 N 2.98 -0.05 0.00 -1.40 0.00 -1.26 -2.21 120.51 118.57 1tbr n ALA 132 Ca -0.17 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1tbr n ALA 132 Cb 0.53 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1tbr n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tbr n GLY 133 N 1.32 2.80 3.78 0.00 0.00 0.11 -4.93 105.19 108.26 1tbr n GLY 133 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 1tbr n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tbr s PHE 134 N -1.70 3.02 0.05 1.61 0.40 -0.94 -4.65 117.98 115.77 1tbr s PHE 134 Ca 0.00 1.57 0.00 0.00 -0.60 0.00 0.00 56.93 57.91 1tbr s PHE 134 Cb 0.00 -3.28 -0.04 0.00 0.51 0.00 0.00 43.02 40.21 1tbr s PHE 134 CO 0.00 -1.18 0.17 0.15 0.70 0.00 0.00 175.22 175.06 1tbr s LYS 135 N -2.63 3.29 0.46 0.44 1.02 -1.26 -0.67 119.74 120.38 1tbr s LYS 135 Ca 0.61 -0.49 0.03 0.00 0.02 0.00 0.00 55.97 56.15 1tbr s LYS 135 Cb -0.26 -2.96 -0.01 0.00 -0.52 0.00 0.00 37.83 34.07 1tbr s LYS 135 CO 0.32 0.61 0.10 0.20 -0.92 0.00 0.00 175.35 175.66 1tbr s GLY 136 N -2.38 2.83 -0.03 -3.33 0.00 0.34 -4.81 107.32 99.93 1tbr s GLY 136 Ca 0.32 -0.82 0.04 0.00 0.00 0.00 0.00 44.72 44.25 1tbr s GLY 136 CO 0.25 -1.96 -0.14 -1.60 0.00 0.00 0.00 173.10 169.65 1tbr s ARG 137 N -3.74 1.43 -0.02 2.90 3.52 0.19 -1.29 118.95 121.94 1tbr s ARG 137 Ca 0.16 -0.49 0.08 0.00 -0.13 0.00 0.00 55.73 55.34 1tbr s ARG 137 Cb 0.01 -1.28 -0.02 0.00 -1.56 0.00 0.00 34.95 32.10 1tbr s ARG 137 CO 0.10 0.21 -0.25 0.08 -0.81 0.00 0.00 175.30 174.63 1tbr s VAL 138 N 0.05 1.98 0.02 7.11 1.01 -0.32 -0.78 120.40 129.47 1tbr s VAL 138 Ca -0.02 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 60.90 1tbr s VAL 138 Cb -0.10 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 1tbr s VAL 138 CO 0.01 0.56 -0.05 0.42 0.00 0.00 0.00 175.10 176.05 1tbr s THR 139 N -0.59 0.31 -0.03 3.92 -4.23 -1.25 -1.91 115.64 111.86 1tbr s THR 139 Ca 0.10 -0.65 -0.30 0.00 -1.18 0.00 0.00 61.69 59.66 1tbr s THR 139 Cb -0.10 -0.36 0.11 0.00 1.34 0.00 0.00 72.50 73.50 1tbr s THR 139 CO -0.01 -0.23 1.30 -0.83 -0.54 0.00 0.00 174.62 174.32 1tbr s GLY 140 N -0.93 -0.29 -0.16 3.99 0.00 -1.14 -4.55 107.32 104.24 1tbr s GLY 140 Ca -0.07 0.41 0.16 0.00 0.00 0.00 0.00 44.72 45.22 1tbr s GLY 140 CO -0.00 2.76 1.39 0.79 0.00 0.00 0.00 173.10 178.04 1tbr n TRP 141 N -0.69 0.84 -1.46 1.90 8.01 -1.26 -1.90 117.44 122.88 1tbr n TRP 141 Ca -0.03 -0.85 -0.29 0.00 -1.31 0.00 0.00 57.50 55.02 1tbr n TRP 141 Cb 0.61 -0.28 0.13 0.00 -2.01 0.00 0.00 31.31 29.76 1tbr n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1tbr s GLY 142 N -1.89 1.59 0.32 6.99 0.00 -1.26 -4.49 107.32 108.58 1tbr s GLY 142 Ca 0.40 -0.35 -0.27 0.00 0.00 0.00 0.00 44.72 44.50 1tbr s GLY 142 CO 0.09 0.17 0.93 0.70 0.00 0.00 0.00 173.10 174.99 1tbr n ASN 143 N -3.72 0.92 -0.28 1.64 3.02 0.23 -2.10 115.26 114.96 1tbr n ASN 143 Ca 0.07 1.13 0.13 0.00 -0.03 0.00 0.00 54.58 55.88 1tbr n ASN 143 Cb 0.58 -1.26 0.43 0.00 -0.61 0.00 0.00 39.78 38.92 1tbr n ASN 143 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1tbr n ARG 144 N 0.64 1.00 -3.91 3.52 1.74 0.64 0.33 116.66 120.61 1tbr n ARG 144 Ca 0.10 -0.56 -0.10 0.00 -0.77 0.00 0.00 57.85 56.52 1tbr n ARG 144 Cb 0.33 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.22 1tbr n ARG 144 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1tbr s ARG 145 N -2.39 1.20 -0.02 5.56 1.81 -1.26 -4.41 118.95 119.44 1tbr s ARG 145 Ca 0.28 -1.10 -0.15 0.00 -1.72 0.00 0.00 55.73 53.03 1tbr s ARG 145 Cb 0.20 0.41 -0.08 0.00 -0.45 0.00 0.00 34.95 35.02 1tbr s ARG 145 CO 0.48 -0.45 0.71 1.49 -0.68 0.00 0.00 175.30 176.84 1tbr h GLU 146 N 2.48 -0.52 -6.59 3.54 4.81 -1.91 -3.47 114.58 112.92 1tbr h GLU 146 Ca -0.31 0.04 -0.51 0.00 -0.13 0.00 0.00 59.36 58.44 1tbr h GLU 146 Cb 1.23 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.72 1tbr h GLU 146 CO 0.46 -0.35 -0.05 0.99 -0.73 0.00 0.00 179.01 179.33 1tbr s THR 147 N -3.37 4.92 -0.65 0.32 2.01 -1.26 -5.02 115.64 112.59 1tbr s THR 147 Ca -0.08 0.33 -0.08 0.00 0.31 0.00 0.00 61.69 62.17 1tbr s THR 147 Cb 0.01 -3.70 -0.07 0.00 0.01 0.00 0.00 72.50 68.74 1tbr s THR 147 CO 0.24 -0.32 1.82 0.79 -0.69 0.00 0.00 174.62 176.45 1tbr n TRP 148 N -0.85 1.08 0.12 4.92 7.02 -1.26 -4.90 117.44 123.57 1tbr n TRP 148 Ca 0.00 -1.55 0.00 0.00 -1.02 0.00 0.00 57.50 54.93 1tbr n TRP 148 Cb 0.54 -1.40 0.00 0.00 -2.42 0.00 0.00 31.31 28.03 1tbr n TRP 148 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1tbr n THR 149 N 4.79 0.00 -4.31 -0.99 -1.04 -1.26 -5.08 114.28 106.39 1tbr n THR 149 Ca 0.36 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 62.19 1tbr n THR 149 Cb 0.16 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.64 1tbr n THR 149 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1tbr n SER 149 N -3.11 2.66 -0.16 8.00 7.64 -1.26 -5.01 113.62 122.38 1tbr n SER 149 Ca 0.00 -2.23 0.22 0.00 1.01 0.00 0.00 58.87 57.87 1tbr n SER 149 Cb 0.00 0.16 0.62 0.00 -1.01 0.00 0.00 64.21 63.98 1tbr n SER 149 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 1tbr h VAL 149 N 1.05 0.66 -1.45 0.44 -1.51 -2.07 -3.28 116.25 110.09 1tbr h VAL 149 Ca -0.23 -0.06 -0.60 0.00 -1.23 0.00 0.00 66.70 64.57 1tbr h VAL 149 Cb 0.72 0.46 -0.11 0.00 -2.13 0.00 0.00 31.29 30.23 1tbr h VAL 149 CO 0.38 0.03 1.35 0.00 -1.23 0.00 0.00 177.57 178.10 1tbr s ALA 149 N -5.19 2.80 0.60 5.19 0.00 -1.26 -4.98 121.76 118.92 1tbr s ALA 149 Ca -0.06 -2.19 -0.20 0.00 0.00 0.00 0.00 51.96 49.51 1tbr s ALA 149 Cb 0.21 -4.43 -0.03 0.00 0.00 0.00 0.00 23.12 18.88 1tbr s ALA 149 CO 0.77 -3.49 1.31 -1.91 0.00 0.00 0.00 175.76 172.44 1tbr n GLU 149 N 8.66 1.37 0.18 0.00 4.07 -1.24 -4.74 120.64 128.94 1tbr n GLU 149 Ca 0.27 0.52 -0.16 0.00 -0.06 0.00 0.00 57.16 57.73 1tbr n GLU 149 Cb 0.50 -2.54 -0.09 0.00 -0.06 0.00 0.00 31.44 29.26 1tbr n GLU 149 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1tbr h VAL 150 N 0.94 0.09 -3.55 6.31 2.07 -1.90 -3.44 116.25 116.77 1tbr h VAL 150 Ca -0.51 0.00 -0.52 0.00 0.82 0.00 0.00 66.70 66.49 1tbr h VAL 150 Cb 1.33 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1tbr h VAL 150 CO 0.55 0.00 0.32 -1.10 0.02 0.00 0.00 177.57 177.36 1tbr s GLN 151 N -5.88 4.67 0.65 1.57 -0.21 -1.26 -0.26 119.66 118.93 1tbr s GLN 151 Ca -0.17 1.38 -0.14 0.00 0.02 0.00 0.00 55.36 56.45 1tbr s GLN 151 Cb 0.06 -3.37 -0.01 0.00 1.00 0.00 0.00 33.01 30.69 1tbr s GLN 151 CO 0.62 0.25 1.07 -1.25 -2.12 0.00 0.00 175.29 173.86 1tbr s PRO 152 N -0.09 3.01 -0.00 2.91 0.04 -1.26 -4.95 135.00 134.65 1tbr s PRO 152 Ca 0.45 1.19 -0.09 0.00 0.04 0.00 0.00 61.00 62.58 1tbr s PRO 152 Cb -0.23 -1.99 -0.31 0.00 0.04 0.00 0.00 34.50 32.01 1tbr s PRO 152 CO 0.29 -1.06 0.86 0.66 0.04 0.00 0.00 177.00 177.78 1tbr h SER 153 N -0.07 0.60 -2.60 6.66 4.64 -1.96 -3.45 113.55 117.37 1tbr h SER 153 Ca -0.46 -0.77 -0.55 0.00 -0.47 0.00 0.00 61.79 59.54 1tbr h SER 153 Cb 1.22 -0.20 -0.13 0.00 -0.31 0.00 0.00 62.40 62.99 1tbr h SER 153 CO 0.56 1.63 -0.56 0.68 -0.87 0.00 0.00 176.83 178.27 1tbr s VAL 154 N -2.60 1.06 0.18 0.95 -7.23 -1.26 -2.49 120.40 109.02 1tbr s VAL 154 Ca -0.11 -2.00 -0.33 0.00 -1.81 0.00 0.00 61.98 57.73 1tbr s VAL 154 Cb 0.06 -2.57 -0.14 0.00 0.56 0.00 0.00 36.38 34.29 1tbr s VAL 154 CO 0.88 0.00 1.52 -0.11 -0.31 0.00 0.00 175.10 177.08 1tbr n LEU 155 N -0.88 3.07 -4.87 1.32 7.94 0.10 -4.88 117.00 118.79 1tbr n LEU 155 Ca -0.06 1.10 -0.27 0.00 -1.11 0.00 0.00 56.01 55.67 1tbr n LEU 155 Cb 0.66 -1.42 -0.04 0.00 0.53 0.00 0.00 43.42 43.14 1tbr n LEU 155 CO 0.40 -0.37 -0.17 -1.10 -1.11 0.00 0.00 177.39 175.05 1tbr s GLN 156 N 0.47 3.17 0.10 1.96 -1.52 -0.80 -0.77 119.66 122.28 1tbr s GLN 156 Ca 0.75 -0.69 0.06 0.00 -1.95 0.00 0.00 55.36 53.53 1tbr s GLN 156 Cb -0.68 -2.83 -0.03 0.00 -0.22 0.00 0.00 33.01 29.25 1tbr s GLN 156 CO 0.42 0.52 -0.15 0.08 -0.25 0.00 0.00 175.29 175.91 1tbr s VAL 157 N -1.67 1.30 -0.28 1.09 1.01 0.29 -2.91 120.40 119.23 1tbr s VAL 157 Ca 0.33 -1.50 -0.21 0.00 0.00 0.00 0.00 61.98 60.59 1tbr s VAL 157 Cb -0.11 -1.33 0.08 0.00 0.00 0.00 0.00 36.38 35.02 1tbr s VAL 157 CO 0.26 -0.27 0.73 0.54 0.00 0.00 0.00 175.10 176.36 1tbr s VAL 158 N -1.59 0.00 -0.16 2.92 0.11 -0.80 -1.16 120.40 119.72 1tbr s VAL 158 Ca 0.04 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.03 1tbr s VAL 158 Cb -0.08 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.73 1tbr s VAL 158 CO 0.03 0.00 0.03 0.20 -3.33 0.00 0.00 175.10 172.03 1tbr s ASN 159 N 0.93 5.35 0.08 3.54 0.01 -1.26 -1.17 114.94 122.43 1tbr s ASN 159 Ca -0.04 0.04 0.04 0.00 -0.71 0.00 0.00 52.86 52.18 1tbr s ASN 159 Cb -0.05 -1.85 -0.03 0.00 0.41 0.00 0.00 41.25 39.73 1tbr s ASN 159 CO -0.09 0.21 -0.10 -0.76 -1.51 0.00 0.00 177.10 174.85 1tbr s LEU 160 N 0.15 2.35 -0.01 0.60 1.43 -0.41 -4.95 118.68 117.84 1tbr s LEU 160 Ca 0.03 -0.73 -0.22 0.00 -1.03 0.00 0.00 54.13 52.18 1tbr s LEU 160 Cb -0.13 -0.32 -0.05 0.00 0.03 0.00 0.00 46.19 45.73 1tbr s LEU 160 CO 0.01 -0.22 0.63 -2.84 0.23 0.00 0.00 176.35 174.17 1tbr s PRO 161 N -2.39 4.36 0.14 1.29 0.02 -1.26 -0.51 135.00 136.66 1tbr s PRO 161 Ca 0.01 0.80 -0.31 0.00 0.02 0.00 0.00 61.00 61.52 1tbr s PRO 161 Cb -0.05 -3.36 -0.09 0.00 0.02 0.00 0.00 34.50 31.02 1tbr s PRO 161 CO 0.00 0.31 1.45 -0.51 -0.33 0.00 0.00 177.00 177.92 1tbr s LEU 162 N -0.00 4.37 0.14 -5.54 1.43 0.15 -0.77 118.68 118.46 1tbr s LEU 162 Ca 0.33 2.44 0.01 0.00 -1.03 0.00 0.00 54.13 55.88 1tbr s LEU 162 Cb -0.18 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 1tbr s LEU 162 CO 0.18 -0.71 0.29 -0.69 0.23 0.00 0.00 176.35 175.65 1tbr s VAL 163 N 1.04 5.31 0.15 -1.59 1.01 -0.92 0.09 120.40 125.50 1tbr s VAL 163 Ca 0.66 -0.55 -0.31 0.00 0.00 0.00 0.00 61.98 61.78 1tbr s VAL 163 Cb -0.39 -3.72 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 1tbr s VAL 163 CO 0.31 -0.06 1.52 -1.61 0.00 0.00 0.00 175.10 175.26 1tbr s GLU 164 N -3.10 4.24 0.30 2.72 8.01 -1.26 -4.73 118.70 124.89 1tbr s GLU 164 Ca 0.36 2.28 0.06 0.00 0.01 0.00 0.00 54.97 57.68 1tbr s GLU 164 Cb -0.11 -3.18 0.81 0.00 -4.31 0.00 0.00 34.13 27.34 1tbr s GLU 164 CO 0.28 -0.55 1.67 -0.09 0.01 0.00 0.00 175.26 176.58 1tbr h ARG 165 N 6.73 0.29 -0.97 1.61 2.43 -1.97 0.66 114.38 123.17 1tbr h ARG 165 Ca -0.43 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 58.74 1tbr h ARG 165 Cb 1.21 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.64 1tbr h ARG 165 CO 0.90 0.19 0.64 -1.35 -1.51 0.00 0.00 179.97 178.84 1tbr h PRO 166 N 0.30 1.26 -0.62 0.20 0.11 -1.99 -0.23 132.00 131.03 1tbr h PRO 166 Ca 0.60 -0.08 -0.10 0.00 0.11 0.00 0.00 66.00 66.54 1tbr h PRO 166 Cb 1.23 -0.28 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 1tbr h PRO 166 CO -0.60 0.84 0.01 0.28 -0.21 0.00 0.00 178.00 178.32 1tbr h VAL 167 N 1.30 1.27 0.31 3.15 2.07 -1.28 -0.16 116.25 122.90 1tbr h VAL 167 Ca 0.36 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1tbr h VAL 167 Cb -0.14 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1tbr h VAL 167 CO -0.08 0.42 -0.18 0.00 0.02 0.00 0.00 177.57 177.75 1tbr h LYS 169 N -0.47 -0.03 0.00 0.00 3.64 -0.90 -2.00 116.57 116.82 1tbr h LYS 169 Ca -0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1tbr h LYS 169 Cb 0.38 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1tbr h LYS 169 CO 0.04 -0.02 0.01 0.00 -2.27 0.00 0.00 179.45 177.22 1tbr h ALA 170 N 1.09 1.01 0.01 5.00 0.00 -0.97 -2.85 119.26 122.56 1tbr h ALA 170 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 1tbr h ALA 170 Cb 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1tbr h ALA 170 CO -0.14 -0.01 -0.93 0.66 0.00 0.00 0.00 179.25 178.82 1tbr h SER 171 N 0.00 0.07 -2.57 0.00 4.64 -0.81 -3.46 113.55 111.41 1tbr h SER 171 Ca 0.00 -0.06 -0.61 0.00 -0.47 0.00 0.00 61.79 60.65 1tbr h SER 171 Cb 0.03 -0.02 -0.14 0.00 -0.31 0.00 0.00 62.40 61.96 1tbr h SER 171 CO 0.00 0.95 -0.74 0.42 -0.87 0.00 0.00 176.83 176.59 1tbr s THR 172 N -2.95 2.77 -2.28 2.95 -4.23 -1.08 -4.87 115.64 105.96 1tbr s THR 172 Ca -0.00 -2.09 0.23 0.00 -1.18 0.00 0.00 61.69 58.64 1tbr s THR 172 Cb 0.10 -2.42 0.51 0.00 1.34 0.00 0.00 72.50 72.03 1tbr s THR 172 CO 0.81 -0.28 1.65 -1.14 -0.54 0.00 0.00 174.62 175.12 1tbr n ARG 173 N -0.36 1.59 -3.53 3.99 0.63 -1.26 -4.90 116.66 112.82 1tbr n ARG 173 Ca -0.08 -0.88 -0.24 0.00 -0.92 0.00 0.00 57.85 55.73 1tbr n ARG 173 Cb 0.58 -1.41 -0.02 0.00 0.45 0.00 0.00 32.46 32.07 1tbr n ARG 173 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1tbr s ILE 174 N -1.87 5.14 -0.78 5.15 -1.09 -1.26 -5.03 121.20 121.46 1tbr s ILE 174 Ca 0.34 -0.52 -0.25 0.00 -2.23 0.00 0.00 60.65 57.99 1tbr s ILE 174 Cb 0.18 -3.84 0.05 0.00 -1.58 0.00 0.00 42.46 37.27 1tbr s ILE 174 CO 0.28 -0.45 1.22 -0.60 -1.23 0.00 0.00 174.94 174.16 1tbr s ARG 175 N -4.08 3.26 0.79 2.79 3.52 -1.26 -5.01 118.95 118.97 1tbr s ARG 175 Ca 0.39 -0.64 -0.11 0.00 -0.13 0.00 0.00 55.73 55.24 1tbr s ARG 175 Cb -0.10 -4.44 0.07 0.00 -1.56 0.00 0.00 34.95 28.92 1tbr s ARG 175 CO 0.33 -2.05 1.09 0.42 -0.81 0.00 0.00 175.30 174.28 1tbr s ILE 176 N 5.00 3.24 0.12 4.11 -1.09 -1.26 -4.85 121.20 126.46 1tbr s ILE 176 Ca 0.34 0.40 0.03 0.00 -2.23 0.00 0.00 60.65 59.18 1tbr s ILE 176 Cb -0.09 -2.91 -0.01 0.00 -1.58 0.00 0.00 42.46 37.87 1tbr s ILE 176 CO 0.08 -0.53 0.09 0.35 -1.23 0.00 0.00 174.94 173.71 1tbr n THR 177 N -3.57 0.00 1.22 2.92 -2.24 -1.26 -5.04 114.28 106.31 1tbr n THR 177 Ca 0.08 -0.87 0.13 0.00 -2.27 0.00 0.00 64.05 61.13 1tbr n THR 177 Cb 0.54 0.42 0.48 0.00 -2.10 0.00 0.00 70.33 69.66 1tbr n THR 177 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1tbr n ASP 178 N -2.44 0.52 -1.88 3.42 9.92 -1.26 -3.64 116.55 121.18 1tbr n ASP 178 Ca 0.02 -0.41 -0.04 0.00 -0.53 0.00 0.00 54.79 53.83 1tbr n ASP 178 Cb 0.22 -0.02 0.28 0.00 -0.64 0.00 0.00 41.12 40.96 1tbr n ASP 178 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1tbr n ASN 179 N -1.10 4.64 -3.71 -2.24 3.02 -1.26 -4.86 115.26 109.74 1tbr n ASN 179 Ca 0.11 -3.06 -0.14 0.00 -0.03 0.00 0.00 54.58 51.45 1tbr n ASN 179 Cb 0.31 -0.72 -0.08 0.00 -0.61 0.00 0.00 39.78 38.68 1tbr n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tbr s MET 180 N -2.72 0.72 0.22 3.52 0.23 -1.24 -1.24 119.30 118.80 1tbr s MET 180 Ca 0.50 -0.03 0.02 0.00 -1.03 0.00 0.00 55.69 55.14 1tbr s MET 180 Cb 0.39 0.33 -0.05 0.00 -1.53 0.00 0.00 34.83 33.97 1tbr s MET 180 CO 0.12 -0.20 0.05 -0.59 -2.03 0.00 0.00 175.02 172.38 1tbr s PHE 181 N -1.15 1.40 0.13 3.16 -0.12 -0.29 -4.80 117.98 116.31 1tbr s PHE 181 Ca -0.12 -1.09 0.07 0.00 -0.05 0.00 0.00 56.93 55.74 1tbr s PHE 181 Cb -0.04 -0.81 -0.04 0.00 -0.63 0.00 0.00 43.02 41.50 1tbr s PHE 181 CO 0.05 -0.26 -0.16 0.00 -0.05 0.00 0.00 175.22 174.80 1tbr s ALA 183 N -1.94 -0.48 0.00 0.00 0.00 -0.83 -2.16 121.76 116.36 1tbr s ALA 183 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.94 1tbr s ALA 183 Cb -0.06 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.30 1tbr s ALA 183 CO 0.04 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.87 1tbr n GLY 184 N 0.84 -0.68 3.92 0.00 0.00 0.05 -2.72 105.19 106.60 1tbr n GLY 184 Ca -0.20 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 43.83 1tbr n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tbr s TYR 184 N -1.45 3.52 0.46 1.61 2.02 -1.26 -4.35 117.35 117.89 1tbr s TYR 184 Ca 0.00 0.25 -0.14 0.00 -0.37 0.00 0.00 57.07 56.80 1tbr s TYR 184 Cb 0.00 -1.76 -0.08 0.00 -0.40 0.00 0.00 41.96 39.73 1tbr s TYR 184 CO 0.00 0.59 0.89 0.15 -1.57 0.00 0.00 175.55 175.60 1tbr s LYS 185 N -2.52 3.91 0.90 -0.62 1.02 -1.26 -4.77 119.74 116.39 1tbr s LYS 185 Ca 0.35 0.77 -0.10 0.00 0.02 0.00 0.00 55.97 57.00 1tbr s LYS 185 Cb -0.13 -2.25 0.14 0.00 -0.52 0.00 0.00 37.83 35.07 1tbr s LYS 185 CO 0.28 -0.14 1.16 -2.14 -0.92 0.00 0.00 175.35 173.58 1tbr s PRO 186 N -3.86 1.08 0.00 -1.68 0.02 -1.26 -2.71 135.00 126.60 1tbr s PRO 186 Ca 0.56 1.58 0.00 0.00 0.02 0.00 0.00 61.00 63.16 1tbr s PRO 186 Cb -0.10 -1.73 0.00 0.00 0.02 0.00 0.00 34.50 32.69 1tbr s PRO 186 CO 0.29 -2.59 0.00 0.41 -0.33 0.00 0.00 177.00 174.78 1tbr n GLY 186 N 0.25 2.38 0.29 0.52 0.00 -1.26 -4.77 105.19 102.60 1tbr n GLY 186 Ca 0.12 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.31 1tbr n GLY 186 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1tbr h GLU 186 N 0.93 0.00 -0.20 1.61 5.08 -1.91 -3.46 114.58 116.63 1tbr h GLU 186 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1tbr h GLU 186 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1tbr h GLU 186 CO 0.00 0.06 -0.08 0.41 -1.00 0.00 0.00 179.01 178.40 1tbr n GLY 186 N -0.55 0.70 3.10 -3.84 0.00 -1.26 -5.01 105.19 98.32 1tbr n GLY 186 Ca -0.01 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 1tbr n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tbr s LYS 186 N -1.96 1.98 0.26 1.61 1.02 -1.26 -5.15 119.74 116.24 1tbr s LYS 186 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.43 1tbr s LYS 186 Cb 0.00 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.70 1tbr s LYS 186 CO 0.00 0.12 0.03 0.54 -0.92 0.00 0.00 175.35 175.13 1tbr n ARG 187 N 3.55 1.34 0.00 1.68 1.74 -1.26 -4.72 116.66 118.98 1tbr n ARG 187 Ca -0.21 -1.83 0.00 0.00 -0.77 0.00 0.00 57.85 55.05 1tbr n ARG 187 Cb 0.52 0.44 0.00 0.00 -1.02 0.00 0.00 32.46 32.41 1tbr n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1tbr n GLY 188 N 1.93 4.33 3.65 -0.13 0.00 -1.26 -4.95 105.19 108.76 1tbr n GLY 188 Ca -0.09 -1.18 -0.04 0.00 0.00 0.00 0.00 46.02 44.71 1tbr n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tbr s ASP 189 N 0.00 -0.20 0.92 1.61 2.15 -1.03 -4.74 116.67 115.38 1tbr s ASP 189 Ca 0.00 -0.22 -0.14 0.00 0.43 0.00 0.00 52.55 52.62 1tbr s ASP 189 Cb 0.00 0.37 0.18 0.00 -0.30 0.00 0.00 42.92 43.17 1tbr s ASP 189 CO 0.00 -0.66 1.27 0.00 -0.17 0.00 0.00 175.17 175.61 1tbr s ALA 190 N -3.01 2.44 0.25 3.66 0.00 -1.26 -0.97 121.76 122.87 1tbr s ALA 190 Ca 0.11 -1.20 -0.19 0.00 0.00 0.00 0.00 51.96 50.68 1tbr s ALA 190 Cb -0.00 -2.71 0.07 0.00 0.00 0.00 0.00 23.12 20.48 1tbr s ALA 190 CO -0.02 -2.26 0.92 0.00 0.00 0.00 0.00 175.76 174.40 1tbr n GLU 192 N -0.64 2.29 0.00 0.00 4.71 -1.26 -0.90 120.64 124.85 1tbr n GLU 192 Ca -0.04 0.83 0.00 0.00 -0.01 0.00 0.00 57.16 57.94 1tbr n GLU 192 Cb 0.57 -2.67 0.00 0.00 -1.01 0.00 0.00 31.44 28.33 1tbr n GLU 192 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1tbr n GLY 193 N 4.03 2.34 0.07 0.62 0.00 -1.26 -0.60 105.19 110.38 1tbr n GLY 193 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1tbr n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tbr n ASP 194 N 0.00 0.70 -4.45 1.61 8.00 -0.07 -3.59 116.55 118.75 1tbr n ASP 194 Ca 0.00 0.15 -0.36 0.00 0.71 0.00 0.00 54.79 55.29 1tbr n ASP 194 Cb 0.00 0.06 0.07 0.00 -0.02 0.00 0.00 41.12 41.23 1tbr n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1tbr n SER 195 N -2.09 -1.37 0.00 -2.24 7.64 -1.26 -1.80 113.62 112.50 1tbr n SER 195 Ca 0.04 0.57 0.00 0.00 1.01 0.00 0.00 58.87 60.49 1tbr n SER 195 Cb 0.43 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1tbr n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tbr n GLY 196 N 1.69 2.75 3.72 0.23 0.00 -0.77 -0.39 105.19 112.41 1tbr n GLY 196 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1tbr n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tbr s GLY 197 N -0.77 2.13 0.47 -0.02 0.00 -0.74 -3.34 107.32 105.05 1tbr s GLY 197 Ca 0.00 0.72 -0.11 0.00 0.00 0.00 0.00 44.72 45.33 1tbr s GLY 197 CO 0.00 1.12 0.85 2.56 0.00 0.00 0.00 173.10 177.63 1tbr s PRO 198 N -4.17 3.74 -0.29 2.90 0.04 -1.26 -0.96 135.00 135.00 1tbr s PRO 198 Ca 0.71 0.56 0.03 0.00 0.04 0.00 0.00 61.00 62.34 1tbr s PRO 198 Cb -0.26 -2.29 0.08 0.00 0.04 0.00 0.00 34.50 32.07 1tbr s PRO 198 CO 0.48 -0.19 -0.04 0.12 0.04 0.00 0.00 177.00 177.42 1tbr s PHE 199 N -2.61 3.38 0.34 0.56 2.19 -0.84 -3.93 117.98 117.07 1tbr s PHE 199 Ca 0.53 -2.56 0.08 0.00 0.33 0.00 0.00 56.93 55.31 1tbr s PHE 199 Cb -0.10 -2.31 -0.04 0.00 -1.31 0.00 0.00 43.02 39.25 1tbr s PHE 199 CO 0.37 -0.90 0.14 0.14 1.83 0.00 0.00 175.22 176.80 1tbr s VAL 200 N 1.05 3.03 0.00 3.12 -7.23 0.04 -0.96 120.40 119.45 1tbr s VAL 200 Ca -0.00 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.42 1tbr s VAL 200 Cb -0.19 -2.98 -0.00 0.00 0.56 0.00 0.00 36.38 33.77 1tbr s VAL 200 CO -0.07 -0.18 0.10 -0.04 -0.31 0.00 0.00 175.10 174.60 1tbr s MET 201 N -3.84 0.40 -0.29 4.82 -1.94 -0.61 0.57 119.30 118.40 1tbr s MET 201 Ca 0.38 -0.37 -0.08 0.00 -1.71 0.00 0.00 55.69 53.90 1tbr s MET 201 Cb -0.02 0.16 -0.01 0.00 2.01 0.00 0.00 34.83 36.97 1tbr s MET 201 CO 0.23 -0.09 0.11 0.21 -0.01 0.00 0.00 175.02 175.47 1tbr s LYS 202 N -1.20 3.38 0.19 2.03 2.20 -1.26 -0.70 119.74 124.39 1tbr s LYS 202 Ca -0.13 -0.67 -0.31 0.00 -0.36 0.00 0.00 55.97 54.50 1tbr s LYS 202 Cb -0.07 -3.45 -0.10 0.00 -1.51 0.00 0.00 37.83 32.70 1tbr s LYS 202 CO 0.01 -0.35 1.47 0.45 -0.36 0.00 0.00 175.35 176.56 1tbr s SER 203 N 1.59 6.68 0.00 1.43 0.15 -0.07 -4.88 113.70 118.60 1tbr s SER 203 Ca 0.05 2.57 0.30 0.00 0.70 0.00 0.00 55.95 59.57 1tbr s SER 203 Cb -0.16 -2.60 1.55 0.00 -1.71 0.00 0.00 66.02 63.09 1tbr s SER 203 CO 0.05 -0.72 2.04 -2.65 1.20 0.00 0.00 173.24 173.15 1tbr n PRO 204 N 3.23 1.00 -0.06 5.44 -0.02 -1.26 -1.50 135.00 141.83 1tbr n PRO 204 Ca 0.10 -0.24 -0.21 0.00 -2.02 0.00 0.00 63.50 61.13 1tbr n PRO 204 Cb 0.40 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.26 1tbr n PRO 204 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1tbr n TYR 204 N -0.79 0.82 0.12 6.00 4.01 -1.26 -4.59 117.16 121.47 1tbr n TYR 204 Ca 0.20 0.21 0.01 0.00 -0.16 0.00 0.00 57.90 58.16 1tbr n TYR 204 Cb 0.21 -1.10 0.01 0.00 -0.31 0.00 0.00 39.34 38.14 1tbr n TYR 204 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1tbr n ASN 204 N -3.65 1.02 -1.01 7.72 0.23 -1.25 -5.02 115.26 113.29 1tbr n ASN 204 Ca -0.37 -1.01 -0.13 0.00 -0.53 0.00 0.00 54.58 52.54 1tbr n ASN 204 Cb 0.96 0.20 -0.06 0.00 -2.08 0.00 0.00 39.78 38.81 1tbr n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1tbr n ASN 205 N -0.09 -4.62 -4.98 0.53 5.15 -0.57 -5.01 115.26 105.68 1tbr n ASN 205 Ca 0.01 0.33 -0.19 0.00 -0.60 0.00 0.00 54.58 54.13 1tbr n ASN 205 Cb 0.07 -3.28 -0.01 0.00 -0.53 0.00 0.00 39.78 36.03 1tbr n ASN 205 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1tbr s ARG 206 N -3.10 3.04 -0.18 1.20 0.52 -1.25 -4.84 118.95 114.34 1tbr s ARG 206 Ca 0.00 -1.07 -0.09 0.00 -0.52 0.00 0.00 55.73 54.05 1tbr s ARG 206 Cb 0.00 -2.78 -0.05 0.00 0.52 0.00 0.00 34.95 32.64 1tbr s ARG 206 CO 0.00 0.02 0.13 -1.58 0.02 0.00 0.00 175.30 173.89 1tbr s TRP 207 N -2.21 3.44 0.06 -0.53 0.52 -1.26 -0.89 118.94 118.07 1tbr s TRP 207 Ca 0.46 0.36 0.09 0.00 0.02 0.00 0.00 56.10 57.03 1tbr s TRP 207 Cb -0.09 -2.11 -0.03 0.00 -1.15 0.00 0.00 33.47 30.09 1tbr s TRP 207 CO 0.31 0.38 -0.24 0.71 0.02 0.00 0.00 176.95 178.13 1tbr s TYR 208 N 0.05 2.39 -0.27 -1.98 1.51 0.13 -1.88 117.35 117.29 1tbr s TYR 208 Ca 0.09 -0.36 -0.13 0.00 -1.01 0.00 0.00 57.07 55.66 1tbr s TYR 208 Cb -0.11 -1.39 -0.04 0.00 -0.11 0.00 0.00 41.96 40.31 1tbr s TYR 208 CO -0.01 0.20 0.31 -1.14 -1.11 0.00 0.00 175.55 173.80 1tbr s GLN 209 N -1.45 3.99 -0.19 -0.62 0.74 0.30 -1.57 119.66 120.85 1tbr s GLN 209 Ca 0.13 -0.10 0.06 0.00 0.05 0.00 0.00 55.36 55.50 1tbr s GLN 209 Cb -0.10 -3.66 -0.16 0.00 1.10 0.00 0.00 33.01 30.19 1tbr s GLN 209 CO 0.04 -0.24 -0.10 -1.33 -0.55 0.00 0.00 175.29 173.10 1tbr n MET 210 N 5.23 0.80 -4.53 1.67 2.81 -0.14 -4.04 117.12 118.94 1tbr n MET 210 Ca -0.10 0.08 -0.26 0.00 -1.81 0.00 0.00 57.70 55.60 1tbr n MET 210 Cb 0.51 -1.41 -0.08 0.00 -0.71 0.00 0.00 33.22 31.53 1tbr n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1tbr s GLY 211 N -5.66 2.68 -0.04 3.03 0.00 -0.89 -1.58 107.32 104.86 1tbr s GLY 211 Ca -0.21 -1.16 -0.02 0.00 0.00 0.00 0.00 44.72 43.33 1tbr s GLY 211 CO 0.54 -1.84 0.07 -0.42 0.00 0.00 0.00 173.10 171.45 1tbr s ILE 212 N -3.18 -0.11 0.31 0.90 1.01 -1.20 -1.98 121.20 116.95 1tbr s ILE 212 Ca 0.22 0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.92 1tbr s ILE 212 Cb 0.02 -0.15 -0.13 0.00 0.01 0.00 0.00 42.46 42.21 1tbr s ILE 212 CO 0.15 0.14 1.25 0.52 0.00 0.00 0.00 174.94 177.00 1tbr n VAL 213 N 4.86 1.78 0.00 2.92 0.31 -0.13 -1.45 118.33 126.61 1tbr n VAL 213 Ca -0.13 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1tbr n VAL 213 Cb 0.50 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 1tbr n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1tbr n SER 214 N 1.15 0.00 -3.24 4.52 2.88 -0.98 -1.86 113.62 116.09 1tbr n SER 214 Ca 0.07 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.50 1tbr n SER 214 Cb 0.34 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.79 1tbr n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1tbr s TRP 215 N -1.00 0.52 -0.05 0.66 1.48 -0.93 -4.89 118.94 114.73 1tbr s TRP 215 Ca 0.00 -0.96 -0.30 0.00 -1.06 0.00 0.00 56.10 53.78 1tbr s TRP 215 Cb 0.00 0.37 0.10 0.00 -1.16 0.00 0.00 33.47 32.78 1tbr s TRP 215 CO 0.00 -1.30 1.33 0.20 -4.06 0.00 0.00 176.95 173.12 1tbr s GLY 216 N -3.12 -0.20 -0.54 3.67 0.00 -1.26 -0.72 107.32 105.13 1tbr s GLY 216 Ca 0.22 0.18 -0.06 0.00 0.00 0.00 0.00 44.72 45.06 1tbr s GLY 216 CO 0.15 5.54 0.39 -0.54 0.00 0.00 0.00 173.10 178.63 1tbr s GLU 217 N -2.03 2.51 0.64 2.90 2.02 -1.26 -4.98 118.70 118.50 1tbr s GLU 217 Ca 0.29 -2.10 0.00 0.00 0.02 0.00 0.00 54.97 53.18 1tbr s GLU 217 Cb 0.01 -3.83 0.00 0.00 0.10 0.00 0.00 34.13 30.40 1tbr s GLU 217 CO -0.02 -1.17 0.00 0.41 0.02 0.00 0.00 175.26 174.50 1tbr n GLY 219 N 4.27 -2.01 3.16 -1.39 0.00 -1.26 -4.60 105.19 103.35 1tbr n GLY 219 Ca 0.01 -1.39 -0.33 0.00 0.00 0.00 0.00 46.02 44.31 1tbr n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tbr n ASP 221 N 4.37 -1.68 -4.86 0.00 2.03 -1.26 -4.82 116.55 110.33 1tbr n ASP 221 Ca -0.20 -0.76 -0.34 0.00 0.52 0.00 0.00 54.79 54.01 1tbr n ASP 221 Cb 0.51 -4.40 -0.05 0.00 -0.72 0.00 0.00 41.12 36.45 1tbr n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1tbr s ARG 221 N -5.74 3.83 0.11 -0.67 1.81 -1.26 -4.97 118.95 112.06 1tbr s ARG 221 Ca 0.03 0.28 -0.31 0.00 -1.72 0.00 0.00 55.73 54.01 1tbr s ARG 221 Cb -0.01 -2.84 -0.08 0.00 -0.45 0.00 0.00 34.95 31.57 1tbr s ARG 221 CO 0.79 0.44 1.37 -0.51 -0.68 0.00 0.00 175.30 176.71 1tbr s ASP 222 N -2.01 6.85 0.00 0.23 1.01 -1.26 -2.67 116.67 118.82 1tbr s ASP 222 Ca 0.40 2.30 0.00 0.00 0.71 0.00 0.00 52.55 55.96 1tbr s ASP 222 Cb -0.13 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1tbr s ASP 222 CO 0.20 -0.63 0.00 0.61 0.21 0.00 0.00 175.17 175.56 1tbr n GLY 223 N 3.41 2.14 3.75 0.21 0.00 -1.26 -5.00 105.19 108.44 1tbr n GLY 223 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1tbr n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tbr s LYS 224 N -0.31 2.87 0.36 1.61 -0.14 -1.09 -4.75 119.74 118.29 1tbr s LYS 224 Ca 0.00 -0.63 0.05 0.00 -1.36 0.00 0.00 55.97 54.03 1tbr s LYS 224 Cb 0.00 -2.73 -0.07 0.00 -1.68 0.00 0.00 37.83 33.35 1tbr s LYS 224 CO 0.00 0.60 0.03 0.71 -0.76 0.00 0.00 175.35 175.92 1tbr s TYR 225 N -1.26 2.21 -0.11 3.18 1.51 -1.26 -4.61 117.35 117.01 1tbr s TYR 225 Ca 0.25 -0.80 -0.05 0.00 -1.01 0.00 0.00 57.07 55.45 1tbr s TYR 225 Cb -0.12 -1.49 -0.04 0.00 -0.11 0.00 0.00 41.96 40.21 1tbr s TYR 225 CO 0.17 0.23 0.08 0.20 -1.11 0.00 0.00 175.55 175.12 1tbr s GLY 226 N -3.58 2.02 -0.14 0.71 0.00 -1.10 -4.44 107.32 100.78 1tbr s GLY 226 Ca 0.35 -0.71 -0.07 0.00 0.00 0.00 0.00 44.72 44.29 1tbr s GLY 226 CO 0.16 -0.41 0.11 -1.36 0.00 0.00 0.00 173.10 171.61 1tbr s PHE 227 N -0.83 3.47 0.05 1.90 0.40 0.10 -1.96 117.98 121.11 1tbr s PHE 227 Ca 0.13 0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.93 1tbr s PHE 227 Cb -0.12 -1.98 -0.03 0.00 0.51 0.00 0.00 43.02 41.41 1tbr s PHE 227 CO 0.03 0.55 -0.21 0.71 0.70 0.00 0.00 175.22 177.00 1tbr s TYR 228 N -0.57 1.84 0.41 0.36 1.51 -0.19 -2.20 117.35 118.52 1tbr s TYR 228 Ca 0.12 -0.38 -0.26 0.00 -1.01 0.00 0.00 57.07 55.54 1tbr s TYR 228 Cb -0.12 -1.09 -0.08 0.00 -0.11 0.00 0.00 41.96 40.56 1tbr s TYR 228 CO 0.02 0.10 1.28 0.99 -1.11 0.00 0.00 175.55 176.84 1tbr s THR 229 N -0.83 2.67 -0.61 -0.71 2.01 -0.53 -1.14 115.64 116.51 1tbr s THR 229 Ca 0.08 0.59 -0.24 0.00 0.31 0.00 0.00 61.69 62.43 1tbr s THR 229 Cb -0.09 -3.34 0.05 0.00 0.01 0.00 0.00 72.50 69.13 1tbr s THR 229 CO 0.02 0.07 0.98 -2.28 -0.69 0.00 0.00 174.62 172.72 1tbr s HIS 230 N -1.29 2.70 0.00 4.92 2.46 -0.37 -3.23 115.29 120.48 1tbr s HIS 230 Ca 0.58 -0.22 -0.25 0.00 0.47 0.00 0.00 55.06 55.64 1tbr s HIS 230 Cb -0.37 -4.20 -0.18 0.00 -0.13 0.00 0.00 32.58 27.69 1tbr s HIS 230 CO 0.47 -1.53 1.31 0.28 -2.47 0.00 0.00 174.74 172.80 1tbr h VAL 231 N 6.00 1.10 -0.69 0.89 2.07 -1.63 -3.20 116.25 120.80 1tbr h VAL 231 Ca -0.27 -0.82 0.12 0.00 0.82 0.00 0.00 66.70 66.55 1tbr h VAL 231 Cb 1.07 1.62 -0.09 0.00 -1.52 0.00 0.00 31.29 32.38 1tbr h VAL 231 CO 1.14 0.20 0.26 0.15 0.02 0.00 0.00 177.57 179.34 1tbr h PHE 232 N -0.52 0.45 -0.61 1.57 3.57 -1.86 -1.74 116.94 117.80 1tbr h PHE 232 Ca -0.01 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1tbr h PHE 232 Cb 0.42 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.01 1tbr h PHE 232 CO 0.05 0.08 0.28 0.00 -2.23 0.00 0.00 178.31 176.48 1tbr h ARG 233 N 0.42 0.49 -0.05 1.11 3.08 -1.94 -1.99 114.38 115.50 1tbr h ARG 233 Ca 0.36 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1tbr h ARG 233 Cb 0.51 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1tbr h ARG 233 CO -0.36 0.32 0.00 1.28 -1.07 0.00 0.00 179.97 180.14 1tbr n LEU 234 N -4.92 0.30 0.33 3.04 4.77 -0.68 -4.21 117.00 115.63 1tbr n LEU 234 Ca 0.08 -0.14 0.20 0.00 -0.03 0.00 0.00 56.01 56.12 1tbr n LEU 234 Cb 0.23 -0.03 1.12 0.00 -2.33 0.00 0.00 43.42 42.40 1tbr n LEU 234 CO 0.25 0.07 1.17 0.50 -1.33 0.00 0.00 177.39 178.05 1tbr h LYS 235 N 0.34 0.00 -0.52 3.23 3.64 -1.10 -2.04 116.57 120.12 1tbr h LYS 235 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1tbr h LYS 235 Cb 0.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1tbr h LYS 235 CO 0.00 0.00 -0.05 0.87 -2.27 0.00 0.00 179.45 178.00 1tbr h LYS 236 N 0.00 0.93 -0.15 1.90 1.79 -1.82 -2.21 116.57 117.00 1tbr h LYS 236 Ca -0.00 -0.30 -0.08 0.00 -2.18 0.00 0.00 60.65 58.09 1tbr h LYS 236 Cb 0.01 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1tbr h LYS 236 CO 0.00 0.95 -0.24 2.35 -1.08 0.00 0.00 179.45 181.43 1tbr h TRP 237 N 0.84 0.52 -0.25 -1.35 7.01 -1.71 -1.18 115.95 119.84 1tbr h TRP 237 Ca 0.15 -0.18 0.06 0.00 2.11 0.00 0.00 58.89 61.03 1tbr h TRP 237 Cb 0.57 -0.10 -0.06 0.00 -2.10 0.00 0.00 29.16 27.47 1tbr h TRP 237 CO 0.03 0.86 -0.16 0.82 -2.79 0.00 0.00 178.44 177.21 1tbr h ILE 238 N 0.03 0.54 0.05 2.65 2.04 -1.48 0.55 117.51 121.90 1tbr h ILE 238 Ca 0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 1tbr h ILE 238 Cb 0.82 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1tbr h ILE 238 CO 0.05 0.00 -0.03 -0.61 0.00 0.00 0.00 178.15 177.57 1tbr h GLN 239 N -0.14 -0.07 -0.52 2.37 4.15 -1.38 -0.06 115.11 119.46 1tbr h GLN 239 Ca 0.14 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.64 1tbr h GLN 239 Cb 0.35 0.02 -0.10 0.00 0.21 0.00 0.00 27.48 27.96 1tbr h GLN 239 CO -0.33 -0.05 -0.47 -0.22 -1.93 0.00 0.00 178.83 175.83 1tbr h LYS 240 N -0.07 -0.27 0.23 1.69 3.64 -0.62 0.41 116.57 121.57 1tbr h LYS 240 Ca -0.00 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1tbr h LYS 240 Cb 0.06 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1tbr h LYS 240 CO 0.00 -0.18 -0.14 0.28 -2.27 0.00 0.00 179.45 177.14 1tbr h VAL 241 N -0.28 0.69 0.26 2.00 2.07 -0.55 0.87 116.25 121.32 1tbr h VAL 241 Ca 0.15 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1tbr h VAL 241 Cb 0.57 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1tbr h VAL 241 CO -0.65 0.00 -0.12 0.40 0.02 0.00 0.00 177.57 177.21 1tbr h ILE 242 N -0.37 0.80 0.07 4.57 2.04 -0.65 -3.36 117.51 120.61 1tbr h ILE 242 Ca -0.02 -0.46 -0.28 0.00 1.00 0.00 0.00 64.86 65.10 1tbr h ILE 242 Cb 0.31 1.05 0.02 0.00 -0.74 0.00 0.00 36.82 37.46 1tbr h ILE 242 CO 0.02 0.10 -1.15 0.44 0.00 0.00 0.00 178.15 177.56 1tbr h ASP 243 N -0.59 0.78 -0.33 1.72 5.19 -0.98 -3.38 116.42 118.84 1tbr h ASP 243 Ca -0.04 -0.69 -0.71 0.00 -0.62 0.00 0.00 57.03 54.98 1tbr h ASP 243 Cb 0.43 -0.24 -0.06 0.00 0.18 0.00 0.00 39.33 39.63 1tbr h ASP 243 CO 0.06 1.50 2.82 -1.14 -3.12 0.00 0.00 179.24 179.36 1tbr n ARG 244 N -3.77 2.99 0.00 3.56 0.63 0.30 -4.10 116.66 116.27 1tbr n ARG 244 Ca -0.11 -2.84 0.00 0.00 -0.92 0.00 0.00 57.85 53.98 1tbr n ARG 244 Cb 0.94 -3.31 0.00 0.00 0.45 0.00 0.00 32.46 30.54 1tbr n ARG 244 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1tbr n LEU 245 N 6.48 0.00 -4.69 6.15 4.77 -1.26 -4.79 117.00 123.66 1tbr n LEU 245 Ca 0.50 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 56.06 1tbr n LEU 245 Cb 0.41 0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1tbr n LEU 245 CO 0.86 -0.18 0.89 -0.83 -1.33 0.00 0.00 177.39 176.80 1tbr s GLY 246 N -1.23 2.17 0.00 -0.72 0.00 -1.26 -5.22 107.32 101.07 1tbr s GLY 246 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.23 1tbr s GLY 246 CO 0.00 2.10 0.00 -1.26 0.00 0.00 0.00 173.10 173.94