#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lo4 s LEU 2 N 0.00 4.39 -0.20 -1.84 1.43 -1.26 -3.80 118.68 117.40 1lo4 s LEU 2 Ca 0.00 2.47 -0.18 0.00 -1.03 0.00 0.00 54.13 55.39 1lo4 s LEU 2 Cb 0.00 -3.60 0.05 0.00 0.03 0.00 0.00 46.19 42.67 1lo4 s LEU 2 CO 0.00 -0.65 0.53 -0.75 0.23 0.00 0.00 176.35 175.71 1lo4 s LYS 3 N 0.35 0.61 -0.03 1.70 2.20 0.16 -4.98 119.74 119.74 1lo4 s LYS 3 Ca 0.61 0.75 0.02 0.00 -0.36 0.00 0.00 55.97 56.99 1lo4 s LYS 3 Cb -0.39 0.28 0.01 0.00 -1.51 0.00 0.00 37.83 36.22 1lo4 s LYS 3 CO 0.36 -0.08 -0.06 -0.51 -0.36 0.00 0.00 175.35 174.70 1lo4 s LEU 4 N 0.38 1.59 -0.10 5.43 1.43 -1.26 0.28 118.68 126.42 1lo4 s LEU 4 Ca -0.01 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 1lo4 s LEU 4 Cb -0.04 -0.44 0.02 0.00 0.03 0.00 0.00 46.19 45.76 1lo4 s LEU 4 CO -0.01 0.00 -0.10 -0.69 0.23 0.00 0.00 176.35 175.78 1lo4 s VAL 5 N 0.51 1.16 -0.08 -1.59 1.01 -0.67 -4.18 120.40 116.56 1lo4 s VAL 5 Ca -0.07 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.38 1lo4 s VAL 5 Cb -0.11 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.11 1lo4 s VAL 5 CO 0.00 0.38 0.30 -1.61 0.00 0.00 0.00 175.10 174.17 1lo4 s GLU 6 N 1.33 3.89 0.07 2.72 8.01 -1.26 -1.05 118.70 132.42 1lo4 s GLU 6 Ca -0.01 0.16 -0.00 0.00 0.01 0.00 0.00 54.97 55.13 1lo4 s GLU 6 Cb -0.14 -3.28 -0.04 0.00 -4.31 0.00 0.00 34.13 26.37 1lo4 s GLU 6 CO -0.05 0.57 -0.04 0.95 0.01 0.00 0.00 175.26 176.71 1lo4 s THR 7 N -0.57 0.39 0.00 3.63 -4.23 0.43 -4.68 115.64 110.60 1lo4 s THR 7 Ca 0.19 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1lo4 s THR 7 Cb -0.14 -1.60 0.00 0.00 1.34 0.00 0.00 72.50 72.10 1lo4 s THR 7 CO 0.08 -0.93 0.00 0.61 -0.54 0.00 0.00 174.62 173.83 1lo4 n GLY 8 N 0.05 0.56 3.65 3.99 0.00 -1.26 -1.32 105.19 110.86 1lo4 n GLY 8 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1lo4 n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lo4 n GLY 9 N -1.28 0.19 3.78 -0.02 0.00 -1.26 -4.79 105.19 101.81 1lo4 n GLY 9 Ca 0.00 0.32 -0.09 0.00 0.00 0.00 0.00 46.02 46.25 1lo4 n GLY 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1lo4 s ASP 10 N -0.42 0.11 -0.13 1.61 -1.08 -0.87 -4.80 116.67 111.10 1lo4 s ASP 10 Ca 0.57 -1.24 -0.17 0.00 -0.52 0.00 0.00 52.55 51.20 1lo4 s ASP 10 Cb -0.63 0.85 -0.04 0.00 -1.46 0.00 0.00 42.92 41.64 1lo4 s ASP 10 CO 0.61 -1.70 0.42 -0.22 0.52 0.00 0.00 175.17 174.80 1lo4 s LEU 11 N -3.10 4.27 -0.01 -1.34 2.96 -1.26 -0.89 118.68 119.32 1lo4 s LEU 11 Ca 0.17 0.72 0.02 0.00 -0.22 0.00 0.00 54.13 54.82 1lo4 s LEU 11 Cb -0.05 -2.59 -0.00 0.00 0.50 0.00 0.00 46.19 44.04 1lo4 s LEU 11 CO 0.13 0.03 -0.07 0.54 -1.32 0.00 0.00 176.35 175.66 1lo4 s VAL 12 N 0.56 0.53 0.55 1.68 0.11 0.35 -4.94 120.40 119.25 1lo4 s VAL 12 Ca 0.23 -0.29 -0.20 0.00 -2.93 0.00 0.00 61.98 58.79 1lo4 s VAL 12 Cb -0.14 -0.45 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1lo4 s VAL 12 CO 0.08 0.15 1.25 -1.59 -3.33 0.00 0.00 175.10 171.66 1lo4 s LYS 13 N -0.14 3.16 0.13 1.54 -2.85 -1.25 -0.84 119.74 119.49 1lo4 s LYS 13 Ca 0.02 1.95 -0.35 0.00 -1.00 0.00 0.00 55.97 56.59 1lo4 s LYS 13 Cb -0.03 -2.12 -0.15 0.00 -2.06 0.00 0.00 37.83 33.47 1lo4 s LYS 13 CO -0.00 -1.09 1.42 -2.30 0.10 0.00 0.00 175.35 173.48 1lo4 n PRO 14 N -1.21 1.59 -0.07 1.78 -0.02 -1.26 -1.74 135.00 134.07 1lo4 n PRO 14 Ca 0.11 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1lo4 n PRO 14 Cb 0.48 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1lo4 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lo4 n GLY 15 N 2.81 0.55 1.25 -1.23 0.00 -0.13 -4.93 105.19 103.50 1lo4 n GLY 15 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 1lo4 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lo4 n GLY 16 N -2.00 1.63 3.47 -0.02 0.00 -0.71 -4.08 105.19 103.47 1lo4 n GLY 16 Ca 0.00 -2.11 -0.23 0.00 0.00 0.00 0.00 46.02 43.68 1lo4 n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lo4 s SER 17 N -2.19 2.98 -0.26 1.61 0.01 -1.26 -1.66 113.70 112.93 1lo4 s SER 17 Ca 0.20 -1.23 -0.26 0.00 1.31 0.00 0.00 55.95 55.97 1lo4 s SER 17 Cb -0.01 -0.21 0.10 0.00 0.21 0.00 0.00 66.02 66.11 1lo4 s SER 17 CO 0.13 -0.36 0.89 -0.22 0.41 0.00 0.00 173.24 174.09 1lo4 s LEU 18 N -3.50 -0.57 -0.11 2.44 2.96 -1.04 -5.00 118.68 113.86 1lo4 s LEU 18 Ca 0.31 1.06 -0.02 0.00 -0.22 0.00 0.00 54.13 55.26 1lo4 s LEU 18 Cb 0.05 2.14 -0.03 0.00 0.50 0.00 0.00 46.19 48.84 1lo4 s LEU 18 CO 0.14 -0.22 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.03 1lo4 s THR 19 N 0.15 4.04 -0.04 3.68 2.01 -1.26 -0.79 115.64 123.43 1lo4 s THR 19 Ca 0.01 -0.33 0.03 0.00 0.31 0.00 0.00 61.69 61.71 1lo4 s THR 19 Cb -0.05 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 1lo4 s THR 19 CO -0.02 0.56 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.59 1lo4 s LEU 20 N -0.34 2.91 0.22 4.42 1.43 -0.68 -4.65 118.68 121.99 1lo4 s LEU 20 Ca 0.06 -0.16 0.10 0.00 -1.03 0.00 0.00 54.13 53.09 1lo4 s LEU 20 Cb -0.12 -1.63 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 1lo4 s LEU 20 CO 0.02 0.33 -0.18 -0.44 0.23 0.00 0.00 176.35 176.32 1lo4 s SER 21 N -0.93 2.98 -0.10 2.29 0.01 -0.43 -1.91 113.70 115.60 1lo4 s SER 21 Ca 0.13 -0.98 -0.04 0.00 1.31 0.00 0.00 55.95 56.37 1lo4 s SER 21 Cb -0.11 -0.20 0.05 0.00 0.21 0.00 0.00 66.02 65.97 1lo4 s SER 21 CO 0.02 -0.06 0.21 0.00 0.41 0.00 0.00 173.24 173.83 1lo4 s GLU 23 N 2.15 4.10 -0.00 0.00 2.02 -0.21 -1.56 118.70 125.19 1lo4 s GLU 23 Ca 0.00 -0.21 -0.08 0.00 0.02 0.00 0.00 54.97 54.70 1lo4 s GLU 23 Cb -0.12 -3.39 -0.05 0.00 0.10 0.00 0.00 34.13 30.68 1lo4 s GLU 23 CO -0.07 0.35 0.28 0.00 0.02 0.00 0.00 175.26 175.84 1lo4 s ALA 24 N 0.21 3.82 -0.13 5.21 0.00 -0.61 -1.66 121.76 128.60 1lo4 s ALA 24 Ca 0.09 -0.52 -0.09 0.00 0.00 0.00 0.00 51.96 51.43 1lo4 s ALA 24 Cb -0.11 -2.11 0.04 0.00 0.00 0.00 0.00 23.12 20.93 1lo4 s ALA 24 CO -0.01 0.61 0.32 -1.12 0.00 0.00 0.00 175.76 175.56 1lo4 s SER 25 N -1.53 -0.35 0.00 0.00 0.01 0.14 -4.81 113.70 107.16 1lo4 s SER 25 Ca 0.26 0.66 0.00 0.00 1.31 0.00 0.00 55.95 58.18 1lo4 s SER 25 Cb -0.14 0.62 0.00 0.00 0.21 0.00 0.00 66.02 66.71 1lo4 s SER 25 CO 0.14 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.26 1lo4 n GLY 26 N 3.43 0.47 3.80 3.44 0.00 -1.25 0.36 105.19 115.44 1lo4 n GLY 26 Ca -0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 1lo4 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1lo4 s PHE 27 N -2.00 -0.04 0.12 1.61 -0.71 -1.26 -4.67 117.98 111.03 1lo4 s PHE 27 Ca 0.00 -0.29 0.07 0.00 -1.04 0.00 0.00 56.93 55.67 1lo4 s PHE 27 Cb 0.00 0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 42.43 1lo4 s PHE 27 CO 0.00 -0.82 -0.07 0.99 -1.34 0.00 0.00 175.22 173.97 1lo4 s THR 28 N -2.74 3.49 -0.11 -4.49 2.01 -1.26 -4.94 115.64 107.60 1lo4 s THR 28 Ca 0.16 -1.28 -0.06 0.00 0.31 0.00 0.00 61.69 60.82 1lo4 s THR 28 Cb -0.01 -2.66 -0.26 0.00 0.01 0.00 0.00 72.50 69.57 1lo4 s THR 28 CO 0.03 0.07 0.39 0.18 -0.69 0.00 0.00 174.62 174.59 1lo4 n LEU 29 N 0.52 2.58 -0.08 4.42 4.77 -1.26 -4.28 117.00 123.68 1lo4 n LEU 29 Ca -0.12 0.22 -0.02 0.00 -0.03 0.00 0.00 56.01 56.06 1lo4 n LEU 29 Cb 0.53 -1.09 -0.02 0.00 -2.33 0.00 0.00 43.42 40.51 1lo4 n LEU 29 CO 0.35 0.84 0.15 -1.14 -1.33 0.00 0.00 177.39 176.26 1lo4 n ARG 30 N -3.47 -0.08 -0.02 3.23 0.63 -1.26 -1.84 116.66 113.85 1lo4 n ARG 30 Ca -0.31 0.39 -0.13 0.00 -0.92 0.00 0.00 57.85 56.88 1lo4 n ARG 30 Cb 1.05 -0.58 -0.10 0.00 0.45 0.00 0.00 32.46 33.28 1lo4 n ARG 30 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1lo4 h THR 31 N 0.00 1.41 -4.08 5.15 2.02 -1.86 -3.40 112.91 112.15 1lo4 h THR 31 Ca 0.03 -1.22 -0.48 0.00 0.77 0.00 0.00 66.41 65.52 1lo4 h THR 31 Cb 0.07 2.23 0.07 0.00 -1.74 0.00 0.00 68.15 68.79 1lo4 h THR 31 CO -0.17 0.31 0.30 -0.31 0.37 0.00 0.00 175.52 176.02 1lo4 s TYR 32 N -4.13 3.17 0.33 3.16 1.51 -0.77 -4.26 117.35 116.36 1lo4 s TYR 32 Ca -0.16 0.75 -0.07 0.00 -1.01 0.00 0.00 57.07 56.57 1lo4 s TYR 32 Cb 0.01 -3.04 -0.06 0.00 -0.11 0.00 0.00 41.96 38.76 1lo4 s TYR 32 CO 0.67 -1.19 0.64 0.20 -1.11 0.00 0.00 175.55 174.76 1lo4 s GLY 33 N -4.40 1.91 -0.03 0.71 0.00 0.69 -3.88 107.32 102.32 1lo4 s GLY 33 Ca 0.58 -0.41 0.01 0.00 0.00 0.00 0.00 44.72 44.90 1lo4 s GLY 33 CO 0.48 -0.27 -0.01 1.06 0.00 0.00 0.00 173.10 174.36 1lo4 s MET 34 N -3.63 0.39 0.12 2.90 -1.94 -0.57 0.63 119.30 117.20 1lo4 s MET 34 Ca 0.47 0.04 -0.10 0.00 -1.71 0.00 0.00 55.69 54.39 1lo4 s MET 34 Cb -0.11 -0.54 0.00 0.00 2.01 0.00 0.00 34.83 36.20 1lo4 s MET 34 CO 0.30 -0.12 0.27 -1.54 -0.01 0.00 0.00 175.02 173.92 1lo4 s SER 35 N 0.99 0.02 -0.26 3.03 1.04 0.98 -1.03 113.70 118.46 1lo4 s SER 35 Ca -0.10 -0.66 -0.13 0.00 0.48 0.00 0.00 55.95 55.53 1lo4 s SER 35 Cb -0.14 0.40 -0.04 0.00 0.10 0.00 0.00 66.02 66.35 1lo4 s SER 35 CO -0.01 -0.82 0.30 0.26 0.98 0.00 0.00 173.24 173.94 1lo4 s TRP 36 N -3.89 3.25 0.04 5.02 0.52 -0.89 0.70 118.94 123.70 1lo4 s TRP 36 Ca 0.09 0.32 0.06 0.00 0.02 0.00 0.00 56.10 56.59 1lo4 s TRP 36 Cb 0.04 -2.48 -0.03 0.00 -1.15 0.00 0.00 33.47 29.84 1lo4 s TRP 36 CO -0.07 -0.16 -0.15 0.08 0.02 0.00 0.00 176.95 176.66 1lo4 s VAL 37 N 1.82 2.99 0.11 4.03 1.01 0.13 -0.23 120.40 130.25 1lo4 s VAL 37 Ca 0.12 -1.13 0.07 0.00 0.00 0.00 0.00 61.98 61.05 1lo4 s VAL 37 Cb -0.16 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1lo4 s VAL 37 CO 0.10 0.32 -0.18 0.00 0.00 0.00 0.00 175.10 175.34 1lo4 s ARG 38 N -1.51 1.06 -0.14 2.72 1.70 -0.52 0.56 118.95 122.83 1lo4 s ARG 38 Ca 0.16 -1.16 0.01 0.00 -0.47 0.00 0.00 55.73 54.27 1lo4 s ARG 38 Cb -0.11 -1.19 0.02 0.00 -0.57 0.00 0.00 34.95 33.10 1lo4 s ARG 38 CO 0.06 0.27 -0.17 -1.14 -1.08 0.00 0.00 175.30 173.24 1lo4 s GLN 39 N -2.09 2.53 0.80 3.89 0.74 -0.64 -0.49 119.66 124.40 1lo4 s GLN 39 Ca 0.06 -0.66 -0.12 0.00 0.05 0.00 0.00 55.36 54.69 1lo4 s GLN 39 Cb -0.09 -2.17 0.08 0.00 1.10 0.00 0.00 33.01 31.92 1lo4 s GLN 39 CO 0.04 -0.13 1.16 0.95 -0.55 0.00 0.00 175.29 176.76 1lo4 s THR 40 N 1.16 2.07 0.10 -0.34 -4.23 -0.53 -2.15 115.64 111.71 1lo4 s THR 40 Ca -0.01 -0.01 0.34 0.00 -1.18 0.00 0.00 61.69 60.82 1lo4 s THR 40 Cb -0.14 -3.01 0.38 0.00 1.34 0.00 0.00 72.50 71.06 1lo4 s THR 40 CO -0.06 -0.02 2.00 -0.65 -0.54 0.00 0.00 174.62 175.35 1lo4 h PRO 41 N -1.01 0.00 -0.28 3.99 0.11 -1.91 -0.30 132.00 132.60 1lo4 h PRO 41 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1lo4 h PRO 41 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1lo4 h PRO 41 CO 0.65 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.48 1lo4 n GLN 42 N -2.96 1.55 -2.47 1.05 6.02 -1.26 -4.91 117.38 114.40 1lo4 n GLN 42 Ca 0.00 -0.77 -0.13 0.00 -0.01 0.00 0.00 57.00 56.09 1lo4 n GLN 42 Cb 0.26 -1.22 0.01 0.00 1.02 0.00 0.00 30.24 30.31 1lo4 n GLN 42 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1lo4 n MET 43 N 0.12 -1.94 -3.41 -1.09 2.81 -0.12 -5.03 117.12 108.47 1lo4 n MET 43 Ca 0.07 0.58 -0.38 0.00 -1.81 0.00 0.00 57.70 56.16 1lo4 n MET 43 Cb 0.21 -4.73 -0.06 0.00 -0.71 0.00 0.00 33.22 27.93 1lo4 n MET 43 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1lo4 s ARG 44 N -4.91 4.11 -0.08 0.03 3.52 -1.26 -4.87 118.95 115.49 1lo4 s ARG 44 Ca 0.09 0.45 -0.15 0.00 -0.13 0.00 0.00 55.73 55.98 1lo4 s ARG 44 Cb -0.04 -3.31 -0.05 0.00 -1.56 0.00 0.00 34.95 30.00 1lo4 s ARG 44 CO 0.11 0.48 0.40 -0.51 -0.81 0.00 0.00 175.30 174.97 1lo4 s LEU 45 N -0.43 4.36 -0.04 -0.88 1.43 -1.26 -1.45 118.68 120.41 1lo4 s LEU 45 Ca 0.25 0.80 -0.01 0.00 -1.03 0.00 0.00 54.13 54.14 1lo4 s LEU 45 Cb -0.16 -2.56 0.03 0.00 0.03 0.00 0.00 46.19 43.53 1lo4 s LEU 45 CO 0.13 0.17 0.04 -1.61 0.23 0.00 0.00 176.35 175.31 1lo4 s GLU 46 N -0.19 0.10 0.32 1.70 2.02 0.36 -4.98 118.70 118.02 1lo4 s GLU 46 Ca 0.23 0.27 -0.29 0.00 0.02 0.00 0.00 54.97 55.19 1lo4 s GLU 46 Cb -0.15 -0.56 -0.12 0.00 0.10 0.00 0.00 34.13 33.40 1lo4 s GLU 46 CO 0.10 -0.28 1.48 1.87 0.02 0.00 0.00 175.26 178.45 1lo4 n TRP 47 N 4.99 2.67 -0.08 1.61 -0.00 -1.26 -1.44 117.44 123.93 1lo4 n TRP 47 Ca -0.10 0.39 -0.15 0.00 -0.00 0.00 0.00 57.50 57.64 1lo4 n TRP 47 Cb 0.50 -2.52 -0.05 0.00 -0.00 0.00 0.00 31.31 29.24 1lo4 n TRP 47 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1lo4 n VAL 48 N 1.32 1.31 -3.50 5.87 0.31 0.68 -4.72 118.33 119.61 1lo4 n VAL 48 Ca 0.06 -0.05 -0.11 0.00 -0.01 0.00 0.00 64.34 64.23 1lo4 n VAL 48 Cb 0.36 -1.99 -0.03 0.00 -0.91 0.00 0.00 33.84 31.27 1lo4 n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1lo4 s ALA 49 N -2.55 -1.79 0.05 3.52 0.00 -1.12 -2.06 121.76 117.82 1lo4 s ALA 49 Ca -0.26 1.07 -0.01 0.00 0.00 0.00 0.00 51.96 52.75 1lo4 s ALA 49 Cb 0.07 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1lo4 s ALA 49 CO 0.36 -0.57 -0.02 -1.12 0.00 0.00 0.00 175.76 174.40 1lo4 s SER 50 N -2.03 0.45 -0.06 0.00 0.01 0.51 -2.09 113.70 110.48 1lo4 s SER 50 Ca -0.00 -0.93 -0.03 0.00 1.31 0.00 0.00 55.95 56.30 1lo4 s SER 50 Cb -0.01 0.20 0.04 0.00 0.21 0.00 0.00 66.02 66.46 1lo4 s SER 50 CO -0.04 -0.57 0.14 -0.51 0.41 0.00 0.00 173.24 172.66 1lo4 s ILE 51 N -3.65 -0.05 0.87 1.44 2.07 -0.20 -1.42 121.20 120.26 1lo4 s ILE 51 Ca 0.04 0.18 -0.13 0.00 -1.41 0.00 0.00 60.65 59.34 1lo4 s ILE 51 Cb 0.06 -0.23 0.13 0.00 0.13 0.00 0.00 42.46 42.55 1lo4 s ILE 51 CO -0.09 0.07 1.23 -0.94 -1.91 0.00 0.00 174.94 173.30 1lo4 s SER 52 N 1.16 3.89 0.61 4.50 1.04 -0.62 -1.51 113.70 122.77 1lo4 s SER 52 Ca -0.09 0.49 0.32 0.00 0.48 0.00 0.00 55.95 57.15 1lo4 s SER 52 Cb -0.12 -0.78 1.87 0.00 0.10 0.00 0.00 66.02 67.09 1lo4 s SER 52 CO -0.06 -2.26 2.23 0.10 0.98 0.00 0.00 173.24 174.23 1lo4 h TYR 53 N -1.28 0.00 -0.18 5.02 -0.00 -1.74 -1.00 116.97 117.78 1lo4 h TYR 53 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 1lo4 h TYR 53 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.01 1lo4 h TYR 53 CO -0.37 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.20 1lo4 n GLY 54 N -1.30 0.97 1.77 0.10 0.00 -1.26 -4.75 105.19 100.71 1lo4 n GLY 54 Ca -0.02 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1lo4 n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lo4 n GLY 55 N 1.34 0.79 3.73 -0.02 0.00 -0.38 -5.02 105.19 105.63 1lo4 n GLY 55 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1lo4 n GLY 55 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lo4 n LEU 56 N 0.00 4.14 -4.62 0.99 4.77 -1.26 -4.77 117.00 116.24 1lo4 n LEU 56 Ca 0.00 1.20 -0.35 0.00 -0.03 0.00 0.00 56.01 56.84 1lo4 n LEU 56 Cb 0.00 -1.55 -0.10 0.00 -2.33 0.00 0.00 43.42 39.44 1lo4 n LEU 56 CO 0.00 -0.13 -0.25 -0.76 -1.33 0.00 0.00 177.39 174.92 1lo4 s LEU 57 N -1.28 3.79 -0.11 2.23 1.43 -1.26 -1.58 118.68 121.90 1lo4 s LEU 57 Ca 0.57 0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.76 1lo4 s LEU 57 Cb -0.53 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1lo4 s LEU 57 CO 0.60 0.15 -0.23 -0.31 0.23 0.00 0.00 176.35 176.79 1lo4 s TYR 58 N 0.49 2.58 0.18 0.29 1.51 -0.51 -5.02 117.35 116.88 1lo4 s TYR 58 Ca 0.03 -1.14 0.11 0.00 -1.01 0.00 0.00 57.07 55.06 1lo4 s TYR 58 Cb -0.13 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 1lo4 s TYR 58 CO 0.01 -0.48 -0.23 -0.06 -1.11 0.00 0.00 175.55 173.67 1lo4 s PHE 59 N 0.50 2.20 0.53 2.71 0.40 -1.26 -0.37 117.98 122.70 1lo4 s PHE 59 Ca -0.15 -0.38 -0.07 0.00 -0.60 0.00 0.00 56.93 55.72 1lo4 s PHE 59 Cb -0.17 -1.10 -0.04 0.00 0.51 0.00 0.00 43.02 42.22 1lo4 s PHE 59 CO 0.05 0.45 0.88 -1.54 0.70 0.00 0.00 175.22 175.76 1lo4 s SER 60 N -2.59 6.25 0.46 1.36 1.04 -0.87 -4.89 113.70 114.46 1lo4 s SER 60 Ca 0.19 1.12 0.21 0.00 0.48 0.00 0.00 55.95 57.95 1lo4 s SER 60 Cb -0.08 -2.33 1.13 0.00 0.10 0.00 0.00 66.02 64.84 1lo4 s SER 60 CO 0.09 -0.69 1.97 0.44 0.98 0.00 0.00 173.24 176.03 1lo4 h ASP 61 N 0.03 0.00 1.01 7.02 3.45 -1.94 -0.80 116.42 125.19 1lo4 h ASP 61 Ca -0.46 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.00 1lo4 h ASP 61 Cb 1.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.97 1lo4 h ASP 61 CO 0.62 0.21 -0.26 -1.54 -1.57 0.00 0.00 179.24 176.69 1lo4 n SER 62 N -3.84 0.52 0.00 6.45 3.41 -1.26 -3.78 113.62 115.12 1lo4 n SER 62 Ca -0.02 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1lo4 n SER 62 Cb 0.30 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1lo4 n SER 62 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1lo4 n VAL 63 N -1.88 0.00 -1.68 -3.33 0.31 -0.88 -4.94 118.33 105.93 1lo4 n VAL 63 Ca 0.05 -0.33 -0.42 0.00 -0.01 0.00 0.00 64.34 63.63 1lo4 n VAL 63 Cb 0.39 0.88 -0.03 0.00 -0.91 0.00 0.00 33.84 34.17 1lo4 n VAL 63 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1lo4 n LYS 64 N -0.93 2.82 -0.36 5.55 4.81 -0.36 -1.70 118.16 128.00 1lo4 n LYS 64 Ca 0.00 1.03 0.00 0.00 -0.87 0.00 0.00 58.31 58.47 1lo4 n LYS 64 Cb 0.00 -2.95 0.00 0.00 0.02 0.00 0.00 35.03 32.10 1lo4 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lo4 n GLY 65 N 4.36 0.72 0.46 3.14 0.00 -1.26 -4.86 105.19 107.75 1lo4 n GLY 65 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1lo4 n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lo4 n ARG 66 N -2.00 0.00 -3.54 1.61 1.74 -0.69 -5.02 116.66 108.76 1lo4 n ARG 66 Ca 0.00 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.84 1lo4 n ARG 66 Cb 0.00 -0.71 -0.02 0.00 -1.02 0.00 0.00 32.46 30.71 1lo4 n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1lo4 s PHE 67 N -1.88 3.49 -0.01 -1.55 0.40 -0.88 -2.16 117.98 115.38 1lo4 s PHE 67 Ca 0.00 0.31 -0.03 0.00 -0.60 0.00 0.00 56.93 56.60 1lo4 s PHE 67 Cb 0.00 -1.84 -0.00 0.00 0.51 0.00 0.00 43.02 41.68 1lo4 s PHE 67 CO 0.00 0.24 0.06 0.99 0.70 0.00 0.00 175.22 177.21 1lo4 s THR 68 N -2.15 0.05 0.19 0.64 2.01 0.18 -4.86 115.64 111.71 1lo4 s THR 68 Ca 0.39 -0.38 0.11 0.00 0.31 0.00 0.00 61.69 62.11 1lo4 s THR 68 Cb -0.10 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 1lo4 s THR 68 CO 0.33 -0.21 -0.20 0.27 -0.69 0.00 0.00 174.62 174.12 1lo4 s ILE 69 N -0.66 2.60 -0.05 1.82 -4.36 -1.26 0.54 121.20 119.84 1lo4 s ILE 69 Ca -0.07 -1.94 -0.30 0.00 -0.26 0.00 0.00 60.65 58.08 1lo4 s ILE 69 Cb -0.05 -2.27 0.11 0.00 1.25 0.00 0.00 42.46 41.51 1lo4 s ILE 69 CO 0.00 -0.13 0.93 -0.94 0.24 0.00 0.00 174.94 175.04 1lo4 s SER 70 N -2.75 -0.35 0.18 4.36 1.04 -0.52 -4.97 113.70 110.68 1lo4 s SER 70 Ca 0.22 0.08 0.04 0.00 0.48 0.00 0.00 55.95 56.78 1lo4 s SER 70 Cb -0.08 0.35 -0.05 0.00 0.10 0.00 0.00 66.02 66.35 1lo4 s SER 70 CO 0.12 -0.54 -0.08 0.00 0.98 0.00 0.00 173.24 173.72 1lo4 s ARG 71 N -2.69 1.16 -0.38 4.02 1.70 -1.26 0.15 118.95 121.65 1lo4 s ARG 71 Ca 0.04 -1.53 0.01 0.00 -0.47 0.00 0.00 55.73 53.78 1lo4 s ARG 71 Cb -0.01 -0.66 0.12 0.00 -0.57 0.00 0.00 34.95 33.83 1lo4 s ARG 71 CO -0.07 0.03 0.16 0.34 -1.08 0.00 0.00 175.30 174.69 1lo4 s ASP 72 N -3.22 3.96 0.00 -2.89 2.15 0.31 -4.95 116.67 112.03 1lo4 s ASP 72 Ca 0.21 -2.23 0.14 0.00 0.43 0.00 0.00 52.55 51.09 1lo4 s ASP 72 Cb 0.03 -1.08 0.60 0.00 -0.30 0.00 0.00 42.92 42.17 1lo4 s ASP 72 CO 0.03 -0.33 1.44 -0.38 -0.17 0.00 0.00 175.17 175.76 1lo4 n ILE 73 N 4.08 1.02 0.03 4.11 -0.00 -1.26 0.28 119.36 127.62 1lo4 n ILE 73 Ca 0.04 0.26 -0.01 0.00 -0.00 0.00 0.00 62.75 63.03 1lo4 n ILE 73 Cb 0.38 -1.02 -0.01 0.00 -0.00 0.00 0.00 39.64 39.00 1lo4 n ILE 73 CO 0.00 0.00 0.00 0.58 -0.00 0.00 0.00 176.55 177.13 1lo4 h VAL 74 N 0.00 0.00 0.00 1.39 2.07 -1.97 -3.37 116.25 114.37 1lo4 h VAL 74 Ca 0.00 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1lo4 h VAL 74 Cb 0.23 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1lo4 h VAL 74 CO 0.00 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.13 1lo4 n ARG 75 N -2.73 0.19 -2.61 1.57 1.74 -1.05 -4.94 116.66 108.83 1lo4 n ARG 75 Ca -0.01 0.20 -0.07 0.00 -0.77 0.00 0.00 57.85 57.19 1lo4 n ARG 75 Cb 0.04 -1.74 0.04 0.00 -1.02 0.00 0.00 32.46 29.77 1lo4 n ARG 75 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1lo4 n ASN 76 N -2.07 -2.20 -4.01 0.55 3.02 0.81 -4.81 115.26 106.54 1lo4 n ASN 76 Ca 0.05 -0.25 -0.27 0.00 -0.03 0.00 0.00 54.58 54.09 1lo4 n ASN 76 Cb 0.38 -2.36 -0.17 0.00 -0.61 0.00 0.00 39.78 37.02 1lo4 n ASN 76 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1lo4 s ILE 77 N -3.14 1.26 -0.15 2.41 1.01 -0.77 -1.57 121.20 120.25 1lo4 s ILE 77 Ca 0.03 -0.51 -0.13 0.00 0.00 0.00 0.00 60.65 60.04 1lo4 s ILE 77 Cb -0.01 -1.17 -0.05 0.00 0.01 0.00 0.00 42.46 41.24 1lo4 s ILE 77 CO 0.29 0.39 0.26 -0.22 0.00 0.00 0.00 174.94 175.67 1lo4 s LEU 78 N 0.99 4.27 0.22 2.97 2.96 -0.60 0.11 118.68 129.60 1lo4 s LEU 78 Ca -0.08 0.50 0.10 0.00 -0.22 0.00 0.00 54.13 54.44 1lo4 s LEU 78 Cb -0.15 -2.32 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 1lo4 s LEU 78 CO -0.01 0.16 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.15 1lo4 s THR 79 N 0.17 2.85 -0.17 3.68 2.01 0.38 -1.25 115.64 123.31 1lo4 s THR 79 Ca 0.16 -1.98 -0.04 0.00 0.31 0.00 0.00 61.69 60.14 1lo4 s THR 79 Cb -0.13 -2.44 0.06 0.00 0.01 0.00 0.00 72.50 70.00 1lo4 s THR 79 CO 0.04 -0.23 0.06 -0.22 -0.69 0.00 0.00 174.62 173.58 1lo4 s LEU 80 N -3.10 0.80 -0.33 4.42 2.96 -0.80 -1.44 118.68 121.19 1lo4 s LEU 80 Ca 0.26 -0.67 -0.16 0.00 -0.22 0.00 0.00 54.13 53.34 1lo4 s LEU 80 Cb -0.07 -0.44 -0.02 0.00 0.50 0.00 0.00 46.19 46.16 1lo4 s LEU 80 CO 0.15 -0.31 0.41 -1.10 -1.32 0.00 0.00 176.35 174.17 1lo4 s GLN 81 N 1.98 3.68 -0.14 1.98 -1.52 0.19 -1.68 119.66 124.16 1lo4 s GLN 81 Ca 0.01 -0.23 -0.07 0.00 -1.95 0.00 0.00 55.36 53.11 1lo4 s GLN 81 Cb -0.16 -3.77 -0.04 0.00 -0.22 0.00 0.00 33.01 28.81 1lo4 s GLN 81 CO -0.08 -0.50 0.13 -1.64 -0.25 0.00 0.00 175.29 172.94 1lo4 s MET 82 N 2.14 3.62 0.11 2.91 -1.94 0.03 -0.65 119.30 125.53 1lo4 s MET 82 Ca 0.15 -0.18 0.03 0.00 -1.71 0.00 0.00 55.69 53.98 1lo4 s MET 82 Cb -0.16 -3.22 -0.04 0.00 2.01 0.00 0.00 34.83 33.42 1lo4 s MET 82 CO 0.12 0.64 -0.09 -1.12 -0.01 0.00 0.00 175.02 174.55 1lo4 s SER 83 N -0.62 1.47 -1.21 3.03 0.01 -0.92 -2.48 113.70 112.98 1lo4 s SER 83 Ca 0.13 -0.90 -0.03 0.00 1.31 0.00 0.00 55.95 56.45 1lo4 s SER 83 Cb -0.12 0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.12 1lo4 s SER 83 CO 0.02 -0.32 0.84 0.54 0.41 0.00 0.00 173.24 174.73 1lo4 n ARG 84 N 0.25 -4.56 -2.12 12.44 1.74 -1.09 -4.65 116.66 118.67 1lo4 n ARG 84 Ca -0.14 0.72 -0.41 0.00 -0.77 0.00 0.00 57.85 57.25 1lo4 n ARG 84 Cb 0.59 -5.40 -0.02 0.00 -1.02 0.00 0.00 32.46 26.61 1lo4 n ARG 84 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1lo4 s LEU 85 N -6.32 4.43 0.35 0.55 1.43 -0.66 -4.68 118.68 113.77 1lo4 s LEU 85 Ca 0.13 2.65 0.09 0.00 -1.03 0.00 0.00 54.13 55.97 1lo4 s LEU 85 Cb -0.03 -3.64 -0.06 0.00 0.03 0.00 0.00 46.19 42.49 1lo4 s LEU 85 CO 0.78 -0.54 0.01 -0.13 0.23 0.00 0.00 176.35 176.70 1lo4 s ARG 86 N -1.46 2.05 0.37 1.70 0.52 -1.26 -0.96 118.95 119.92 1lo4 s ARG 86 Ca 0.51 -1.81 0.06 0.00 -0.52 0.00 0.00 55.73 53.97 1lo4 s ARG 86 Cb -0.39 -1.88 0.75 0.00 0.52 0.00 0.00 34.95 33.94 1lo4 s ARG 86 CO 0.50 0.10 1.99 0.66 0.02 0.00 0.00 175.30 178.57 1lo4 h SER 87 N 1.80 0.63 0.00 0.23 4.64 -1.96 0.87 113.55 119.75 1lo4 h SER 87 Ca -0.43 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1lo4 h SER 87 Cb 1.25 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1lo4 h SER 87 CO 0.69 0.43 0.05 -0.33 -0.87 0.00 0.00 176.83 176.79 1lo4 h GLU 88 N 0.72 0.00 -0.00 4.77 3.07 -1.95 -0.35 114.58 120.84 1lo4 h GLU 88 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 1lo4 h GLU 88 Cb 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1lo4 h GLU 88 CO -0.07 0.00 -0.05 -0.25 -1.40 0.00 0.00 179.01 177.24 1lo4 n ASP 89 N -2.69 0.32 -4.70 1.42 10.43 0.30 -4.82 116.55 116.81 1lo4 n ASP 89 Ca -0.02 -0.63 -0.42 0.00 2.57 0.00 0.00 54.79 56.29 1lo4 n ASP 89 Cb 0.10 -0.10 -0.03 0.00 1.84 0.00 0.00 41.12 42.93 1lo4 n ASP 89 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1lo4 s THR 90 N -2.35 3.38 0.00 -3.53 2.01 -0.15 -4.88 115.64 110.12 1lo4 s THR 90 Ca 0.34 0.86 0.00 0.00 0.31 0.00 0.00 61.69 63.20 1lo4 s THR 90 Cb 0.21 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 69.16 1lo4 s THR 90 CO 0.44 0.02 0.00 0.00 -0.69 0.00 0.00 174.62 174.38 1lo4 n ALA 91 N 5.02 0.00 -2.52 7.40 0.00 -0.73 -4.47 120.51 125.20 1lo4 n ALA 91 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.18 1lo4 n ALA 91 Cb 0.42 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.82 1lo4 n ALA 91 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1lo4 s ILE 92 N -2.00 4.90 -0.21 0.00 1.01 -0.92 -0.59 121.20 123.39 1lo4 s ILE 92 Ca 0.00 1.39 -0.05 0.00 0.00 0.00 0.00 60.65 61.99 1lo4 s ILE 92 Cb 0.00 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 1lo4 s ILE 92 CO 0.00 0.36 0.01 -0.31 0.00 0.00 0.00 174.94 175.00 1lo4 s TYR 93 N 0.10 3.04 -0.13 3.97 1.51 0.28 -1.63 117.35 124.49 1lo4 s TYR 93 Ca 0.34 -0.47 -0.03 0.00 -1.01 0.00 0.00 57.07 55.90 1lo4 s TYR 93 Cb -0.19 -2.10 -0.03 0.00 -0.11 0.00 0.00 41.96 39.53 1lo4 s TYR 93 CO 0.19 -0.26 -0.01 0.71 -1.11 0.00 0.00 175.55 175.07 1lo4 s TYR 94 N 1.07 3.10 0.12 2.71 1.51 0.19 -0.87 117.35 125.18 1lo4 s TYR 94 Ca 0.02 -0.05 -0.01 0.00 -1.01 0.00 0.00 57.07 56.02 1lo4 s TYR 94 Cb -0.14 -1.91 -0.04 0.00 -0.11 0.00 0.00 41.96 39.76 1lo4 s TYR 94 CO 0.02 0.19 0.30 0.00 -1.11 0.00 0.00 175.55 174.94 1lo4 s ALA 96 N -1.65 -1.45 0.03 0.00 0.00 0.22 -1.46 121.76 117.46 1lo4 s ALA 96 Ca 0.37 1.12 -0.14 0.00 0.00 0.00 0.00 51.96 53.31 1lo4 s ALA 96 Cb -0.12 -0.16 -0.06 0.00 0.00 0.00 0.00 23.12 22.78 1lo4 s ALA 96 CO 0.27 -0.32 0.43 0.50 0.00 0.00 0.00 175.76 176.64 1lo4 s ARG 97 N -0.95 3.91 0.18 0.00 3.00 -0.24 -0.02 118.95 124.84 1lo4 s ARG 97 Ca -0.10 0.40 0.11 0.00 -1.00 0.00 0.00 55.73 55.14 1lo4 s ARG 97 Cb -0.02 -3.15 -0.04 0.00 0.00 0.00 0.00 34.95 31.73 1lo4 s ARG 97 CO 0.07 0.64 -0.24 0.20 0.00 0.00 0.00 175.30 175.97 1lo4 s GLY 98 N -1.28 1.66 -0.64 8.12 0.00 0.21 0.06 107.32 115.45 1lo4 s GLY 98 Ca 0.27 -1.60 -0.24 0.00 0.00 0.00 0.00 44.72 43.15 1lo4 s GLY 98 CO 0.15 -1.63 1.02 -1.59 0.00 0.00 0.00 173.10 171.05 1lo4 s THR 99 N -1.64 4.23 0.09 0.90 2.01 -0.75 -0.22 115.64 120.27 1lo4 s THR 99 Ca 0.19 -0.01 -0.18 0.00 0.31 0.00 0.00 61.69 62.00 1lo4 s THR 99 Cb -0.08 -4.68 -0.10 0.00 0.01 0.00 0.00 72.50 67.65 1lo4 s THR 99 CO 0.09 -1.42 0.37 -1.20 -0.69 0.00 0.00 174.62 171.77 1lo4 n SER 100 N 7.94 -0.57 0.00 3.53 7.64 -1.26 -0.05 113.62 130.84 1lo4 n SER 100 Ca -0.01 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.53 1lo4 n SER 100 Cb 0.47 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1lo4 n SER 100 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1lo4 n PHE 101 N 0.19 0.00 -0.04 1.43 3.01 -1.26 -4.62 117.46 116.17 1lo4 n PHE 101 Ca 0.11 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.48 1lo4 n PHE 101 Cb 0.12 -1.19 -0.03 0.00 -0.01 0.00 0.00 39.48 38.38 1lo4 n PHE 101 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1lo4 n VAL 102 N -0.88 0.50 -3.65 -4.37 0.31 0.92 -5.12 118.33 106.04 1lo4 n VAL 102 Ca 0.00 -0.09 -0.05 0.00 -0.01 0.00 0.00 64.34 64.18 1lo4 n VAL 102 Cb 0.20 -1.62 -0.07 0.00 -0.91 0.00 0.00 33.84 31.45 1lo4 n VAL 102 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1lo4 s ARG 103 N -2.16 0.62 -0.01 5.55 0.52 -0.56 -4.99 118.95 117.92 1lo4 s ARG 103 Ca -0.11 1.25 -0.20 0.00 -0.52 0.00 0.00 55.73 56.15 1lo4 s ARG 103 Cb 0.04 0.37 -0.29 0.00 0.52 0.00 0.00 34.95 35.59 1lo4 s ARG 103 CO 0.14 -0.17 0.99 1.88 0.02 0.00 0.00 175.30 178.16 1lo4 h TYR 104 N 7.40 0.67 -2.42 -0.53 -1.99 -1.89 -1.99 116.97 116.22 1lo4 h TYR 104 Ca -0.26 -0.44 -0.59 0.00 2.00 0.00 0.00 58.73 59.43 1lo4 h TYR 104 Cb 1.18 -0.05 -0.38 0.00 2.00 0.00 0.00 36.73 39.48 1lo4 h TYR 104 CO 0.12 1.31 -0.94 1.19 -0.00 0.00 0.00 178.16 179.84 1lo4 n PHE 105 N -4.07 -0.55 0.06 4.88 0.99 -1.25 -3.00 117.46 114.53 1lo4 n PHE 105 Ca -0.13 -3.40 0.10 0.00 -0.00 0.00 0.00 57.45 54.02 1lo4 n PHE 105 Cb 0.83 0.18 -0.06 0.00 -1.00 0.00 0.00 39.48 39.43 1lo4 n PHE 105 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 1lo4 n ASP 106 N 2.74 0.60 -4.11 4.37 3.85 0.11 -4.79 116.55 119.31 1lo4 n ASP 106 Ca 0.29 0.23 -0.28 0.00 -0.71 0.00 0.00 54.79 54.33 1lo4 n ASP 106 Cb 0.47 0.87 -0.17 0.00 -1.35 0.00 0.00 41.12 40.95 1lo4 n ASP 106 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1lo4 s VAL 107 N -3.37 1.52 -0.05 2.12 1.01 -1.11 -4.99 120.40 115.54 1lo4 s VAL 107 Ca -0.03 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.30 1lo4 s VAL 107 Cb 0.11 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 1lo4 s VAL 107 CO 0.83 0.44 -0.24 0.26 0.00 0.00 0.00 175.10 176.38 1lo4 s TRP 108 N 0.48 2.31 1.09 5.22 0.52 -1.26 -1.08 118.94 126.23 1lo4 s TRP 108 Ca -0.15 -0.63 -0.18 0.00 0.02 0.00 0.00 56.10 55.16 1lo4 s TRP 108 Cb -0.16 -1.51 0.25 0.00 -1.15 0.00 0.00 33.47 30.89 1lo4 s TRP 108 CO 0.06 -0.17 1.24 0.20 0.02 0.00 0.00 176.95 178.30 1lo4 s GLY 109 N -0.25 1.71 0.48 0.98 0.00 -0.53 -4.74 107.32 104.97 1lo4 s GLY 109 Ca -0.00 -1.16 0.28 0.00 0.00 0.00 0.00 44.72 43.83 1lo4 s GLY 109 CO 0.02 -0.31 1.78 0.00 0.00 0.00 0.00 173.10 174.59 1lo4 h ALA 110 N -2.13 0.99 0.00 3.20 0.00 -1.91 -3.46 119.26 115.96 1lo4 h ALA 110 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1lo4 h ALA 110 Cb 1.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1lo4 h ALA 110 CO 0.33 0.03 0.00 0.41 0.00 0.00 0.00 179.25 180.02 1lo4 n GLY 111 N 0.61 1.10 2.91 0.00 0.00 -1.26 -5.01 105.19 103.54 1lo4 n GLY 111 Ca 0.02 -1.72 -0.16 0.00 0.00 0.00 0.00 46.02 44.17 1lo4 n GLY 111 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1lo4 s THR 112 N -2.72 0.31 0.02 2.61 -1.32 -0.05 -4.80 115.64 109.70 1lo4 s THR 112 Ca 0.00 -0.13 -0.22 0.00 -1.21 0.00 0.00 61.69 60.13 1lo4 s THR 112 Cb 0.00 -0.29 -0.06 0.00 -1.51 0.00 0.00 72.50 70.64 1lo4 s THR 112 CO 0.00 0.11 0.66 -0.89 -2.21 0.00 0.00 174.62 172.28 1lo4 s THR 113 N 0.17 4.82 -0.07 5.08 2.01 -1.26 -0.56 115.64 125.83 1lo4 s THR 113 Ca -0.01 1.38 0.04 0.00 0.31 0.00 0.00 61.69 63.41 1lo4 s THR 113 Cb -0.05 -4.00 0.00 0.00 0.01 0.00 0.00 72.50 68.47 1lo4 s THR 113 CO -0.00 0.41 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.46 1lo4 s VAL 114 N -0.24 1.64 -0.08 3.82 1.01 0.24 -2.04 120.40 124.74 1lo4 s VAL 114 Ca 0.33 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1lo4 s VAL 114 Cb -0.19 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.78 1lo4 s VAL 114 CO 0.19 0.47 -0.15 -0.89 0.00 0.00 0.00 175.10 174.72 1lo4 s THR 115 N 0.28 1.37 -0.26 3.92 2.01 -0.06 -1.77 115.64 121.11 1lo4 s THR 115 Ca -0.12 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.31 1lo4 s THR 115 Cb -0.15 -1.24 0.06 0.00 0.01 0.00 0.00 72.50 71.18 1lo4 s THR 115 CO 0.05 0.41 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.60 1lo4 s VAL 116 N 0.75 2.22 -0.06 3.82 1.01 -1.25 0.13 120.40 127.02 1lo4 s VAL 116 Ca -0.12 -1.64 -0.29 0.00 0.00 0.00 0.00 61.98 59.93 1lo4 s VAL 116 Cb -0.16 -2.32 0.11 0.00 0.00 0.00 0.00 36.38 34.01 1lo4 s VAL 116 CO 0.03 -0.05 0.89 -0.55 0.00 0.00 0.00 175.10 175.42 1lo4 s SER 117 N 1.11 -0.41 0.00 3.32 0.15 -0.02 -4.52 113.70 113.33 1lo4 s SER 117 Ca -0.08 0.24 0.26 0.00 0.70 0.00 0.00 55.95 57.07 1lo4 s SER 117 Cb -0.20 0.38 0.65 0.00 -1.71 0.00 0.00 66.02 65.14 1lo4 s SER 117 CO -0.05 -0.52 1.50 -1.20 1.20 0.00 0.00 173.24 174.17 1lo4 n SER 118 N 0.27 0.87 -4.71 5.45 7.64 -1.26 -3.82 113.62 118.06 1lo4 n SER 118 Ca -0.11 -0.69 -0.40 0.00 1.01 0.00 0.00 58.87 58.68 1lo4 n SER 118 Cb 0.60 0.19 0.02 0.00 -1.01 0.00 0.00 64.21 64.01 1lo4 n SER 118 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1lo4 n ALA 119 N -0.93 1.30 -2.32 -0.43 0.00 -1.26 -4.97 120.51 111.89 1lo4 n ALA 119 Ca 0.10 0.21 -0.33 0.00 0.00 0.00 0.00 53.44 53.42 1lo4 n ALA 119 Cb 0.35 -2.28 -0.06 0.00 0.00 0.00 0.00 19.45 17.46 1lo4 n ALA 119 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1lo4 s LYS 120 N -2.43 3.89 0.00 0.00 3.01 -1.26 -5.01 119.74 117.94 1lo4 s LYS 120 Ca 0.65 0.43 -0.30 0.00 -1.01 0.00 0.00 55.97 55.74 1lo4 s LYS 120 Cb -0.47 -2.61 -0.07 0.00 -1.01 0.00 0.00 37.83 33.66 1lo4 s LYS 120 CO 0.55 0.29 1.72 0.99 0.51 0.00 0.00 175.35 179.40 1lo4 s THR 121 N -1.83 3.30 -0.06 2.17 2.01 -1.26 -4.72 115.64 115.25 1lo4 s THR 121 Ca 0.48 0.50 0.02 0.00 0.31 0.00 0.00 61.69 63.00 1lo4 s THR 121 Cb -0.11 -3.32 0.01 0.00 0.01 0.00 0.00 72.50 69.09 1lo4 s THR 121 CO 0.20 -0.03 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.10 1lo4 s THR 122 N 3.69 1.03 0.33 -0.82 2.01 -0.36 -4.94 115.64 116.58 1lo4 s THR 122 Ca 0.77 -0.42 -0.26 0.00 0.31 0.00 0.00 61.69 62.09 1lo4 s THR 122 Cb -0.37 -0.95 -0.10 0.00 0.01 0.00 0.00 72.50 71.09 1lo4 s THR 122 CO 0.33 0.33 0.98 0.00 -0.69 0.00 0.00 174.62 175.57 1lo4 s ALA 123 N 0.70 3.22 0.55 7.40 0.00 -1.26 -1.48 121.76 130.87 1lo4 s ALA 123 Ca -0.14 0.60 -0.16 0.00 0.00 0.00 0.00 51.96 52.25 1lo4 s ALA 123 Cb -0.16 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 1lo4 s ALA 123 CO 0.03 0.08 1.02 -1.25 0.00 0.00 0.00 175.76 175.64 1lo4 s PRO 124 N -2.00 3.69 -0.08 0.00 0.04 -1.26 -4.55 135.00 130.83 1lo4 s PRO 124 Ca 0.50 1.07 -0.11 0.00 0.04 0.00 0.00 61.00 62.51 1lo4 s PRO 124 Cb -0.21 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 1lo4 s PRO 124 CO 0.27 -0.50 0.26 -1.12 0.04 0.00 0.00 177.00 175.94 1lo4 s SER 125 N -2.91 6.55 -0.20 6.66 0.01 0.12 -4.90 113.70 119.03 1lo4 s SER 125 Ca 0.61 0.66 -0.01 0.00 1.31 0.00 0.00 55.95 58.52 1lo4 s SER 125 Cb -0.13 -2.15 0.01 0.00 0.21 0.00 0.00 66.02 63.96 1lo4 s SER 125 CO 0.33 0.34 -0.12 -0.69 0.41 0.00 0.00 173.24 173.51 1lo4 s VAL 126 N -0.88 2.67 -0.06 3.43 1.01 -1.26 -0.30 120.40 125.00 1lo4 s VAL 126 Ca 0.18 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.45 1lo4 s VAL 126 Cb -0.14 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1lo4 s VAL 126 CO 0.07 0.47 -0.21 -0.31 0.00 0.00 0.00 175.10 175.12 1lo4 s TYR 127 N 1.37 2.54 -0.11 5.22 2.02 0.55 -4.98 117.35 123.97 1lo4 s TYR 127 Ca 0.05 -0.57 -0.23 0.00 -0.37 0.00 0.00 57.07 55.96 1lo4 s TYR 127 Cb -0.14 -1.63 -0.03 0.00 -0.40 0.00 0.00 41.96 39.76 1lo4 s TYR 127 CO -0.08 -0.11 0.69 -1.25 -1.57 0.00 0.00 175.55 173.22 1lo4 s PRO 128 N -0.25 4.37 -0.38 -1.71 0.04 -1.26 -0.63 135.00 135.18 1lo4 s PRO 128 Ca -0.00 0.82 -0.01 0.00 0.04 0.00 0.00 61.00 61.84 1lo4 s PRO 128 Cb -0.13 -3.49 0.10 0.00 0.04 0.00 0.00 34.50 31.02 1lo4 s PRO 128 CO 0.03 -0.04 0.14 -0.51 0.04 0.00 0.00 177.00 176.65 1lo4 s LEU 129 N 1.19 4.92 0.31 -3.56 1.43 0.07 -4.96 118.68 118.07 1lo4 s LEU 129 Ca 0.35 -1.93 -0.00 0.00 -1.03 0.00 0.00 54.13 51.52 1lo4 s LEU 129 Cb -0.17 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 1lo4 s LEU 129 CO 0.15 -0.46 0.51 0.00 0.23 0.00 0.00 176.35 176.78 1lo4 s ALA 130 N 1.11 3.72 0.94 4.21 0.00 -1.26 -0.53 121.76 129.95 1lo4 s ALA 130 Ca 0.06 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 51.04 1lo4 s ALA 130 Cb -0.21 -2.09 0.15 0.00 0.00 0.00 0.00 23.12 20.97 1lo4 s ALA 130 CO -0.04 0.10 1.11 -2.14 0.00 0.00 0.00 175.76 174.78 1lo4 s PRO 131 N -4.04 0.89 -0.06 0.00 0.02 -1.26 -4.96 135.00 125.59 1lo4 s PRO 131 Ca 0.40 1.26 -0.15 0.00 0.02 0.00 0.00 61.00 62.52 1lo4 s PRO 131 Cb -0.10 -1.73 -0.10 0.00 0.02 0.00 0.00 34.50 32.58 1lo4 s PRO 131 CO 0.34 -2.62 0.61 -0.39 -0.33 0.00 0.00 177.00 174.61 1lo4 h VAL 132 N -1.85 0.39 0.00 3.83 -1.51 -1.95 -3.43 116.25 111.73 1lo4 h VAL 132 Ca -0.47 -0.94 0.00 0.00 -1.23 0.00 0.00 66.70 64.06 1lo4 h VAL 132 Cb 1.28 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 1lo4 h VAL 132 CO 0.47 0.11 0.00 0.00 -1.23 0.00 0.00 177.57 176.91 1lo4 n GLY 134 N 0.00 -0.58 1.30 0.00 0.00 -1.26 -4.44 105.19 100.21 1lo4 n GLY 134 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1lo4 n GLY 134 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lo4 n ASP 135 N -2.78 3.72 0.00 1.61 8.00 -1.26 -2.87 116.55 122.97 1lo4 n ASP 135 Ca -0.30 -2.01 0.00 0.00 0.71 0.00 0.00 54.79 53.20 1lo4 n ASP 135 Cb 0.96 -0.73 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1lo4 n ASP 135 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1lo4 n THR 136 N 1.09 0.00 -2.37 -3.53 5.66 -1.26 -4.08 114.28 109.79 1lo4 n THR 136 Ca 0.00 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.75 1lo4 n THR 136 Cb 0.44 0.03 0.01 0.00 -1.55 0.00 0.00 70.33 69.25 1lo4 n THR 136 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1lo4 n THR 137 N 0.00 2.34 -3.95 1.09 -1.04 -1.14 -5.02 114.28 106.56 1lo4 n THR 137 Ca 0.00 -4.65 -0.12 0.00 -2.04 0.00 0.00 64.05 57.24 1lo4 n THR 137 Cb 0.22 -1.12 -0.01 0.00 -1.82 0.00 0.00 70.33 67.59 1lo4 n THR 137 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1lo4 n GLY 138 N -0.52 1.89 0.55 3.41 0.00 -1.26 -5.03 105.19 104.22 1lo4 n GLY 138 Ca 0.39 -1.50 0.40 0.00 0.00 0.00 0.00 46.02 45.30 1lo4 n GLY 138 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1lo4 h SER 139 N 1.83 0.14 -5.14 1.61 0.02 -1.98 -3.39 113.55 106.63 1lo4 h SER 139 Ca -0.27 0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 60.62 1lo4 h SER 139 Cb 1.11 0.05 -0.16 0.00 0.14 0.00 0.00 62.40 63.54 1lo4 h SER 139 CO 0.36 -0.06 -0.55 -0.44 -1.14 0.00 0.00 176.83 175.00 1lo4 s SER 140 N -4.56 0.27 0.09 3.07 0.01 -1.26 -1.22 113.70 110.10 1lo4 s SER 140 Ca -0.06 -0.70 0.07 0.00 1.31 0.00 0.00 55.95 56.56 1lo4 s SER 140 Cb 0.27 0.23 -0.03 0.00 0.21 0.00 0.00 66.02 66.70 1lo4 s SER 140 CO 0.84 -0.57 -0.17 0.54 0.41 0.00 0.00 173.24 174.29 1lo4 s VAL 141 N -3.21 1.40 -0.10 3.43 0.11 0.14 -4.65 120.40 117.52 1lo4 s VAL 141 Ca 0.00 -1.45 0.04 0.00 -2.93 0.00 0.00 61.98 57.64 1lo4 s VAL 141 Cb 0.02 -1.33 -0.00 0.00 -1.53 0.00 0.00 36.38 33.54 1lo4 s VAL 141 CO -0.07 -0.17 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.41 1lo4 s THR 142 N -1.30 2.15 0.19 5.04 2.01 -1.26 -1.20 115.64 121.27 1lo4 s THR 142 Ca 0.03 -0.99 0.11 0.00 0.31 0.00 0.00 61.69 61.15 1lo4 s THR 142 Cb -0.10 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 1lo4 s THR 142 CO 0.03 0.56 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.53 1lo4 s LEU 143 N 0.32 2.44 0.00 4.42 1.43 -0.56 -4.43 118.68 122.30 1lo4 s LEU 143 Ca -0.18 -0.87 0.05 0.00 -1.03 0.00 0.00 54.13 52.10 1lo4 s LEU 143 Cb -0.18 -1.11 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 1lo4 s LEU 143 CO 0.09 0.09 0.18 0.61 0.23 0.00 0.00 176.35 177.55 1lo4 n GLY 144 N 0.24 3.21 3.12 -3.19 0.00 0.31 -0.84 105.19 108.04 1lo4 n GLY 144 Ca -0.12 -1.98 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 1lo4 n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lo4 s LEU 146 N 1.89 3.56 -0.30 0.00 2.96 0.20 -1.87 118.68 125.12 1lo4 s LEU 146 Ca -0.05 -0.05 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 1lo4 s LEU 146 Cb -0.11 -1.90 0.06 0.00 0.50 0.00 0.00 46.19 44.74 1lo4 s LEU 146 CO -0.10 0.13 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.35 1lo4 s VAL 147 N 0.64 2.80 -0.03 1.68 1.01 0.05 -0.33 120.40 126.22 1lo4 s VAL 147 Ca 0.01 -1.51 0.07 0.00 0.00 0.00 0.00 61.98 60.56 1lo4 s VAL 147 Cb -0.14 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.58 1lo4 s VAL 147 CO 0.02 -0.14 -0.24 -0.75 0.00 0.00 0.00 175.10 173.99 1lo4 s LYS 148 N 1.20 2.25 -0.63 2.72 2.20 0.58 -0.99 119.74 127.08 1lo4 s LYS 148 Ca -0.05 -0.89 -0.03 0.00 -0.36 0.00 0.00 55.97 54.65 1lo4 s LYS 148 Cb -0.20 -2.12 0.00 0.00 -1.51 0.00 0.00 37.83 34.00 1lo4 s LYS 148 CO -0.02 0.54 0.54 0.41 -0.36 0.00 0.00 175.35 176.46 1lo4 n GLY 149 N 2.50 0.17 3.80 5.54 0.00 -0.88 0.14 105.19 116.45 1lo4 n GLY 149 Ca -0.16 -0.22 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 1lo4 n GLY 149 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1lo4 s TYR 150 N -3.16 2.90 -0.21 1.61 1.13 -0.89 -4.40 117.35 114.33 1lo4 s TYR 150 Ca 0.18 -0.26 -0.24 0.00 -1.41 0.00 0.00 57.07 55.35 1lo4 s TYR 150 Cb -0.08 -1.59 0.06 0.00 -1.10 0.00 0.00 41.96 39.26 1lo4 s TYR 150 CO 0.35 0.36 0.65 0.12 -2.51 0.00 0.00 175.55 174.52 1lo4 s PHE 151 N -2.28 -0.70 0.00 -3.49 2.19 -0.55 0.63 117.98 113.78 1lo4 s PHE 151 Ca 0.37 1.63 0.00 0.00 0.33 0.00 0.00 56.93 59.26 1lo4 s PHE 151 Cb -0.06 0.27 0.00 0.00 -1.31 0.00 0.00 43.02 41.92 1lo4 s PHE 151 CO 0.25 -0.39 0.00 -0.35 1.83 0.00 0.00 175.22 176.55 1lo4 n PRO 152 N 2.40 0.74 -1.32 10.12 -0.04 -1.26 -1.22 135.00 144.42 1lo4 n PRO 152 Ca -0.15 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.98 1lo4 n PRO 152 Cb 0.56 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.11 1lo4 n PRO 152 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1lo4 s GLU 153 N -2.21 2.07 0.54 0.54 0.41 -1.26 -4.73 118.70 114.07 1lo4 s GLU 153 Ca 0.00 1.52 0.08 0.00 -0.41 0.00 0.00 54.97 56.17 1lo4 s GLU 153 Cb 0.00 -1.85 0.06 0.00 -1.78 0.00 0.00 34.13 30.56 1lo4 s GLU 153 CO 0.00 -1.83 0.65 -1.25 -0.49 0.00 0.00 175.26 172.34 1lo4 s PRO 154 N -4.29 2.38 0.19 0.39 0.04 -1.26 -4.96 135.00 127.48 1lo4 s PRO 154 Ca 0.69 -1.67 0.11 0.00 0.04 0.00 0.00 61.00 60.17 1lo4 s PRO 154 Cb -0.24 -2.53 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 1lo4 s PRO 154 CO 0.49 -0.69 -0.24 0.14 0.04 0.00 0.00 177.00 176.74 1lo4 s VAL 155 N -2.64 2.34 -0.07 -0.36 -7.23 -1.26 -4.56 120.40 106.62 1lo4 s VAL 155 Ca 0.54 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.67 1lo4 s VAL 155 Cb -0.05 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.74 1lo4 s VAL 155 CO 0.34 -0.11 0.03 -0.89 -0.31 0.00 0.00 175.10 174.15 1lo4 s THR 156 N -1.66 4.48 -0.02 5.32 2.01 0.14 -4.94 115.64 120.97 1lo4 s THR 156 Ca 0.20 -0.25 0.00 0.00 0.31 0.00 0.00 61.69 61.96 1lo4 s THR 156 Cb -0.08 -2.92 0.02 0.00 0.01 0.00 0.00 72.50 69.53 1lo4 s THR 156 CO 0.10 0.56 0.00 -0.22 -0.69 0.00 0.00 174.62 174.36 1lo4 s LEU 157 N -1.06 1.31 0.22 4.42 0.20 -1.25 0.15 118.68 122.68 1lo4 s LEU 157 Ca 0.15 -0.02 -0.02 0.00 0.69 0.00 0.00 54.13 54.93 1lo4 s LEU 157 Cb -0.11 -0.17 -0.03 0.00 -0.43 0.00 0.00 46.19 45.44 1lo4 s LEU 157 CO 0.05 -0.08 0.21 0.42 -0.29 0.00 0.00 176.35 176.66 1lo4 s THR 158 N 0.82 0.00 -0.09 3.68 -4.23 -0.37 -4.97 115.64 110.48 1lo4 s THR 158 Ca -0.08 -1.89 0.04 0.00 -1.18 0.00 0.00 61.69 58.58 1lo4 s THR 158 Cb -0.11 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.26 1lo4 s THR 158 CO -0.02 0.00 -0.21 0.26 -0.54 0.00 0.00 174.62 174.11 1lo4 s TRP 159 N -4.04 2.58 -1.40 3.99 0.52 -1.26 0.19 118.94 119.53 1lo4 s TRP 159 Ca 0.36 -0.80 -0.07 0.00 0.02 0.00 0.00 56.10 55.62 1lo4 s TRP 159 Cb 0.05 -1.69 0.04 0.00 -1.15 0.00 0.00 33.47 30.71 1lo4 s TRP 159 CO 0.13 -0.27 0.88 0.09 0.02 0.00 0.00 176.95 177.80 1lo4 n ASN 160 N 3.25 -3.22 -3.95 2.95 4.13 0.22 -0.52 115.26 118.13 1lo4 n ASN 160 Ca -0.18 -0.77 -0.32 0.00 1.68 0.00 0.00 54.58 55.00 1lo4 n ASN 160 Cb 0.53 -4.13 -0.00 0.00 -1.54 0.00 0.00 39.78 34.63 1lo4 n ASN 160 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1lo4 n SER 161 N -2.96 -4.04 0.00 6.41 7.64 -1.26 -1.68 113.62 117.72 1lo4 n SER 161 Ca -0.13 -0.80 0.00 0.00 1.01 0.00 0.00 58.87 58.95 1lo4 n SER 161 Cb 0.60 -3.28 0.00 0.00 -1.01 0.00 0.00 64.21 60.53 1lo4 n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lo4 n GLY 162 N -1.47 1.14 0.13 0.23 0.00 0.32 -4.88 105.19 100.65 1lo4 n GLY 162 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.03 1lo4 n GLY 162 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1lo4 h SER 163 N 0.00 0.11 -3.55 1.61 4.64 -1.28 -3.39 113.55 111.68 1lo4 h SER 163 Ca 0.00 -0.08 -0.68 0.00 -0.47 0.00 0.00 61.79 60.57 1lo4 h SER 163 Cb 0.00 -0.03 -0.17 0.00 -0.31 0.00 0.00 62.40 61.89 1lo4 h SER 163 CO 0.00 0.80 -0.06 -0.22 -0.87 0.00 0.00 176.83 176.47 1lo4 s LEU 164 N -7.50 4.72 0.00 5.97 0.20 -1.07 -4.81 118.68 116.20 1lo4 s LEU 164 Ca -0.02 -0.54 0.00 0.00 0.69 0.00 0.00 54.13 54.26 1lo4 s LEU 164 Cb 0.12 -2.53 0.00 0.00 -0.43 0.00 0.00 46.19 43.34 1lo4 s LEU 164 CO 0.79 -0.67 0.00 -1.54 -0.29 0.00 0.00 176.35 174.64 1lo4 n SER 165 N 5.89 0.18 -4.86 3.68 3.41 -1.26 -4.08 113.62 116.58 1lo4 n SER 165 Ca -0.05 -0.02 -0.31 0.00 -0.26 0.00 0.00 58.87 58.22 1lo4 n SER 165 Cb 0.47 0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 1lo4 n SER 165 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1lo4 s SER 166 N -0.12 6.60 0.00 4.04 0.01 -1.26 -3.95 113.70 119.02 1lo4 s SER 166 Ca 0.00 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.57 1lo4 s SER 166 Cb 0.00 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.83 1lo4 s SER 166 CO 0.00 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 173.82 1lo4 n GLY 167 N -1.26 0.41 3.82 3.44 0.00 -1.26 -4.65 105.19 105.68 1lo4 n GLY 167 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1lo4 n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lo4 s VAL 168 N -1.84 5.20 -0.15 1.61 1.01 -1.25 -1.21 120.40 123.76 1lo4 s VAL 168 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1lo4 s VAL 168 Cb 0.00 -3.26 0.04 0.00 0.00 0.00 0.00 36.38 33.16 1lo4 s VAL 168 CO 0.00 0.60 -0.07 -1.00 0.00 0.00 0.00 175.10 174.63 1lo4 s HIS 169 N -0.87 1.78 -0.22 5.22 3.76 0.02 -4.98 115.29 119.98 1lo4 s HIS 169 Ca 0.14 -1.07 -0.05 0.00 -0.15 0.00 0.00 55.06 53.93 1lo4 s HIS 169 Cb -0.12 -1.36 -0.02 0.00 1.11 0.00 0.00 32.58 32.20 1lo4 s HIS 169 CO 0.03 -0.61 -0.01 0.99 -0.85 0.00 0.00 174.74 174.29 1lo4 s THR 170 N 1.61 3.67 0.11 1.30 2.01 -1.26 -1.10 115.64 121.98 1lo4 s THR 170 Ca 0.02 -0.39 -0.13 0.00 0.31 0.00 0.00 61.69 61.49 1lo4 s THR 170 Cb -0.14 -2.68 -0.06 0.00 0.01 0.00 0.00 72.50 69.62 1lo4 s THR 170 CO -0.08 0.40 0.50 -0.36 -0.69 0.00 0.00 174.62 174.39 1lo4 s PHE 171 N 1.45 3.62 0.49 4.92 0.40 0.15 -5.00 117.98 124.01 1lo4 s PHE 171 Ca 0.05 0.99 -0.23 0.00 -0.60 0.00 0.00 56.93 57.15 1lo4 s PHE 171 Cb -0.14 -2.31 -0.06 0.00 0.51 0.00 0.00 43.02 41.01 1lo4 s PHE 171 CO -0.01 0.48 1.32 -2.14 0.70 0.00 0.00 175.22 175.57 1lo4 s PRO 172 N -1.82 3.48 0.50 0.24 0.02 -1.26 -4.28 135.00 131.87 1lo4 s PRO 172 Ca 0.35 2.14 -0.22 0.00 0.02 0.00 0.00 61.00 63.30 1lo4 s PRO 172 Cb -0.15 -2.42 -0.07 0.00 0.02 0.00 0.00 34.50 31.88 1lo4 s PRO 172 CO 0.18 -0.89 1.17 0.00 -0.33 0.00 0.00 177.00 177.14 1lo4 s ALA 173 N -1.34 2.86 0.05 -1.55 0.00 -1.26 -4.82 121.76 115.71 1lo4 s ALA 173 Ca 0.66 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.64 1lo4 s ALA 173 Cb -0.38 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.32 1lo4 s ALA 173 CO 0.46 -0.77 -0.21 0.14 0.00 0.00 0.00 175.76 175.38 1lo4 s VAL 174 N -1.59 2.58 -0.10 0.00 -7.23 0.99 -4.90 120.40 110.15 1lo4 s VAL 174 Ca 0.67 -1.29 -0.08 0.00 -1.81 0.00 0.00 61.98 59.48 1lo4 s VAL 174 Cb -0.28 -2.08 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 1lo4 s VAL 174 CO 0.33 0.32 0.18 -0.22 -0.31 0.00 0.00 175.10 175.40 1lo4 s LEU 175 N -1.46 4.40 -0.24 1.32 2.96 -1.26 -0.66 118.68 123.73 1lo4 s LEU 175 Ca 0.14 0.52 -0.04 0.00 -0.22 0.00 0.00 54.13 54.53 1lo4 s LEU 175 Cb -0.10 -2.17 0.08 0.00 0.50 0.00 0.00 46.19 44.50 1lo4 s LEU 175 CO 0.05 0.39 0.11 -1.58 -1.32 0.00 0.00 176.35 173.99 1lo4 s GLN 176 N -1.11 0.22 -1.07 1.98 -0.44 0.41 -4.93 119.66 114.72 1lo4 s GLN 176 Ca 0.17 -0.41 -0.21 0.00 -2.50 0.00 0.00 55.36 52.41 1lo4 s GLN 176 Cb -0.13 -1.52 0.02 0.00 -1.64 0.00 0.00 33.01 29.75 1lo4 s GLN 176 CO 0.06 -0.87 0.68 -1.13 0.50 0.00 0.00 175.29 174.53 1lo4 n SER 177 N 5.22 -4.71 0.00 6.67 3.41 -1.26 -1.18 113.62 121.77 1lo4 n SER 177 Ca -0.06 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.44 1lo4 n SER 177 Cb 0.45 -2.10 0.00 0.00 -0.26 0.00 0.00 64.21 62.30 1lo4 n SER 177 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1lo4 n ASP 178 N -2.36 -2.80 -4.23 4.04 10.43 -1.26 -4.99 116.55 115.38 1lo4 n ASP 178 Ca -0.17 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 56.93 1lo4 n ASP 178 Cb 0.60 -1.54 -0.15 0.00 1.84 0.00 0.00 41.12 41.87 1lo4 n ASP 178 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1lo4 s LEU 179 N 0.00 2.09 0.06 0.64 1.43 -0.33 -4.72 118.68 117.85 1lo4 s LEU 179 Ca 0.00 -0.43 -0.08 0.00 -1.03 0.00 0.00 54.13 52.59 1lo4 s LEU 179 Cb 0.00 -1.02 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 1lo4 s LEU 179 CO 0.00 0.21 0.34 -0.31 0.23 0.00 0.00 176.35 176.82 1lo4 s TYR 180 N -0.61 3.56 0.03 0.29 2.02 0.21 0.15 117.35 123.01 1lo4 s TYR 180 Ca 0.08 0.65 0.02 0.00 -0.37 0.00 0.00 57.07 57.45 1lo4 s TYR 180 Cb -0.08 -2.06 -0.02 0.00 -0.40 0.00 0.00 41.96 39.40 1lo4 s TYR 180 CO 0.00 0.55 -0.07 -0.08 -1.57 0.00 0.00 175.55 174.38 1lo4 s THR 181 N -1.39 0.49 0.09 -0.71 -1.32 0.16 -2.08 115.64 110.88 1lo4 s THR 181 Ca 0.32 -0.87 -0.11 0.00 -1.21 0.00 0.00 61.69 59.82 1lo4 s THR 181 Cb -0.13 -0.53 0.01 0.00 -1.51 0.00 0.00 72.50 70.33 1lo4 s THR 181 CO 0.18 -0.27 0.25 -0.22 -2.21 0.00 0.00 174.62 172.36 1lo4 s LEU 182 N -1.22 1.13 0.15 9.08 0.20 -0.16 -0.01 118.68 127.85 1lo4 s LEU 182 Ca -0.07 -0.51 -0.10 0.00 0.69 0.00 0.00 54.13 54.14 1lo4 s LEU 182 Cb -0.08 1.25 -0.00 0.00 -0.43 0.00 0.00 46.19 46.93 1lo4 s LEU 182 CO 0.00 -0.73 0.30 -0.94 -0.29 0.00 0.00 176.35 174.69 1lo4 s SER 183 N -2.71 0.00 -0.11 3.68 1.04 -1.26 -0.77 113.70 113.57 1lo4 s SER 183 Ca 0.03 -0.75 -0.13 0.00 0.48 0.00 0.00 55.95 55.58 1lo4 s SER 183 Cb 0.03 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.62 1lo4 s SER 183 CO -0.10 -0.88 0.35 -0.55 0.98 0.00 0.00 173.24 173.04 1lo4 s SER 184 N -2.93 -0.34 0.21 7.02 0.15 -0.78 -0.68 113.70 116.35 1lo4 s SER 184 Ca 0.13 0.61 0.11 0.00 0.70 0.00 0.00 55.95 57.51 1lo4 s SER 184 Cb 0.03 0.66 -0.05 0.00 -1.71 0.00 0.00 66.02 64.95 1lo4 s SER 184 CO -0.03 -0.18 -0.23 -0.94 1.20 0.00 0.00 173.24 173.06 1lo4 s SER 185 N -0.08 3.38 -0.01 5.45 1.04 -0.26 -0.86 113.70 122.36 1lo4 s SER 185 Ca -0.02 -0.90 -0.01 0.00 0.48 0.00 0.00 55.95 55.50 1lo4 s SER 185 Cb -0.03 -0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.85 1lo4 s SER 185 CO 0.01 0.09 0.03 0.54 0.98 0.00 0.00 173.24 174.89 1lo4 s VAL 186 N -1.88 -0.01 -0.19 5.02 0.11 -0.02 -0.80 120.40 122.63 1lo4 s VAL 186 Ca 0.22 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.32 1lo4 s VAL 186 Cb -0.07 -0.06 0.03 0.00 -1.53 0.00 0.00 36.38 34.75 1lo4 s VAL 186 CO 0.10 0.02 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.82 1lo4 s THR 187 N 0.23 2.01 0.27 5.04 2.01 -0.35 -1.49 115.64 123.35 1lo4 s THR 187 Ca -0.02 -0.99 0.03 0.00 0.31 0.00 0.00 61.69 61.03 1lo4 s THR 187 Cb -0.03 -1.86 -0.06 0.00 0.01 0.00 0.00 72.50 70.56 1lo4 s THR 187 CO -0.01 0.46 0.04 0.68 -0.69 0.00 0.00 174.62 175.11 1lo4 s VAL 188 N 1.29 0.97 0.49 3.82 -7.23 -0.34 -4.61 120.40 114.80 1lo4 s VAL 188 Ca 0.03 -2.01 -0.22 0.00 -1.81 0.00 0.00 61.98 57.97 1lo4 s VAL 188 Cb -0.14 -2.58 -0.06 0.00 0.56 0.00 0.00 36.38 34.16 1lo4 s VAL 188 CO -0.12 -0.13 1.22 0.42 -0.31 0.00 0.00 175.10 176.18 1lo4 s THR 189 N -3.46 2.81 0.67 5.32 -4.23 -1.26 0.23 115.64 115.71 1lo4 s THR 189 Ca 0.34 0.60 0.39 0.00 -1.18 0.00 0.00 61.69 61.84 1lo4 s THR 189 Cb 0.07 -3.30 0.39 0.00 1.34 0.00 0.00 72.50 71.01 1lo4 s THR 189 CO 0.12 -0.02 2.20 -1.28 -0.54 0.00 0.00 174.62 175.11 1lo4 h SER 190 N 1.79 0.00 -0.55 3.99 0.87 -1.37 0.73 113.55 119.01 1lo4 h SER 190 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 1lo4 h SER 190 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 1lo4 h SER 190 CO 0.59 0.00 0.00 -1.54 -0.53 0.00 0.00 176.83 175.35 1lo4 n SER 191 N -3.02 3.58 -0.07 6.23 3.41 -1.26 -3.97 113.62 118.52 1lo4 n SER 191 Ca -0.03 -2.20 -0.22 0.00 -0.26 0.00 0.00 58.87 56.16 1lo4 n SER 191 Cb 0.19 -0.46 -0.12 0.00 -0.26 0.00 0.00 64.21 63.56 1lo4 n SER 191 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1lo4 n THR 192 N 1.03 1.62 -4.25 6.66 -1.04 0.25 -4.78 114.28 113.77 1lo4 n THR 192 Ca 0.20 -0.40 -0.18 0.00 -2.04 0.00 0.00 64.05 61.63 1lo4 n THR 192 Cb 0.63 -1.81 -0.15 0.00 -1.82 0.00 0.00 70.33 67.18 1lo4 n THR 192 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1lo4 s TRP 193 N -2.48 0.71 -2.01 -1.42 -0.00 -1.21 0.20 118.94 112.73 1lo4 s TRP 193 Ca -0.29 -0.16 0.19 0.00 -0.00 0.00 0.00 56.10 55.84 1lo4 s TRP 193 Cb 0.08 -0.52 1.13 0.00 -0.00 0.00 0.00 33.47 34.16 1lo4 s TRP 193 CO 0.64 -0.08 1.73 -0.35 -0.00 0.00 0.00 176.95 178.90 1lo4 n PRO 194 N 3.30 1.02 -0.26 5.86 -0.04 -1.26 -4.77 135.00 138.85 1lo4 n PRO 194 Ca -0.18 -0.02 0.03 0.00 -0.04 0.00 0.00 63.50 63.28 1lo4 n PRO 194 Cb 0.55 -1.30 0.16 0.00 -0.04 0.00 0.00 33.50 32.87 1lo4 n PRO 194 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1lo4 h SER 195 N 0.05 0.49 -1.03 3.54 0.87 -1.84 -3.40 113.55 112.22 1lo4 h SER 195 Ca 0.00 0.07 -0.49 0.00 -1.23 0.00 0.00 61.79 60.13 1lo4 h SER 195 Cb 0.01 -0.02 0.04 0.00 -0.44 0.00 0.00 62.40 62.00 1lo4 h SER 195 CO 0.00 0.27 -0.03 -1.10 -0.53 0.00 0.00 176.83 175.44 1lo4 s GLN 196 N -6.04 2.05 -0.08 2.24 -1.52 0.13 -5.10 119.66 111.34 1lo4 s GLN 196 Ca -0.12 -1.57 -0.19 0.00 -1.95 0.00 0.00 55.36 51.53 1lo4 s GLN 196 Cb 0.19 -2.55 -0.05 0.00 -0.22 0.00 0.00 33.01 30.38 1lo4 s GLN 196 CO 0.77 -1.10 0.51 0.45 -0.25 0.00 0.00 175.29 175.66 1lo4 s SER 197 N -4.73 6.78 -0.11 5.90 0.15 -1.26 -4.67 113.70 115.75 1lo4 s SER 197 Ca 0.64 0.93 0.02 0.00 0.70 0.00 0.00 55.95 58.25 1lo4 s SER 197 Cb -0.05 -2.31 0.01 0.00 -1.71 0.00 0.00 66.02 61.97 1lo4 s SER 197 CO 0.41 0.05 -0.18 -0.63 1.20 0.00 0.00 173.24 174.09 1lo4 s ILE 198 N 0.25 1.73 -0.03 6.45 -1.09 -1.26 -4.95 121.20 122.30 1lo4 s ILE 198 Ca 0.27 -0.79 0.02 0.00 -2.23 0.00 0.00 60.65 57.92 1lo4 s ILE 198 Cb -0.16 -1.55 0.01 0.00 -1.58 0.00 0.00 42.46 39.18 1lo4 s ILE 198 CO 0.13 0.49 -0.07 -0.89 -1.23 0.00 0.00 174.94 173.37 1lo4 s THR 199 N 0.83 0.63 -0.09 2.92 2.01 -1.26 -0.71 115.64 119.96 1lo4 s THR 199 Ca -0.09 -0.24 -0.24 0.00 0.31 0.00 0.00 61.69 61.43 1lo4 s THR 199 Cb -0.16 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.73 1lo4 s THR 199 CO 0.00 0.22 0.74 0.00 -0.69 0.00 0.00 174.62 174.89 1lo4 s ASN 201 N 0.91 4.39 -0.09 0.00 0.01 0.13 -0.90 114.94 119.40 1lo4 s ASN 201 Ca 0.38 -0.71 0.04 0.00 -0.71 0.00 0.00 52.86 51.86 1lo4 s ASN 201 Cb -0.18 -1.71 0.00 0.00 0.41 0.00 0.00 41.25 39.78 1lo4 s ASN 201 CO 0.17 -0.10 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.75 1lo4 s VAL 202 N 1.39 1.83 -0.06 1.60 1.01 0.07 -1.23 120.40 125.01 1lo4 s VAL 202 Ca 0.02 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1lo4 s VAL 202 Cb -0.16 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.64 1lo4 s VAL 202 CO -0.03 0.51 -0.16 0.00 0.00 0.00 0.00 175.10 175.42 1lo4 s ALA 203 N 0.34 1.48 -0.46 5.51 0.00 0.12 -0.85 121.76 127.91 1lo4 s ALA 203 Ca -0.16 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.22 1lo4 s ALA 203 Cb -0.17 -0.56 0.14 0.00 0.00 0.00 0.00 23.12 22.53 1lo4 s ALA 203 CO 0.07 0.21 0.27 -1.58 0.00 0.00 0.00 175.76 174.73 1lo4 s HIS 204 N 0.34 2.04 0.24 0.00 2.46 0.66 0.27 115.29 121.30 1lo4 s HIS 204 Ca -0.10 -2.49 -0.07 0.00 0.47 0.00 0.00 55.06 52.87 1lo4 s HIS 204 Cb -0.14 -1.87 0.41 0.00 -0.13 0.00 0.00 32.58 30.85 1lo4 s HIS 204 CO 0.04 -0.77 1.65 -1.35 -2.47 0.00 0.00 174.74 171.84 1lo4 h PRO 205 N 6.53 0.13 -0.82 2.88 0.11 -1.80 -0.81 132.00 138.23 1lo4 h PRO 205 Ca 0.03 -0.01 0.16 0.00 0.11 0.00 0.00 66.00 66.29 1lo4 h PRO 205 Cb 0.91 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 31.93 1lo4 h PRO 205 CO 0.49 0.09 0.54 0.00 -0.21 0.00 0.00 178.00 178.91 1lo4 h ALA 206 N 1.65 2.05 -0.34 -0.75 0.00 -1.92 0.18 119.26 120.12 1lo4 h ALA 206 Ca 0.39 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1lo4 h ALA 206 Cb 0.68 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1lo4 h ALA 206 CO -0.60 -0.28 0.00 -1.13 0.00 0.00 0.00 179.25 177.24 1lo4 n SER 207 N -4.51 3.03 -3.58 0.00 3.41 -0.89 -4.98 113.62 106.10 1lo4 n SER 207 Ca 0.16 -1.93 -0.26 0.00 -0.26 0.00 0.00 58.87 56.58 1lo4 n SER 207 Cb 0.54 -0.22 0.05 0.00 -0.26 0.00 0.00 64.21 64.32 1lo4 n SER 207 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1lo4 n SER 208 N 1.22 -4.98 -4.11 4.04 7.64 0.61 -4.95 113.62 113.09 1lo4 n SER 208 Ca 0.19 -0.91 -0.33 0.00 1.01 0.00 0.00 58.87 58.82 1lo4 n SER 208 Cb 0.54 -3.93 -0.16 0.00 -1.01 0.00 0.00 64.21 59.65 1lo4 n SER 208 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1lo4 s THR 209 N -3.49 2.05 -0.17 0.44 2.01 -0.39 -4.99 115.64 111.10 1lo4 s THR 209 Ca 0.40 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 61.39 1lo4 s THR 209 Cb -0.12 -1.88 0.05 0.00 0.01 0.00 0.00 72.50 70.57 1lo4 s THR 209 CO 0.82 0.49 0.01 -1.58 -0.69 0.00 0.00 174.62 173.67 1lo4 s GLN 210 N 1.28 0.88 0.01 4.92 2.00 -1.26 -0.24 119.66 127.25 1lo4 s GLN 210 Ca 0.04 -0.41 -0.12 0.00 -2.00 0.00 0.00 55.36 52.87 1lo4 s GLN 210 Cb -0.14 -1.96 0.01 0.00 0.80 0.00 0.00 33.01 31.73 1lo4 s GLN 210 CO -0.12 -0.55 0.24 0.54 -0.50 0.00 0.00 175.29 174.91 1lo4 s VAL 211 N 1.79 0.08 -0.02 1.34 0.11 -0.03 -5.01 120.40 118.66 1lo4 s VAL 211 Ca -0.00 -0.66 0.02 0.00 -2.93 0.00 0.00 61.98 58.41 1lo4 s VAL 211 Cb -0.16 -0.71 0.00 0.00 -1.53 0.00 0.00 36.38 33.98 1lo4 s VAL 211 CO -0.07 -0.37 -0.08 -1.81 -3.33 0.00 0.00 175.10 169.44 1lo4 s ASP 212 N -1.67 1.02 -0.05 3.54 -0.00 -1.26 -0.75 116.67 117.51 1lo4 s ASP 212 Ca -0.10 -0.16 0.01 0.00 -0.00 0.00 0.00 52.55 52.30 1lo4 s ASP 212 Cb -0.04 -0.22 0.02 0.00 -0.00 0.00 0.00 42.92 42.69 1lo4 s ASP 212 CO 0.00 0.07 -0.05 -0.54 -0.00 0.00 0.00 175.17 174.66 1lo4 s LYS 213 N 0.07 0.85 -0.04 8.23 3.01 -0.07 -4.98 119.74 126.81 1lo4 s LYS 213 Ca -0.01 -0.11 -0.16 0.00 -1.01 0.00 0.00 55.97 54.68 1lo4 s LYS 213 Cb -0.06 -0.86 -0.05 0.00 -1.01 0.00 0.00 37.83 35.84 1lo4 s LYS 213 CO 0.00 -0.09 0.44 0.21 0.51 0.00 0.00 175.35 176.42 1lo4 s LYS 214 N 0.95 4.11 -0.31 1.68 2.20 -1.26 0.86 119.74 127.98 1lo4 s LYS 214 Ca -0.10 0.44 -0.29 0.00 -0.36 0.00 0.00 55.97 55.66 1lo4 s LYS 214 Cb -0.14 -3.31 -0.01 0.00 -1.51 0.00 0.00 37.83 32.86 1lo4 s LYS 214 CO -0.00 0.48 1.52 0.42 -0.36 0.00 0.00 175.35 177.42 1lo4 s ILE 215 N -0.43 3.81 -0.18 5.43 -1.09 0.11 -4.89 121.20 123.97 1lo4 s ILE 215 Ca 0.25 0.88 -0.06 0.00 -2.23 0.00 0.00 60.65 59.49 1lo4 s ILE 215 Cb -0.16 -3.93 -0.03 0.00 -1.58 0.00 0.00 42.46 36.76 1lo4 s ILE 215 CO 0.12 -0.48 0.03 0.68 -1.23 0.00 0.00 174.94 174.06 1lo4 s VAL 216 N 5.36 4.39 0.25 2.92 -7.23 -1.26 -4.72 120.40 120.11 1lo4 s VAL 216 Ca 0.67 -0.17 -0.28 0.00 -1.81 0.00 0.00 61.98 60.39 1lo4 s VAL 216 Cb -0.20 -2.97 -0.16 0.00 0.56 0.00 0.00 36.38 33.62 1lo4 s VAL 216 CO 0.29 0.46 0.72 -2.65 -0.31 0.00 0.00 175.10 173.61 1lo4 n PRO 217 N 3.72 0.60 0.00 4.82 -0.02 -1.26 -4.77 135.00 138.09 1lo4 n PRO 217 Ca -0.17 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1lo4 n PRO 217 Cb 0.52 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.62 1lo4 n PRO 217 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1lo4 n ARG 218 N 0.87 3.60 -1.61 -0.52 0.63 -1.26 -5.04 116.66 113.32 1lo4 n ARG 218 Ca 0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 1lo4 n ARG 218 Cb 0.29 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.20 1lo4 n ARG 218 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1lo4 n ALA 219 N -3.00 -2.38 0.41 5.13 0.00 -1.26 -5.16 120.51 114.25 1lo4 n ALA 219 Ca 0.00 0.31 0.03 0.00 0.00 0.00 0.00 53.44 53.78 1lo4 n ALA 219 Cb 0.00 -1.06 0.20 0.00 0.00 0.00 0.00 19.45 18.58 1lo4 n ALA 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50