#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pgt n PRO 2 N 0.00 0.02 -5.28 0.52 -0.05 -1.26 -4.71 135.00 124.24 1pgt n PRO 2 Ca 0.00 0.35 -0.31 0.00 -0.05 0.00 0.00 63.50 63.49 1pgt n PRO 2 Cb 0.00 -1.50 -0.16 0.00 -0.05 0.00 0.00 33.50 31.79 1pgt n PRO 2 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 175.50 176.16 1pgt s TYR 3 N -2.75 2.40 -0.09 0.54 2.02 -1.26 -1.81 117.35 116.40 1pgt s TYR 3 Ca 0.02 -0.63 0.02 0.00 -0.37 0.00 0.00 57.07 56.11 1pgt s TYR 3 Cb 0.01 -1.57 0.01 0.00 -0.40 0.00 0.00 41.96 40.02 1pgt s TYR 3 CO 0.03 -0.16 -0.15 0.99 -1.57 0.00 0.00 175.55 174.69 1pgt s THR 4 N -0.31 1.44 -0.18 -0.71 2.01 -0.52 -0.54 115.64 116.83 1pgt s THR 4 Ca 0.01 -0.64 -0.06 0.00 0.31 0.00 0.00 61.69 61.31 1pgt s THR 4 Cb -0.13 -1.30 -0.03 0.00 0.01 0.00 0.00 72.50 71.05 1pgt s THR 4 CO 0.02 0.43 0.02 -0.69 -0.69 0.00 0.00 174.62 173.71 1pgt s VAL 5 N 0.73 4.33 -0.22 3.82 1.01 0.01 -1.02 120.40 129.06 1pgt s VAL 5 Ca -0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 1pgt s VAL 5 Cb -0.16 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1pgt s VAL 5 CO 0.03 0.46 -0.06 -0.69 0.00 0.00 0.00 175.10 174.84 1pgt s VAL 6 N 0.54 3.16 0.22 2.92 1.01 0.70 -0.55 120.40 128.39 1pgt s VAL 6 Ca 0.00 -0.65 -0.23 0.00 0.00 0.00 0.00 61.98 61.11 1pgt s VAL 6 Cb -0.14 -2.47 0.04 0.00 0.00 0.00 0.00 36.38 33.82 1pgt s VAL 6 CO 0.02 0.38 0.80 -0.47 0.00 0.00 0.00 175.10 175.83 1pgt s TYR 7 N 1.43 -0.19 0.84 5.22 5.04 -0.99 -1.89 117.35 126.81 1pgt s TYR 7 Ca 0.05 -0.20 -0.11 0.00 -2.44 0.00 0.00 57.07 54.37 1pgt s TYR 7 Cb -0.15 0.67 0.10 0.00 0.35 0.00 0.00 41.96 42.93 1pgt s TYR 7 CO -0.04 -1.06 1.10 -0.06 -1.34 0.00 0.00 175.55 174.14 1pgt s PHE 8 N -3.67 2.34 -1.56 4.97 0.08 -1.26 -1.11 117.98 117.77 1pgt s PHE 8 Ca 0.11 1.48 -0.11 0.00 0.12 0.00 0.00 56.93 58.53 1pgt s PHE 8 Cb -0.04 -3.12 -0.05 0.00 -0.57 0.00 0.00 43.02 39.24 1pgt s PHE 8 CO 0.04 -2.17 2.71 -0.35 -0.10 0.00 0.00 175.22 175.35 1pgt n PRO 9 N -3.77 3.39 -4.02 0.24 -0.04 -1.26 -4.80 135.00 124.75 1pgt n PRO 9 Ca 0.09 -2.31 -0.09 0.00 -0.04 0.00 0.00 63.50 61.14 1pgt n PRO 9 Cb 0.54 -2.95 -0.08 0.00 -0.04 0.00 0.00 33.50 30.97 1pgt n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1pgt s VAL 10 N 2.54 0.09 -0.03 0.52 -7.23 -1.26 -4.47 120.40 110.56 1pgt s VAL 10 Ca 0.62 -1.57 -0.08 0.00 -1.81 0.00 0.00 61.98 59.14 1pgt s VAL 10 Cb 0.17 -1.87 -0.05 0.00 0.56 0.00 0.00 36.38 35.19 1pgt s VAL 10 CO -0.07 -0.40 0.45 0.03 -0.31 0.00 0.00 175.10 174.81 1pgt h ARG 11 N 2.68 -0.28 0.00 4.82 3.08 -0.72 -3.46 114.38 120.50 1pgt h ARG 11 Ca -0.33 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1pgt h ARG 11 Cb 1.21 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.33 1pgt h ARG 11 CO 0.53 -0.19 0.00 0.41 -1.07 0.00 0.00 179.97 179.65 1pgt n GLY 12 N 0.77 2.35 0.02 0.04 0.00 0.34 -1.46 105.19 107.25 1pgt n GLY 12 Ca -0.04 0.17 0.04 0.00 0.00 0.00 0.00 46.02 46.19 1pgt n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pgt n ARG 13 N 14.00 1.03 0.00 1.61 1.74 -1.26 -3.41 116.66 130.37 1pgt n ARG 13 Ca 0.00 -0.04 0.04 0.00 -0.77 0.00 0.00 57.85 57.08 1pgt n ARG 13 Cb 0.00 -1.11 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1pgt n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pgt h ALA 15 N 1.53 0.58 -0.54 0.00 0.00 -1.47 -1.47 119.26 117.89 1pgt h ALA 15 Ca 0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1pgt h ALA 15 Cb 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1pgt h ALA 15 CO 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 179.25 179.36 1pgt h ALA 16 N 1.06 0.73 0.00 0.00 0.00 -1.84 0.27 119.26 119.49 1pgt h ALA 16 Ca 0.15 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1pgt h ALA 16 Cb 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1pgt h ALA 16 CO -0.02 0.58 -0.51 1.37 0.00 0.00 0.00 179.25 180.67 1pgt h LEU 17 N 0.85 0.00 -0.31 0.00 8.10 -1.81 -1.44 115.31 120.70 1pgt h LEU 17 Ca 0.15 0.00 -0.18 0.00 0.11 0.00 0.00 57.88 57.96 1pgt h LEU 17 Cb 0.57 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.79 1pgt h LEU 17 CO 0.03 0.51 -0.50 0.03 -4.11 0.00 0.00 178.44 174.40 1pgt h ARG 18 N 0.00 0.89 -0.95 0.17 3.08 -0.66 -2.03 114.38 114.88 1pgt h ARG 18 Ca -0.01 -0.54 0.03 0.00 0.07 0.00 0.00 59.98 59.53 1pgt h ARG 18 Cb 1.06 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 31.11 1pgt h ARG 18 CO 0.07 1.18 0.63 0.52 -1.07 0.00 0.00 179.97 181.29 1pgt h MET 19 N 0.68 1.20 -0.05 0.04 2.86 -0.61 -0.60 114.93 118.46 1pgt h MET 19 Ca 0.03 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1pgt h MET 19 Cb 1.11 -0.27 -0.00 0.00 0.06 0.00 0.00 31.60 32.50 1pgt h MET 19 CO 0.11 0.79 0.01 1.25 1.06 0.00 0.00 176.91 180.13 1pgt h LEU 20 N 1.23 0.07 -0.46 1.22 6.46 -1.12 0.10 115.31 122.82 1pgt h LEU 20 Ca 0.37 -0.25 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 1pgt h LEU 20 Cb -0.04 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 39.85 1pgt h LEU 20 CO -0.10 0.30 0.22 -0.07 -0.62 0.00 0.00 178.44 178.17 1pgt h LEU 21 N -0.16 0.61 -0.06 2.25 3.38 -1.13 -0.21 115.31 119.99 1pgt h LEU 21 Ca 0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1pgt h LEU 21 Cb 0.26 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1pgt h LEU 21 CO 0.00 0.58 0.01 0.00 0.09 0.00 0.00 178.44 179.12 1pgt h ALA 22 N 1.06 0.07 -0.29 1.53 0.00 -0.90 0.58 119.26 121.32 1pgt h ALA 22 Ca 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1pgt h ALA 22 Cb 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1pgt h ALA 22 CO -0.02 -0.29 0.07 0.22 0.00 0.00 0.00 179.25 179.23 1pgt h ASP 23 N -0.15 0.38 -0.18 0.00 3.58 -0.65 0.33 116.42 119.72 1pgt h ASP 23 Ca 0.02 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.42 1pgt h ASP 23 Cb 0.27 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1pgt h ASP 23 CO 0.00 0.39 0.00 0.00 -2.88 0.00 0.00 179.24 176.75 1pgt n GLN 24 N -4.37 1.50 -2.74 0.28 1.13 -0.10 -4.79 117.38 108.29 1pgt n GLN 24 Ca 0.01 -0.78 -0.17 0.00 -1.94 0.00 0.00 57.00 54.12 1pgt n GLN 24 Cb 0.17 -1.24 0.02 0.00 0.11 0.00 0.00 30.24 29.30 1pgt n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1pgt n GLY 25 N 0.91 -0.28 3.91 1.08 0.00 0.10 -5.00 105.19 105.92 1pgt n GLY 25 Ca 0.10 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1pgt n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pgt s GLN 26 N -5.31 3.44 0.04 1.61 -1.52 0.14 -5.03 119.66 113.03 1pgt s GLN 26 Ca 0.19 -0.37 0.00 0.00 -1.95 0.00 0.00 55.36 53.22 1pgt s GLN 26 Cb -0.08 -3.07 -0.04 0.00 -0.22 0.00 0.00 33.01 29.60 1pgt s GLN 26 CO 0.23 0.64 0.15 -1.54 -0.25 0.00 0.00 175.29 174.52 1pgt s SER 27 N -2.22 6.04 0.13 5.90 1.04 -1.26 -4.49 113.70 118.83 1pgt s SER 27 Ca 0.31 0.20 -0.13 0.00 0.48 0.00 0.00 55.95 56.81 1pgt s SER 27 Cb -0.13 -1.79 0.02 0.00 0.10 0.00 0.00 66.02 64.22 1pgt s SER 27 CO 0.23 0.21 0.33 -1.66 0.98 0.00 0.00 173.24 173.34 1pgt s TRP 28 N -1.38 0.00 -0.10 5.02 -2.14 -1.26 -4.13 118.94 114.95 1pgt s TRP 28 Ca 0.30 -0.36 -0.02 0.00 2.66 0.00 0.00 56.10 58.68 1pgt s TRP 28 Cb -0.13 0.13 -0.03 0.00 -3.10 0.00 0.00 33.47 30.35 1pgt s TRP 28 CO 0.22 -0.68 -0.04 0.21 -2.66 0.00 0.00 176.95 174.00 1pgt s LYS 29 N -3.85 3.15 -0.23 3.25 2.47 0.30 -4.97 119.74 119.86 1pgt s LYS 29 Ca 0.06 -0.50 -0.13 0.00 -1.56 0.00 0.00 55.97 53.85 1pgt s LYS 29 Cb 0.03 -2.77 -0.05 0.00 -1.46 0.00 0.00 37.83 33.59 1pgt s LYS 29 CO -0.09 0.52 0.26 -1.21 0.16 0.00 0.00 175.35 174.99 1pgt s GLU 30 N -0.40 4.09 -0.39 4.03 0.41 -1.26 -0.81 118.70 124.37 1pgt s GLU 30 Ca 0.07 -0.10 -0.08 0.00 -0.41 0.00 0.00 54.97 54.45 1pgt s GLU 30 Cb -0.12 -3.56 0.07 0.00 -1.78 0.00 0.00 34.13 28.74 1pgt s GLU 30 CO 0.02 -0.01 0.20 -2.00 -0.49 0.00 0.00 175.26 172.98 1pgt s GLU 31 N 1.27 2.58 0.13 1.61 2.12 0.29 -4.97 118.70 121.73 1pgt s GLU 31 Ca 0.12 -1.38 -0.17 0.00 0.36 0.00 0.00 54.97 53.90 1pgt s GLU 31 Cb -0.14 -3.66 -0.07 0.00 0.26 0.00 0.00 34.13 30.52 1pgt s GLU 31 CO 0.06 -0.86 0.58 0.14 -0.54 0.00 0.00 175.26 174.65 1pgt s VAL 32 N 1.40 4.77 -0.23 3.70 -7.23 -1.26 -2.35 120.40 119.20 1pgt s VAL 32 Ca 0.02 1.03 -0.00 0.00 -1.81 0.00 0.00 61.98 61.22 1pgt s VAL 32 Cb -0.22 -3.81 0.03 0.00 0.56 0.00 0.00 36.38 32.94 1pgt s VAL 32 CO 0.02 0.35 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.36 1pgt s VAL 33 N -1.35 2.60 0.52 1.32 1.01 -0.27 -4.93 120.40 119.30 1pgt s VAL 33 Ca 0.35 -1.03 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 1pgt s VAL 33 Cb -0.17 -2.28 -0.07 0.00 0.00 0.00 0.00 36.38 33.87 1pgt s VAL 33 CO 0.19 0.28 0.96 0.42 0.00 0.00 0.00 175.10 176.95 1pgt s THR 34 N 1.30 4.63 0.60 3.92 -4.23 -1.26 -4.14 115.64 116.45 1pgt s THR 34 Ca 0.01 1.00 0.29 0.00 -1.18 0.00 0.00 61.69 61.81 1pgt s THR 34 Cb -0.16 -3.76 0.36 0.00 1.34 0.00 0.00 72.50 70.28 1pgt s THR 34 CO -0.07 -0.78 2.10 0.58 -0.54 0.00 0.00 174.62 175.91 1pgt h VAL 35 N 0.61 0.43 0.02 2.29 2.07 -1.99 -1.03 116.25 118.65 1pgt h VAL 35 Ca -0.46 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 1pgt h VAL 35 Cb 1.19 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.79 1pgt h VAL 35 CO 0.62 0.00 -0.01 -0.33 0.02 0.00 0.00 177.57 177.87 1pgt h GLU 36 N 0.00 -0.02 -0.87 1.57 3.07 -1.98 0.13 114.58 116.47 1pgt h GLU 36 Ca 0.08 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.92 1pgt h GLU 36 Cb 0.48 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 1pgt h GLU 36 CO -0.00 0.55 0.45 1.15 -1.40 0.00 0.00 179.01 179.76 1pgt h THR 37 N -0.62 1.26 -0.19 1.13 2.02 -1.62 -2.83 112.91 112.07 1pgt h THR 37 Ca -0.00 -0.69 -0.06 0.00 0.77 0.00 0.00 66.41 66.43 1pgt h THR 37 Cb 0.59 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1pgt h THR 37 CO 0.00 0.30 -0.12 -0.25 0.37 0.00 0.00 175.52 175.83 1pgt h TRP 38 N 1.23 0.49 -0.51 3.16 2.91 -1.19 -3.17 115.95 118.87 1pgt h TRP 38 Ca 0.30 -0.13 0.15 0.00 1.13 0.00 0.00 58.89 60.35 1pgt h TRP 38 Cb 0.07 -0.11 -0.02 0.00 -0.51 0.00 0.00 29.16 28.59 1pgt h TRP 38 CO 0.01 0.73 0.39 0.37 -1.03 0.00 0.00 178.44 178.92 1pgt h GLN 39 N 0.10 0.00 0.00 2.65 5.75 -0.64 -2.13 115.11 120.85 1pgt h GLN 39 Ca 0.04 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1pgt h GLN 39 Cb 0.62 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.17 1pgt h GLN 39 CO 0.03 0.00 0.00 -1.91 -2.65 0.00 0.00 178.83 174.30 1pgt n GLU 40 N -4.25 0.00 0.00 1.69 0.00 -1.08 -4.97 120.64 112.03 1pgt n GLU 40 Ca 0.09 0.44 0.00 0.00 0.00 0.00 0.00 57.16 57.69 1pgt n GLU 40 Cb 0.61 -1.38 0.00 0.00 0.00 0.00 0.00 31.44 30.67 1pgt n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1pgt n GLY 41 N -0.89 1.12 0.48 8.31 0.00 -0.80 -5.06 105.19 108.35 1pgt n GLY 41 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1pgt n GLY 41 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1pgt h SER 42 N 0.87 -1.37 -0.41 1.61 0.87 -1.83 -2.32 113.55 110.97 1pgt h SER 42 Ca 0.00 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1pgt h SER 42 Cb 0.00 0.47 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1pgt h SER 42 CO 0.00 -0.62 0.22 0.25 -0.53 0.00 0.00 176.83 176.14 1pgt h LEU 43 N -0.91 0.53 -0.87 2.23 5.85 -1.90 -3.06 115.31 117.18 1pgt h LEU 43 Ca -0.04 -0.11 0.16 0.00 0.84 0.00 0.00 57.88 58.73 1pgt h LEU 43 Cb 0.82 -0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.62 1pgt h LEU 43 CO -0.12 0.48 0.44 0.50 -0.34 0.00 0.00 178.44 179.41 1pgt h LYS 44 N 0.53 0.59 0.00 1.25 3.64 -1.84 0.27 116.57 121.01 1pgt h LYS 44 Ca 0.14 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1pgt h LYS 44 Cb 0.08 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1pgt h LYS 44 CO -0.02 0.39 -0.10 0.00 -2.27 0.00 0.00 179.45 177.44 1pgt h ALA 45 N 1.58 1.19 -0.00 5.00 0.00 -1.31 -2.08 119.26 123.64 1pgt h ALA 45 Ca 0.48 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1pgt h ALA 45 Cb 0.73 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1pgt h ALA 45 CO -0.39 0.13 -0.49 -1.13 0.00 0.00 0.00 179.25 177.38 1pgt n SER 46 N -3.49 0.93 -4.74 0.00 3.41 0.90 -4.86 113.62 105.77 1pgt n SER 46 Ca -0.01 -0.73 -0.40 0.00 -0.26 0.00 0.00 58.87 57.47 1pgt n SER 46 Cb 0.25 0.35 -0.05 0.00 -0.26 0.00 0.00 64.21 64.50 1pgt n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pgt h LEU 48 N 6.03 -0.92 -3.31 0.00 5.85 -1.88 -1.07 115.31 120.01 1pgt h LEU 48 Ca -0.43 0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 1pgt h LEU 48 Cb 1.20 0.53 -0.01 0.00 0.37 0.00 0.00 40.66 42.75 1pgt h LEU 48 CO 0.72 -0.27 0.01 -1.22 -0.34 0.00 0.00 178.44 177.33 1pgt n TYR 49 N -5.47 1.12 -2.17 1.25 4.01 -1.26 -4.95 117.16 109.68 1pgt n TYR 49 Ca 0.08 -0.91 -0.19 0.00 -0.16 0.00 0.00 57.90 56.72 1pgt n TYR 49 Cb 0.38 -0.36 -0.03 0.00 -0.31 0.00 0.00 39.34 39.02 1pgt n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pgt n GLY 50 N -0.42 0.10 3.14 2.72 0.00 -0.41 -4.98 105.19 105.35 1pgt n GLY 50 Ca 0.23 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 1pgt n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pgt s GLN 51 N -4.63 0.84 0.29 1.61 -0.21 -1.26 -4.96 119.66 111.35 1pgt s GLN 51 Ca 0.00 -1.36 0.10 0.00 0.02 0.00 0.00 55.36 54.12 1pgt s GLN 51 Cb 0.00 0.24 -0.05 0.00 1.00 0.00 0.00 33.01 34.20 1pgt s GLN 51 CO 0.00 -0.22 -0.00 -0.51 -2.12 0.00 0.00 175.29 172.43 1pgt s LEU 52 N -3.01 3.11 0.88 2.90 1.43 -1.26 -4.64 118.68 118.09 1pgt s LEU 52 Ca 0.19 -0.76 -0.12 0.00 -1.03 0.00 0.00 54.13 52.41 1pgt s LEU 52 Cb 0.07 -1.60 0.12 0.00 0.03 0.00 0.00 46.19 44.81 1pgt s LEU 52 CO -0.02 -0.08 1.10 -2.16 0.23 0.00 0.00 176.35 175.42 1pgt s PRO 53 N -3.69 1.44 -0.03 1.29 0.04 -1.26 -4.99 135.00 127.80 1pgt s PRO 53 Ca 0.33 0.67 0.05 0.00 0.04 0.00 0.00 61.00 62.09 1pgt s PRO 53 Cb -0.05 -1.84 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 1pgt s PRO 53 CO 0.20 -2.08 -0.17 0.21 0.04 0.00 0.00 177.00 175.20 1pgt s LYS 54 N -5.05 1.56 -0.00 4.56 2.20 -0.79 -3.91 119.74 118.31 1pgt s LYS 54 Ca 0.63 -0.61 0.01 0.00 -0.36 0.00 0.00 55.97 55.64 1pgt s LYS 54 Cb -0.16 -1.44 -0.00 0.00 -1.51 0.00 0.00 37.83 34.71 1pgt s LYS 54 CO 0.56 0.32 -0.05 0.12 -0.36 0.00 0.00 175.35 175.93 1pgt s PHE 55 N -0.21 0.43 -0.09 4.03 5.36 -0.29 -0.22 117.98 126.99 1pgt s PHE 55 Ca 0.02 -0.09 0.04 0.00 -0.96 0.00 0.00 56.93 55.94 1pgt s PHE 55 Cb -0.09 -0.27 0.00 0.00 -0.34 0.00 0.00 43.02 42.32 1pgt s PHE 55 CO 0.01 -0.01 -0.22 -0.65 -1.46 0.00 0.00 175.22 172.88 1pgt s GLN 56 N -0.16 2.75 -0.47 10.12 -0.21 -0.19 -0.59 119.66 130.92 1pgt s GLN 56 Ca 0.01 -0.81 0.04 0.00 0.02 0.00 0.00 55.36 54.62 1pgt s GLN 56 Cb -0.02 -2.13 0.12 0.00 1.00 0.00 0.00 33.01 31.98 1pgt s GLN 56 CO -0.00 0.19 0.20 0.34 -2.12 0.00 0.00 175.29 173.90 1pgt s ASP 57 N 0.31 4.39 1.73 5.90 -1.08 0.38 -1.44 116.67 126.86 1pgt s ASP 57 Ca -0.16 -2.76 0.00 0.00 -0.52 0.00 0.00 52.55 49.11 1pgt s ASP 57 Cb -0.17 -1.59 0.00 0.00 -1.46 0.00 0.00 42.92 39.70 1pgt s ASP 57 CO 0.07 -0.27 0.00 0.61 0.52 0.00 0.00 175.17 176.10 1pgt n GLY 58 N 3.44 3.35 0.21 2.66 0.00 -0.75 -0.40 105.19 113.70 1pgt n GLY 58 Ca 0.05 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1pgt n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pgt n ASP 59 N 7.48 0.85 -4.71 1.61 8.00 -1.26 -4.84 116.55 123.68 1pgt n ASP 59 Ca 0.00 -0.81 -0.40 0.00 0.71 0.00 0.00 54.79 54.29 1pgt n ASP 59 Cb 0.00 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.10 1pgt n ASP 59 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1pgt s LEU 60 N -2.46 4.29 -0.14 0.64 2.96 0.46 -5.04 118.68 119.38 1pgt s LEU 60 Ca 0.27 1.11 -0.00 0.00 -0.22 0.00 0.00 54.13 55.28 1pgt s LEU 60 Cb 0.20 -3.02 -0.01 0.00 0.50 0.00 0.00 46.19 43.85 1pgt s LEU 60 CO 0.49 -0.13 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.37 1pgt s THR 61 N 0.97 2.96 0.12 3.68 2.01 -1.26 -0.47 115.64 123.65 1pgt s THR 61 Ca 0.35 -0.68 0.07 0.00 0.31 0.00 0.00 61.69 61.74 1pgt s THR 61 Cb -0.17 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 1pgt s THR 61 CO 0.16 0.52 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.68 1pgt s LEU 62 N 0.54 2.37 0.40 4.42 1.43 0.24 -4.99 118.68 123.09 1pgt s LEU 62 Ca -0.09 -0.76 0.05 0.00 -1.03 0.00 0.00 54.13 52.31 1pgt s LEU 62 Cb -0.16 -0.67 -0.07 0.00 0.03 0.00 0.00 46.19 45.32 1pgt s LEU 62 CO 0.04 -0.07 0.03 -0.31 0.23 0.00 0.00 176.35 176.27 1pgt s TYR 63 N -1.77 2.27 0.00 0.29 2.02 -1.26 -1.13 117.35 117.77 1pgt s TYR 63 Ca 0.08 -0.80 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 1pgt s TYR 63 Cb -0.07 -1.61 0.00 0.00 -0.40 0.00 0.00 41.96 39.88 1pgt s TYR 63 CO 0.04 0.28 0.00 1.04 -1.57 0.00 0.00 175.55 175.34 1pgt n GLN 64 N -0.93 0.00 -0.22 -0.62 1.13 -1.25 -4.56 117.38 110.93 1pgt n GLN 64 Ca -0.06 0.46 0.00 0.00 -1.94 0.00 0.00 57.00 55.47 1pgt n GLN 64 Cb 0.67 -0.49 0.12 0.00 0.11 0.00 0.00 30.24 30.65 1pgt n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1pgt h SER 65 N 0.00 0.34 0.21 1.08 4.64 -1.89 -1.41 113.55 116.51 1pgt h SER 65 Ca 0.00 0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.32 1pgt h SER 65 Cb 0.00 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1pgt h SER 65 CO 0.00 0.20 -0.28 0.78 -0.87 0.00 0.00 176.83 176.66 1pgt h ASN 66 N 0.50 0.11 -0.64 4.97 2.35 -1.93 -1.48 115.58 119.46 1pgt h ASN 66 Ca 0.32 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.99 1pgt h ASN 66 Cb 0.35 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 1pgt h ASN 66 CO -0.28 0.40 0.21 0.74 -1.65 0.00 0.00 177.43 176.85 1pgt h THR 67 N 0.11 1.25 -0.31 2.81 2.02 -1.57 -1.09 112.91 116.13 1pgt h THR 67 Ca 0.02 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.32 1pgt h THR 67 Cb 0.55 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1pgt h THR 67 CO 0.04 0.32 0.03 0.40 0.37 0.00 0.00 175.52 176.68 1pgt h ILE 68 N 0.92 1.25 -0.38 3.11 2.04 -0.80 -1.23 117.51 122.42 1pgt h ILE 68 Ca 0.21 -0.87 0.05 0.00 1.00 0.00 0.00 64.86 65.25 1pgt h ILE 68 Cb 0.28 1.22 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 1pgt h ILE 68 CO -0.01 0.28 0.11 -0.07 0.00 0.00 0.00 178.15 178.47 1pgt h LEU 69 N 0.33 0.09 -0.81 1.44 3.38 -1.18 -1.76 115.31 116.80 1pgt h LEU 69 Ca 0.09 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1pgt h LEU 69 Cb 0.39 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1pgt h LEU 69 CO 0.01 0.09 0.38 0.03 0.09 0.00 0.00 178.44 179.04 1pgt h ARG 70 N 0.25 1.18 -0.38 1.13 3.08 -1.12 0.84 114.38 119.35 1pgt h ARG 70 Ca 0.18 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1pgt h ARG 70 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1pgt h ARG 70 CO -0.20 0.92 0.24 1.25 -1.07 0.00 0.00 179.97 181.11 1pgt h HIS 71 N 1.16 0.45 -0.17 3.04 2.76 -0.91 -0.44 115.15 121.03 1pgt h HIS 71 Ca 0.28 0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.35 1pgt h HIS 71 Cb 0.14 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 1pgt h HIS 71 CO 0.01 0.28 -0.37 -0.07 -1.30 0.00 0.00 177.93 176.48 1pgt h LEU 72 N 0.49 0.39 -0.56 0.26 4.07 -1.08 -1.00 115.31 117.89 1pgt h LEU 72 Ca 0.15 -0.16 -0.06 0.00 0.08 0.00 0.00 57.88 57.89 1pgt h LEU 72 Cb -0.03 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.58 1pgt h LEU 72 CO -0.05 0.73 0.13 1.23 -1.08 0.00 0.00 178.44 179.41 1pgt h GLY 73 N 1.13 0.97 0.71 0.83 0.00 -0.43 -0.14 103.07 106.13 1pgt h GLY 73 Ca 0.03 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 1pgt h GLY 73 CO 0.06 0.57 -0.00 -0.09 0.00 0.00 0.00 176.54 177.08 1pgt h ARG 74 N 0.80 0.10 0.00 4.80 2.43 -0.90 0.42 114.38 122.03 1pgt h ARG 74 Ca 0.18 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 1pgt h ARG 74 Cb 0.35 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1pgt h ARG 74 CO 0.00 0.40 -0.64 1.79 -1.51 0.00 0.00 179.97 180.01 1pgt h THR 75 N -0.21 1.16 -0.37 0.20 1.35 -1.15 -3.26 112.91 110.63 1pgt h THR 75 Ca 0.02 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 63.38 1pgt h THR 75 Cb 0.35 2.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1pgt h THR 75 CO 0.00 0.63 0.00 0.18 -0.25 0.00 0.00 175.52 176.08 1pgt n LEU 76 N -3.33 3.15 -2.45 3.87 4.77 -0.07 -5.00 117.00 117.94 1pgt n LEU 76 Ca 0.01 -1.63 -0.10 0.00 -0.03 0.00 0.00 56.01 54.26 1pgt n LEU 76 Cb 0.76 -0.24 0.05 0.00 -2.33 0.00 0.00 43.42 41.66 1pgt n LEU 76 CO 0.42 0.72 0.06 0.61 -1.33 0.00 0.00 177.39 177.87 1pgt n GLY 77 N 1.11 -0.07 2.37 -0.72 0.00 -0.80 -4.97 105.19 102.11 1pgt n GLY 77 Ca 0.16 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 1pgt n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pgt n LEU 78 N -2.81 4.20 -2.32 0.99 4.77 0.14 -4.75 117.00 117.22 1pgt n LEU 78 Ca -0.16 -4.74 -0.08 0.00 -0.03 0.00 0.00 56.01 51.01 1pgt n LEU 78 Cb 0.60 -0.25 0.05 0.00 -2.33 0.00 0.00 43.42 41.48 1pgt n LEU 78 CO 0.36 2.03 0.08 0.00 -1.33 0.00 0.00 177.39 178.54 1pgt n TYR 79 N -0.52 1.61 -0.29 -1.77 4.19 -1.23 -1.04 117.16 118.12 1pgt n TYR 79 Ca 0.35 -2.00 0.04 0.00 3.31 0.00 0.00 57.90 59.60 1pgt n TYR 79 Cb 0.79 -0.26 -0.01 0.00 0.49 0.00 0.00 39.34 40.34 1pgt n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1pgt n GLY 80 N -0.58 -2.19 0.08 2.98 0.00 -1.26 -3.91 105.19 100.32 1pgt n GLY 80 Ca 0.21 -1.41 0.12 0.00 0.00 0.00 0.00 46.02 44.93 1pgt n GLY 80 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1pgt h LYS 81 N -0.28 0.00 0.00 1.61 2.10 -1.96 -3.46 116.57 114.59 1pgt h LYS 81 Ca -0.02 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.50 1pgt h LYS 81 Cb 0.27 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.58 1pgt h LYS 81 CO 0.01 0.00 0.06 -0.40 -2.00 0.00 0.00 179.45 177.12 1pgt n ASP 82 N -2.32 -1.54 0.12 7.07 5.68 -1.26 -5.03 116.55 119.27 1pgt n ASP 82 Ca 0.02 -2.45 0.03 0.00 -0.50 0.00 0.00 54.79 51.89 1pgt n ASP 82 Cb 0.48 2.68 0.40 0.00 -1.14 0.00 0.00 41.12 43.54 1pgt n ASP 82 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1pgt h GLN 83 N 0.00 0.24 -0.20 0.11 4.20 -1.94 -0.64 115.11 116.88 1pgt h GLN 83 Ca -0.25 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.38 1pgt h GLN 83 Cb 1.01 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 1pgt h GLN 83 CO 0.33 0.36 0.04 0.37 -0.67 0.00 0.00 178.83 179.26 1pgt h GLN 84 N 0.23 0.33 -0.56 1.46 4.15 -1.98 -1.34 115.11 117.39 1pgt h GLN 84 Ca 0.05 -0.08 -0.05 0.00 0.77 0.00 0.00 58.65 59.33 1pgt h GLN 84 Cb 0.34 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 1pgt h GLN 84 CO 0.02 0.47 0.15 0.93 -1.93 0.00 0.00 178.83 178.47 1pgt h GLU 85 N 0.13 0.89 -0.93 1.69 5.08 -1.87 -2.56 114.58 117.02 1pgt h GLU 85 Ca 0.06 -0.21 0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1pgt h GLU 85 Cb 0.29 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.35 1pgt h GLU 85 CO 0.00 0.82 0.57 0.00 -1.00 0.00 0.00 179.01 179.41 1pgt h ALA 86 N 1.03 1.33 -0.84 3.43 0.00 -0.91 0.18 119.26 123.48 1pgt h ALA 86 Ca 0.18 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1pgt h ALA 86 Cb 0.32 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1pgt h ALA 86 CO -0.00 0.24 0.46 0.00 0.00 0.00 0.00 179.25 179.95 1pgt h ALA 87 N 1.47 1.22 -0.07 0.00 0.00 -1.13 -1.66 119.26 119.10 1pgt h ALA 87 Ca 0.43 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 55.05 1pgt h ALA 87 Cb 0.33 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1pgt h ALA 87 CO -0.23 0.63 -0.69 -0.07 0.00 0.00 0.00 179.25 178.90 1pgt h LEU 88 N 1.18 0.35 -0.31 0.00 3.38 -0.72 -2.23 115.31 116.96 1pgt h LEU 88 Ca 0.30 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1pgt h LEU 88 Cb 0.03 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1pgt h LEU 88 CO -0.05 0.93 0.15 0.58 0.09 0.00 0.00 178.44 180.15 1pgt h VAL 89 N 0.21 0.99 -0.46 1.22 2.07 -0.35 -1.92 116.25 118.01 1pgt h VAL 89 Ca -0.02 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.45 1pgt h VAL 89 Cb 1.24 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 1pgt h VAL 89 CO 0.11 0.06 0.15 0.44 0.02 0.00 0.00 177.57 178.35 1pgt h ASP 90 N 0.32 0.14 -0.80 0.57 3.32 -1.15 0.51 116.42 119.33 1pgt h ASP 90 Ca 0.13 0.06 0.06 0.00 0.02 0.00 0.00 57.03 57.30 1pgt h ASP 90 Cb 0.04 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 1pgt h ASP 90 CO -0.09 0.11 0.49 -0.03 -1.72 0.00 0.00 179.24 178.00 1pgt h MET 91 N 0.32 0.86 -0.11 3.56 4.05 -1.11 0.11 114.93 122.63 1pgt h MET 91 Ca 0.22 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.57 1pgt h MET 91 Cb 0.23 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1pgt h MET 91 CO -0.24 0.57 -0.03 0.28 0.23 0.00 0.00 176.91 177.73 1pgt h VAL 92 N 0.89 1.29 -0.51 -5.77 2.07 -1.11 -2.58 116.25 110.54 1pgt h VAL 92 Ca 0.35 -0.96 0.03 0.00 0.82 0.00 0.00 66.70 66.94 1pgt h VAL 92 Cb 0.18 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 1pgt h VAL 92 CO -0.18 0.27 0.28 -1.13 0.02 0.00 0.00 177.57 176.84 1pgt h ASN 93 N -0.12 0.43 0.02 0.57 -1.24 -0.41 -0.69 115.58 114.15 1pgt h ASN 93 Ca 0.03 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 57.03 1pgt h ASN 93 Cb 0.44 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 1pgt h ASN 93 CO 0.01 0.30 -0.06 0.44 -1.29 0.00 0.00 177.43 176.83 1pgt h ASP 94 N 0.55 0.10 -0.06 1.15 3.32 -0.82 0.31 116.42 120.98 1pgt h ASP 94 Ca 0.21 -0.01 -0.18 0.00 0.02 0.00 0.00 57.03 57.07 1pgt h ASP 94 Cb 0.07 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1pgt h ASP 94 CO -0.12 0.18 -0.62 1.23 -1.72 0.00 0.00 179.24 178.19 1pgt h GLY 95 N 0.41 0.74 0.90 2.75 0.00 -0.91 -2.04 103.07 104.90 1pgt h GLY 95 Ca 0.03 -0.92 -0.00 0.00 0.00 0.00 0.00 47.33 46.43 1pgt h GLY 95 CO 0.01 0.82 0.04 -2.08 0.00 0.00 0.00 176.54 175.33 1pgt h VAL 96 N 0.50 1.11 -0.97 4.60 2.07 -0.67 -2.46 116.25 120.44 1pgt h VAL 96 Ca -0.01 -0.33 0.10 0.00 0.82 0.00 0.00 66.70 67.28 1pgt h VAL 96 Cb 1.20 1.18 -0.08 0.00 -1.52 0.00 0.00 31.29 32.07 1pgt h VAL 96 CO 0.12 0.10 0.61 -0.08 0.02 0.00 0.00 177.57 178.34 1pgt h GLU 97 N 0.02 0.98 -0.52 1.57 4.57 -0.84 0.14 114.58 120.50 1pgt h GLU 97 Ca 0.03 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 1pgt h GLU 97 Cb 0.12 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 1pgt h GLU 97 CO -0.00 0.65 0.23 -0.44 -1.18 0.00 0.00 179.01 178.27 1pgt h ASP 98 N 1.01 0.70 -0.27 1.04 3.32 -1.18 -0.18 116.42 120.87 1pgt h ASP 98 Ca 0.46 -0.15 -0.17 0.00 0.02 0.00 0.00 57.03 57.19 1pgt h ASP 98 Cb 0.37 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1pgt h ASP 98 CO -0.23 0.66 -0.49 0.25 -1.72 0.00 0.00 179.24 177.70 1pgt h LEU 99 N 0.70 0.90 -1.12 1.55 6.46 -1.01 -2.88 115.31 119.92 1pgt h LEU 99 Ca 0.18 -0.53 0.06 0.00 -0.12 0.00 0.00 57.88 57.47 1pgt h LEU 99 Cb 0.16 -0.26 -0.06 0.00 -0.73 0.00 0.00 40.66 39.77 1pgt h LEU 99 CO -0.02 1.26 0.60 -0.09 -0.62 0.00 0.00 178.44 179.58 1pgt h ARG 100 N 0.57 1.03 -0.87 1.25 2.43 -0.39 -0.60 114.38 117.81 1pgt h ARG 100 Ca 0.01 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 1pgt h ARG 100 Cb 1.10 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 30.38 1pgt h ARG 100 CO 0.11 0.68 0.44 0.00 -1.51 0.00 0.00 179.97 179.70 1pgt h LYS 102 N 1.23 1.02 -0.24 0.00 1.57 -1.11 -2.40 116.57 116.65 1pgt h LYS 102 Ca 0.30 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1pgt h LYS 102 Cb 0.08 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1pgt h LYS 102 CO -0.04 1.09 0.13 -0.92 -0.57 0.00 0.00 179.45 179.14 1pgt h TYR 103 N 0.88 0.32 -0.96 -1.35 3.20 -0.64 -1.50 116.97 116.93 1pgt h TYR 103 Ca 0.13 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1pgt h TYR 103 Cb 0.73 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.85 1pgt h TYR 103 CO 0.05 0.27 0.59 0.28 -1.64 0.00 0.00 178.16 177.71 1pgt h VAL 104 N 0.28 1.26 -0.61 1.81 2.07 -1.10 -0.98 116.25 118.99 1pgt h VAL 104 Ca 0.08 -0.55 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 1pgt h VAL 104 Cb 0.05 -0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 29.70 1pgt h VAL 104 CO -0.01 0.27 0.10 -1.28 0.02 0.00 0.00 177.57 176.66 1pgt h SER 105 N 1.31 0.93 0.26 0.57 0.87 -1.26 0.01 113.55 116.24 1pgt h SER 105 Ca 0.34 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1pgt h SER 105 Cb -0.07 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.64 1pgt h SER 105 CO -0.07 0.93 -0.13 0.25 -0.53 0.00 0.00 176.83 177.29 1pgt h LEU 106 N 0.93 -0.30 0.19 2.23 5.85 -0.59 -1.65 115.31 121.96 1pgt h LEU 106 Ca 0.19 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1pgt h LEU 106 Cb 0.40 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1pgt h LEU 106 CO 0.01 -0.06 -0.19 0.40 -0.34 0.00 0.00 178.44 178.26 1pgt h ILE 107 N -0.54 0.58 0.00 4.05 1.08 -0.91 -0.94 117.51 120.84 1pgt h ILE 107 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 1pgt h ILE 107 Cb 0.40 0.58 0.00 0.00 -3.07 0.00 0.00 36.82 34.73 1pgt h ILE 107 CO 0.06 0.00 -0.38 1.88 -0.69 0.00 0.00 178.15 179.02 1pgt h TYR 108 N -0.41 0.00 0.00 1.37 0.05 -1.06 -3.40 116.97 113.52 1pgt h TYR 108 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1pgt h TYR 108 Cb 0.39 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.13 1pgt h TYR 108 CO -0.15 0.00 -0.01 0.25 -1.05 0.00 0.00 178.16 177.21 1pgt n THR 109 N -2.28 0.00 -2.70 -2.88 -2.24 -0.63 -4.95 114.28 98.60 1pgt n THR 109 Ca 0.04 -0.14 -0.03 0.00 -2.27 0.00 0.00 64.05 61.65 1pgt n THR 109 Cb 0.45 0.98 0.11 0.00 -2.10 0.00 0.00 70.33 69.77 1pgt n THR 109 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1pgt n ASN 110 N -0.28 -0.90 0.12 3.42 5.15 -0.89 -5.03 115.26 116.84 1pgt n ASN 110 Ca 0.00 -2.25 -0.05 0.00 -0.60 0.00 0.00 54.58 51.68 1pgt n ASN 110 Cb 0.00 0.49 -0.02 0.00 -0.53 0.00 0.00 39.78 39.72 1pgt n ASN 110 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1pgt h TYR 111 N 1.53 -0.29 0.00 1.20 5.03 -1.40 0.70 116.97 123.74 1pgt h TYR 111 Ca -0.35 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 60.90 1pgt h TYR 111 Cb 1.29 0.10 -0.01 0.00 1.55 0.00 0.00 36.73 39.66 1pgt h TYR 111 CO 0.08 -0.18 -0.25 1.05 -1.32 0.00 0.00 178.16 177.55 1pgt h GLU 112 N -0.31 0.00 0.00 1.82 9.09 -1.94 -1.99 114.58 121.25 1pgt h GLU 112 Ca -0.03 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.21 1pgt h GLU 112 Cb 0.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.31 1pgt h GLU 112 CO 0.05 0.25 -1.29 0.00 0.05 0.00 0.00 179.01 178.07 1pgt h ALA 113 N 1.75 0.66 0.00 1.06 0.00 -1.96 -3.39 119.26 117.37 1pgt h ALA 113 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1pgt h ALA 113 Cb 0.75 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1pgt h ALA 113 CO 0.03 0.95 -1.13 0.41 0.00 0.00 0.00 179.25 179.51 1pgt n GLY 114 N 1.38 -0.53 0.27 0.00 0.00 0.25 -4.77 105.19 101.78 1pgt n GLY 114 Ca -0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 1pgt n GLY 114 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1pgt h LYS 115 N 0.00 -0.03 -0.29 1.61 3.64 -1.47 -1.55 116.57 118.48 1pgt h LYS 115 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1pgt h LYS 115 Cb 0.50 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1pgt h LYS 115 CO 0.00 -0.02 -0.21 -0.44 -2.27 0.00 0.00 179.45 176.50 1pgt h ASP 116 N -0.04 0.54 -0.38 4.20 3.32 -1.86 -2.09 116.42 120.11 1pgt h ASP 116 Ca 0.29 -0.17 -0.13 0.00 0.02 0.00 0.00 57.03 57.04 1pgt h ASP 116 Cb 0.49 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1pgt h ASP 116 CO -0.66 0.76 -0.23 0.44 -1.72 0.00 0.00 179.24 177.82 1pgt h ASP 117 N 0.48 0.90 -0.30 6.45 3.32 -1.72 -2.43 116.42 123.12 1pgt h ASP 117 Ca 0.08 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1pgt h ASP 117 Cb 0.64 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1pgt h ASP 117 CO 0.05 1.10 0.20 0.22 -1.72 0.00 0.00 179.24 179.08 1pgt h TYR 118 N 0.76 0.38 -0.31 4.55 5.03 -0.88 -1.92 116.97 124.58 1pgt h TYR 118 Ca 0.10 0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.32 1pgt h TYR 118 Cb 0.78 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.92 1pgt h TYR 118 CO 0.05 0.25 -0.19 0.28 -1.32 0.00 0.00 178.16 177.22 1pgt h VAL 119 N 0.40 1.26 -0.33 1.81 2.07 -1.33 -0.96 116.25 119.16 1pgt h VAL 119 Ca 0.11 -1.20 -0.09 0.00 0.82 0.00 0.00 66.70 66.34 1pgt h VAL 119 Cb -0.04 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1pgt h VAL 119 CO -0.02 0.39 -0.18 0.50 0.02 0.00 0.00 177.57 178.28 1pgt h LYS 120 N 0.51 0.60 -0.00 1.57 3.64 -1.25 -2.47 116.57 119.17 1pgt h LYS 120 Ca 0.08 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1pgt h LYS 120 Cb 0.62 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1pgt h LYS 120 CO 0.04 0.75 -0.31 0.00 -2.27 0.00 0.00 179.45 177.66 1pgt n ALA 121 N -2.49 3.10 -0.23 5.00 0.00 -0.74 -4.40 120.51 120.76 1pgt n ALA 121 Ca 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 53.44 53.15 1pgt n ALA 121 Cb 0.38 -1.25 0.09 0.00 0.00 0.00 0.00 19.45 18.67 1pgt n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1pgt h LEU 122 N 0.06 0.59 -1.68 0.00 5.85 -0.68 -2.84 115.31 116.60 1pgt h LEU 122 Ca 0.00 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.79 1pgt h LEU 122 Cb 0.49 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1pgt h LEU 122 CO 0.00 0.39 0.29 1.55 -0.34 0.00 0.00 178.44 180.34 1pgt h PRO 123 N 0.72 0.39 0.00 5.25 0.13 -1.77 -0.23 132.00 136.49 1pgt h PRO 123 Ca 0.28 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.34 1pgt h PRO 123 Cb 0.12 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.16 1pgt h PRO 123 CO -0.15 0.26 -0.24 0.78 -0.23 0.00 0.00 178.00 178.42 1pgt h GLY 124 N 0.40 0.00 1.60 1.56 0.00 -1.81 -1.95 103.07 102.86 1pgt h GLY 124 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.43 1pgt h GLY 124 CO -0.04 0.00 -0.72 1.46 0.00 0.00 0.00 176.54 177.23 1pgt h GLN 125 N 0.00 0.00 0.00 4.80 1.08 -1.07 -3.32 115.11 116.60 1pgt h GLN 125 Ca -0.00 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.06 1pgt h GLN 125 Cb 0.79 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.19 1pgt h GLN 125 CO 0.03 0.29 -1.53 1.28 -0.95 0.00 0.00 178.83 177.96 1pgt n LEU 126 N -3.04 0.65 -0.33 1.46 4.77 -0.88 -4.37 117.00 115.25 1pgt n LEU 126 Ca -0.01 0.28 0.17 0.00 -0.03 0.00 0.00 56.01 56.42 1pgt n LEU 126 Cb 0.70 0.08 0.37 0.00 -2.33 0.00 0.00 43.42 42.25 1pgt n LEU 126 CO 0.40 0.10 1.13 0.50 -1.33 0.00 0.00 177.39 178.19 1pgt h LYS 127 N 0.00 0.50 -0.74 3.23 3.64 -1.46 -0.81 116.57 120.94 1pgt h LYS 127 Ca -0.15 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.27 1pgt h LYS 127 Cb 1.47 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 33.13 1pgt h LYS 127 CO 0.03 0.33 0.48 -1.35 -2.27 0.00 0.00 179.45 176.68 1pgt h PRO 128 N 0.52 0.71 -0.00 1.90 0.11 -1.79 0.15 132.00 133.60 1pgt h PRO 128 Ca 0.63 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 66.53 1pgt h PRO 128 Cb 1.21 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1pgt h PRO 128 CO -0.50 0.47 -0.76 0.74 -0.21 0.00 0.00 178.00 177.74 1pgt h PHE 129 N 0.73 0.06 -0.32 0.65 0.04 -1.42 -0.47 116.94 116.21 1pgt h PHE 129 Ca 0.32 -0.03 -0.16 0.00 2.80 0.00 0.00 57.97 60.90 1pgt h PHE 129 Cb 0.32 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.46 1pgt h PHE 129 CO -0.00 0.79 -0.45 1.49 -0.60 0.00 0.00 178.31 179.53 1pgt h GLU 130 N 0.02 0.83 -0.44 1.51 4.57 -1.06 -2.06 114.58 117.95 1pgt h GLU 130 Ca -0.01 -0.47 -0.02 0.00 -1.18 0.00 0.00 59.36 57.68 1pgt h GLU 130 Cb 1.35 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.95 1pgt h GLU 130 CO 0.10 1.11 0.20 1.15 -1.18 0.00 0.00 179.01 180.38 1pgt h THR 131 N 0.66 1.19 -0.38 0.32 2.02 -0.86 0.11 112.91 115.98 1pgt h THR 131 Ca 0.04 -0.57 0.02 0.00 0.77 0.00 0.00 66.41 66.67 1pgt h THR 131 Cb 1.03 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1pgt h THR 131 CO 0.10 0.22 0.19 -0.07 0.37 0.00 0.00 175.52 176.33 1pgt h LEU 132 N 0.58 0.29 -0.63 2.58 3.38 -0.86 -1.88 115.31 118.77 1pgt h LEU 132 Ca 0.15 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1pgt h LEU 132 Cb 0.16 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1pgt h LEU 132 CO -0.02 0.21 0.38 -0.07 0.09 0.00 0.00 178.44 179.04 1pgt h LEU 133 N 0.40 0.75 -2.51 1.67 -0.00 -1.04 -2.56 115.31 112.03 1pgt h LEU 133 Ca 0.16 -0.06 0.01 0.00 -0.00 0.00 0.00 57.88 57.99 1pgt h LEU 133 Cb 0.05 -0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 40.52 1pgt h LEU 133 CO -0.10 0.59 0.05 0.77 -0.00 0.00 0.00 178.44 179.75 1pgt h SER 134 N 0.85 0.00 0.20 -0.43 4.64 -0.03 -0.38 113.55 118.40 1pgt h SER 134 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1pgt h SER 134 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1pgt h SER 134 CO -0.04 0.00 -0.42 0.00 -0.87 0.00 0.00 176.83 175.50 1pgt n GLN 135 N -3.67 0.72 -3.75 4.77 6.02 -0.80 -3.95 117.38 116.74 1pgt n GLN 135 Ca -0.02 -0.49 -0.35 0.00 -0.01 0.00 0.00 57.00 56.12 1pgt n GLN 135 Cb 0.13 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.81 1pgt n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1pgt s ASN 136 N -2.62 5.16 -1.39 1.08 2.47 -0.54 -4.78 114.94 114.32 1pgt s ASN 136 Ca 0.19 -2.99 -0.04 0.00 0.42 0.00 0.00 52.86 50.44 1pgt s ASN 136 Cb 0.18 -1.83 0.03 0.00 -1.45 0.00 0.00 41.25 38.18 1pgt s ASN 136 CO 0.59 -0.32 0.74 0.00 -3.72 0.00 0.00 177.10 174.39 1pgt n GLN 137 N 3.28 -4.86 -1.53 0.43 6.02 -1.26 -1.78 117.38 117.68 1pgt n GLN 137 Ca 0.09 0.58 -0.18 0.00 -0.01 0.00 0.00 57.00 57.48 1pgt n GLN 137 Cb 0.37 -5.18 -0.08 0.00 1.02 0.00 0.00 30.24 26.37 1pgt n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1pgt n GLY 138 N -1.66 1.77 2.19 1.08 0.00 -1.25 -2.34 105.19 104.97 1pgt n GLY 138 Ca -0.20 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 1pgt n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pgt n GLY 139 N -0.56 0.03 0.62 -0.02 0.00 -0.26 -4.81 105.19 100.18 1pgt n GLY 139 Ca -0.18 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.46 1pgt n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pgt n LYS 140 N -1.96 1.52 0.00 1.61 4.76 -0.99 -4.82 118.16 118.29 1pgt n LYS 140 Ca -0.11 -1.24 0.00 0.00 -2.87 0.00 0.00 58.31 54.08 1pgt n LYS 140 Cb 0.57 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.30 1pgt n LYS 140 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1pgt n THR 141 N 0.34 0.00 -3.44 -0.18 -2.24 -1.26 -5.12 114.28 102.39 1pgt n THR 141 Ca 0.10 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.72 1pgt n THR 141 Cb 0.50 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.75 1pgt n THR 141 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1pgt n PHE 142 N 0.00 -1.59 -0.01 4.78 3.72 -1.25 -5.01 117.46 118.10 1pgt n PHE 142 Ca 0.00 -1.60 -0.10 0.00 -0.05 0.00 0.00 57.45 55.70 1pgt n PHE 142 Cb 0.00 -0.35 0.05 0.00 -0.94 0.00 0.00 39.48 38.23 1pgt n PHE 142 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1pgt h ILE 143 N 0.37 1.31 -3.53 4.37 6.09 -1.96 -3.43 117.51 120.73 1pgt h ILE 143 Ca -0.22 -1.74 -0.45 0.00 -1.37 0.00 0.00 64.86 61.08 1pgt h ILE 143 Cb 0.90 1.70 -0.33 0.00 0.47 0.00 0.00 36.82 39.56 1pgt h ILE 143 CO 0.34 0.55 -0.79 -0.69 -3.07 0.00 0.00 178.15 174.49 1pgt s VAL 144 N -4.07 0.78 0.00 2.19 1.01 -1.26 -4.69 120.40 114.36 1pgt s VAL 144 Ca -0.08 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1pgt s VAL 144 Cb 0.11 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.75 1pgt s VAL 144 CO 0.85 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.83 1pgt n GLY 145 N 3.78 -0.16 1.27 4.51 0.00 -1.26 -4.22 105.19 109.11 1pgt n GLY 145 Ca -0.23 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.75 1pgt n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pgt n ASP 146 N -1.70 1.98 -3.94 1.61 5.68 -1.26 -3.86 116.55 115.06 1pgt n ASP 146 Ca 0.00 -3.18 -0.10 0.00 -0.50 0.00 0.00 54.79 51.01 1pgt n ASP 146 Cb 0.00 -0.43 -0.12 0.00 -1.14 0.00 0.00 41.12 39.43 1pgt n ASP 146 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 1pgt s GLN 147 N -2.43 0.21 0.57 0.11 2.00 -1.26 -4.89 119.66 113.97 1pgt s GLN 147 Ca 0.38 -0.40 -0.19 0.00 -2.00 0.00 0.00 55.36 53.15 1pgt s GLN 147 Cb 0.38 0.07 -0.04 0.00 0.80 0.00 0.00 33.01 34.22 1pgt s GLN 147 CO -0.08 -0.03 1.18 -1.50 -0.50 0.00 0.00 175.29 174.36 1pgt s ILE 148 N -0.97 2.81 0.32 -2.34 2.07 -1.26 -4.80 121.20 117.03 1pgt s ILE 148 Ca -0.11 0.51 0.03 0.00 -1.41 0.00 0.00 60.65 59.67 1pgt s ILE 148 Cb -0.07 -3.20 -0.06 0.00 0.13 0.00 0.00 42.46 39.26 1pgt s ILE 148 CO -0.01 -0.11 0.06 -0.94 -1.91 0.00 0.00 174.94 172.04 1pgt s SER 149 N -1.65 2.23 0.51 4.50 1.04 -1.26 -4.68 113.70 114.39 1pgt s SER 149 Ca 0.76 -1.38 0.16 0.00 0.48 0.00 0.00 55.95 55.97 1pgt s SER 149 Cb -0.28 -0.06 1.24 0.00 0.10 0.00 0.00 66.02 67.02 1pgt s SER 149 CO 0.31 -0.62 2.13 2.19 0.98 0.00 0.00 173.24 178.22 1pgt h PHE 150 N 2.15 0.00 0.00 5.02 -5.15 -1.44 -1.06 116.94 116.47 1pgt h PHE 150 Ca -0.40 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.32 1pgt h PHE 150 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.41 1pgt h PHE 150 CO 0.56 0.03 -0.21 0.00 -2.00 0.00 0.00 178.31 176.69 1pgt h ALA 151 N 1.97 1.33 -0.41 12.09 0.00 -1.87 -2.72 119.26 129.64 1pgt h ALA 151 Ca -0.00 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1pgt h ALA 151 Cb 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1pgt h ALA 151 CO 0.00 0.26 0.03 -0.44 0.00 0.00 0.00 179.25 179.10 1pgt h ASP 152 N 0.00 0.69 -0.53 0.00 3.32 -1.59 -0.46 116.42 117.85 1pgt h ASP 152 Ca -0.00 -0.29 -0.06 0.00 0.02 0.00 0.00 57.03 56.69 1pgt h ASP 152 Cb 0.47 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1pgt h ASP 152 CO 0.03 0.81 0.10 1.88 -1.72 0.00 0.00 179.24 180.34 1pgt h TYR 153 N 0.55 0.97 -0.43 4.55 0.05 -1.49 0.16 116.97 121.33 1pgt h TYR 153 Ca 0.12 -0.11 -0.14 0.00 0.05 0.00 0.00 58.73 58.65 1pgt h TYR 153 Cb 0.44 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 1pgt h TYR 153 CO 0.03 0.82 -0.28 -0.97 -1.05 0.00 0.00 178.16 176.72 1pgt h ASN 154 N 0.88 0.98 -0.55 3.88 -1.24 -1.41 -1.01 115.58 117.11 1pgt h ASN 154 Ca 0.18 -0.43 -0.07 0.00 0.71 0.00 0.00 56.30 56.70 1pgt h ASN 154 Cb 0.37 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.13 1pgt h ASN 154 CO 0.01 1.20 0.08 0.25 -1.29 0.00 0.00 177.43 177.68 1pgt h LEU 155 N 0.78 0.87 -0.33 0.34 5.85 -0.79 -0.87 115.31 121.16 1pgt h LEU 155 Ca 0.09 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1pgt h LEU 155 Cb 0.86 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 1pgt h LEU 155 CO 0.08 0.91 0.18 0.25 -0.34 0.00 0.00 178.44 179.52 1pgt h LEU 156 N 0.80 0.40 -0.33 2.25 5.85 -0.53 -0.57 115.31 123.18 1pgt h LEU 156 Ca 0.17 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.86 1pgt h LEU 156 Cb 0.42 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 1pgt h LEU 156 CO 0.01 0.37 0.03 -0.78 -0.34 0.00 0.00 178.44 177.73 1pgt h ASP 157 N 0.41 -0.06 -0.91 1.25 3.58 -0.98 -1.00 116.42 118.70 1pgt h ASP 157 Ca 0.11 0.07 0.05 0.00 0.42 0.00 0.00 57.03 57.68 1pgt h ASP 157 Cb 0.05 0.10 -0.06 0.00 1.72 0.00 0.00 39.33 41.15 1pgt h ASP 157 CO -0.02 0.00 0.59 0.25 -2.88 0.00 0.00 179.24 177.18 1pgt h LEU 158 N 0.14 0.96 -0.40 2.28 5.85 -0.48 -1.72 115.31 121.94 1pgt h LEU 158 Ca 0.16 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.77 1pgt h LEU 158 Cb 0.20 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1pgt h LEU 158 CO -0.24 0.64 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.27 1pgt h LEU 159 N 1.11 0.84 -1.03 2.25 3.38 -0.41 -2.52 115.31 118.93 1pgt h LEU 159 Ca 0.38 -0.39 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1pgt h LEU 159 Cb 0.06 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1pgt h LEU 159 CO -0.14 1.04 0.16 -0.07 0.09 0.00 0.00 178.44 179.52 1pgt h LEU 160 N 0.63 0.79 -0.57 1.67 3.38 -0.97 -0.37 115.31 119.87 1pgt h LEU 160 Ca 0.09 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1pgt h LEU 160 Cb 0.71 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1pgt h LEU 160 CO 0.05 0.76 -0.14 0.16 0.09 0.00 0.00 178.44 179.37 1pgt h ILE 161 N 0.83 0.27 0.00 1.22 3.07 -1.28 -2.41 117.51 119.21 1pgt h ILE 161 Ca 0.19 -1.13 -0.19 0.00 1.55 0.00 0.00 64.86 65.27 1pgt h ILE 161 Cb 0.27 1.91 -0.03 0.00 -0.27 0.00 0.00 36.82 38.70 1pgt h ILE 161 CO -0.01 0.13 -0.91 0.45 -1.05 0.00 0.00 178.15 176.77 1pgt h HIS 162 N 0.00 0.00 -0.03 0.16 3.86 -0.95 -1.91 115.15 116.28 1pgt h HIS 162 Ca -0.00 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.08 1pgt h HIS 162 Cb 0.90 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.36 1pgt h HIS 162 CO 0.00 0.91 -0.56 0.93 0.86 0.00 0.00 177.93 180.07 1pgt h GLU 163 N 0.00 0.10 -0.38 2.45 4.39 -0.82 0.41 114.58 120.72 1pgt h GLU 163 Ca -0.01 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.51 1pgt h GLU 163 Cb 1.68 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.33 1pgt h GLU 163 CO 0.12 0.63 -0.27 0.28 -1.16 0.00 0.00 179.01 178.61 1pgt h VAL 164 N 0.07 1.27 -0.14 3.13 2.07 -1.38 -2.50 116.25 118.78 1pgt h VAL 164 Ca -0.00 -1.40 -0.16 0.00 0.82 0.00 0.00 66.70 65.96 1pgt h VAL 164 Cb 1.01 1.27 0.01 0.00 -1.52 0.00 0.00 31.29 32.05 1pgt h VAL 164 CO 0.08 0.46 -0.53 0.25 0.02 0.00 0.00 177.57 177.85 1pgt h LEU 165 N 0.67 0.72 -6.52 2.57 6.46 -0.73 -3.40 115.31 115.08 1pgt h LEU 165 Ca 0.08 -0.61 -0.57 0.00 -0.12 0.00 0.00 57.88 56.66 1pgt h LEU 165 Cb 0.79 -0.21 -0.38 0.00 -0.73 0.00 0.00 40.66 40.13 1pgt h LEU 165 CO 0.07 1.21 -0.87 0.00 -0.62 0.00 0.00 178.44 178.22 1pgt s ALA 166 N -3.80 0.96 0.23 1.25 0.00 0.14 -5.09 121.76 115.46 1pgt s ALA 166 Ca -0.12 -1.95 -0.31 0.00 0.00 0.00 0.00 51.96 49.57 1pgt s ALA 166 Cb 0.07 -1.62 -0.14 0.00 0.00 0.00 0.00 23.12 21.43 1pgt s ALA 166 CO 0.85 -2.08 1.28 -2.30 0.00 0.00 0.00 175.76 173.50 1pgt n PRO 167 N 3.77 1.69 -0.99 0.00 -0.02 -0.95 -0.87 135.00 137.64 1pgt n PRO 167 Ca 0.16 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 1pgt n PRO 167 Cb 0.40 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1pgt n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pgt n GLY 168 N 1.92 0.55 0.22 -1.23 0.00 -1.26 -4.91 105.19 100.48 1pgt n GLY 168 Ca 0.12 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.29 1pgt n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pgt n LEU 170 N -2.59 2.82 0.10 0.00 4.32 -1.26 -4.39 117.00 116.00 1pgt n LEU 170 Ca -0.01 -1.00 0.05 0.00 -0.02 0.00 0.00 56.01 55.03 1pgt n LEU 170 Cb 0.11 -0.04 0.49 0.00 -1.62 0.00 0.00 43.42 42.36 1pgt n LEU 170 CO 0.16 0.50 1.10 0.44 -1.22 0.00 0.00 177.39 178.37 1pgt h ASP 171 N 4.26 0.28 -0.03 -1.43 3.32 -1.84 -2.00 116.42 118.98 1pgt h ASP 171 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1pgt h ASP 171 Cb 0.91 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.39 1pgt h ASP 171 CO 0.00 0.23 0.00 0.00 -1.72 0.00 0.00 179.24 177.75 1pgt n ALA 172 N -2.50 2.61 -3.81 3.45 0.00 -1.26 -4.61 120.51 114.39 1pgt n ALA 172 Ca 0.01 -0.29 -0.30 0.00 0.00 0.00 0.00 53.44 52.85 1pgt n ALA 172 Cb 0.09 -1.30 -0.14 0.00 0.00 0.00 0.00 19.45 18.10 1pgt n ALA 172 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1pgt s PHE 173 N -1.96 2.36 0.24 0.00 0.08 -0.75 -5.01 117.98 112.93 1pgt s PHE 173 Ca 0.38 -2.32 -0.06 0.00 0.12 0.00 0.00 56.93 55.05 1pgt s PHE 173 Cb 0.18 -2.12 0.23 0.00 -0.57 0.00 0.00 43.02 40.75 1pgt s PHE 173 CO 0.30 -0.86 1.82 -1.35 -0.10 0.00 0.00 175.22 175.04 1pgt h PRO 174 N 7.49 1.16 -0.13 0.24 0.11 -1.82 0.41 132.00 139.46 1pgt h PRO 174 Ca -0.08 -0.18 -0.23 0.00 0.11 0.00 0.00 66.00 65.62 1pgt h PRO 174 Cb 0.98 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 31.90 1pgt h PRO 174 CO 0.50 0.90 -0.82 -0.07 -0.21 0.00 0.00 178.00 178.30 1pgt h LEU 175 N 1.14 0.95 -0.42 2.35 3.38 -1.93 -1.74 115.31 119.04 1pgt h LEU 175 Ca 0.27 -0.65 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 1pgt h LEU 175 Cb 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1pgt h LEU 175 CO -0.03 1.45 -0.05 -0.07 0.09 0.00 0.00 178.44 179.83 1pgt h LEU 176 N 0.52 0.76 -0.01 1.67 4.07 -1.89 -1.15 115.31 119.29 1pgt h LEU 176 Ca -0.07 -0.33 0.03 0.00 0.08 0.00 0.00 57.88 57.59 1pgt h LEU 176 Cb 1.46 -0.21 -0.04 0.00 1.08 0.00 0.00 40.66 42.96 1pgt h LEU 176 CO 0.17 0.92 -0.18 0.28 -1.08 0.00 0.00 178.44 178.54 1pgt h SER 177 N 0.59 -0.53 -0.42 -0.43 0.02 -0.89 -2.18 113.55 109.73 1pgt h SER 177 Ca 0.11 0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 1pgt h SER 177 Cb 0.55 0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 1pgt h SER 177 CO 0.03 -0.24 0.11 0.00 -1.14 0.00 0.00 176.83 175.58 1pgt h ALA 178 N 0.64 1.28 -0.59 3.77 0.00 -1.19 -2.65 119.26 120.52 1pgt h ALA 178 Ca 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1pgt h ALA 178 Cb 0.37 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1pgt h ALA 178 CO -0.18 0.50 0.28 -0.92 0.00 0.00 0.00 179.25 178.93 1pgt h TYR 179 N 0.72 0.85 -0.65 0.00 3.20 -0.93 -0.68 116.97 119.47 1pgt h TYR 179 Ca 0.16 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 1pgt h TYR 179 Cb 0.28 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 1pgt h TYR 179 CO 0.01 0.65 0.17 0.28 -1.64 0.00 0.00 178.16 177.63 1pgt h VAL 180 N 0.80 1.26 -0.35 1.81 2.07 -1.29 0.12 116.25 120.67 1pgt h VAL 180 Ca 0.20 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1pgt h VAL 180 Cb 0.12 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1pgt h VAL 180 CO -0.02 0.35 0.16 1.23 0.02 0.00 0.00 177.57 179.31 1pgt h GLY 181 N 0.96 0.54 0.76 2.17 0.00 -1.18 -0.97 103.07 105.36 1pgt h GLY 181 Ca 0.21 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 1pgt h GLY 181 CO -0.00 0.26 -0.03 -0.09 0.00 0.00 0.00 176.54 176.68 1pgt h ARG 182 N 0.42 0.29 -0.44 4.80 2.43 -0.71 -2.67 114.38 118.50 1pgt h ARG 182 Ca 0.12 -0.11 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 1pgt h ARG 182 Cb 0.13 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1pgt h ARG 182 CO -0.01 0.57 -0.06 -0.07 -1.51 0.00 0.00 179.97 178.88 1pgt h LEU 183 N -0.01 0.82 -1.50 3.80 4.07 -0.68 -2.73 115.31 119.07 1pgt h LEU 183 Ca 0.04 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.66 1pgt h LEU 183 Cb 0.46 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.98 1pgt h LEU 183 CO 0.01 0.96 0.00 0.28 -1.08 0.00 0.00 178.44 178.62 1pgt h SER 184 N 0.65 0.00 -0.02 -0.43 0.02 -1.18 -2.31 113.55 110.29 1pgt h SER 184 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1pgt h SER 184 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1pgt h SER 184 CO 0.03 0.00 -0.03 0.00 -1.14 0.00 0.00 176.83 175.69 1pgt n ALA 185 N -1.83 2.58 -1.80 3.77 0.00 -1.01 -3.74 120.51 118.47 1pgt n ALA 185 Ca -0.01 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.41 1pgt n ALA 185 Cb 0.09 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 1pgt n ALA 185 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1pgt s ARG 186 N -2.04 4.17 0.13 0.00 0.52 -0.87 -4.79 118.95 116.07 1pgt s ARG 186 Ca 0.31 2.49 -0.30 0.00 -0.52 0.00 0.00 55.73 57.70 1pgt s ARG 186 Cb 0.20 -3.06 -0.07 0.00 0.52 0.00 0.00 34.95 32.54 1pgt s ARG 186 CO 0.33 -0.58 1.57 -1.35 0.02 0.00 0.00 175.30 175.29 1pgt h PRO 187 N 5.19 -0.48 -0.19 3.54 0.11 -1.91 0.13 132.00 138.39 1pgt h PRO 187 Ca -0.46 0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.61 1pgt h PRO 187 Cb 1.22 0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 1pgt h PRO 187 CO 0.81 -0.32 -0.21 0.87 -0.21 0.00 0.00 178.00 178.94 1pgt h LYS 188 N -0.50 0.33 -0.18 1.05 1.57 -1.90 -2.77 116.57 114.17 1pgt h LYS 188 Ca 0.07 -0.10 -0.20 0.00 -1.87 0.00 0.00 60.65 58.55 1pgt h LYS 188 Cb 0.64 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1pgt h LYS 188 CO -0.44 0.53 -0.68 1.25 -0.57 0.00 0.00 179.45 179.55 1pgt h LEU 189 N 0.31 0.84 -0.77 2.94 5.85 -1.78 -2.17 115.31 120.52 1pgt h LEU 189 Ca 0.05 -0.51 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1pgt h LEU 189 Cb 0.54 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1pgt h LEU 189 CO 0.04 1.28 0.49 0.50 -0.34 0.00 0.00 178.44 180.41 1pgt h LYS 190 N 0.52 1.03 -0.45 1.25 3.64 -0.85 -0.21 116.57 121.51 1pgt h LYS 190 Ca -0.02 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 1pgt h LYS 190 Cb 1.28 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.86 1pgt h LYS 190 CO 0.14 0.71 0.18 0.00 -2.27 0.00 0.00 179.45 178.20 1pgt h ALA 191 N 1.26 0.58 -0.29 5.00 0.00 -1.44 -2.36 119.26 122.01 1pgt h ALA 191 Ca 0.28 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1pgt h ALA 191 Cb -0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1pgt h ALA 191 CO -0.06 0.19 0.12 0.35 0.00 0.00 0.00 179.25 179.85 1pgt h PHE 192 N 0.58 0.44 0.00 0.00 3.57 -0.96 -2.76 116.94 117.81 1pgt h PHE 192 Ca 0.15 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 1pgt h PHE 192 Cb 0.19 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 1pgt h PHE 192 CO 0.00 0.43 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.36 1pgt h LEU 193 N 0.33 0.00 -0.14 0.59 3.38 -0.92 -1.68 115.31 116.87 1pgt h LEU 193 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1pgt h LEU 193 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1pgt h LEU 193 CO -0.01 0.08 -0.49 0.00 0.09 0.00 0.00 178.44 178.11 1pgt n ALA 194 N -2.21 3.56 -1.83 1.53 0.00 -0.90 -4.53 120.51 116.12 1pgt n ALA 194 Ca -0.01 -0.39 -0.33 0.00 0.00 0.00 0.00 53.44 52.71 1pgt n ALA 194 Cb 0.24 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.56 1pgt n ALA 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1pgt s SER 195 N -2.87 6.75 0.32 0.00 1.04 -0.63 -4.84 113.70 113.48 1pgt s SER 195 Ca 0.14 1.63 0.01 0.00 0.48 0.00 0.00 55.95 58.21 1pgt s SER 195 Cb 0.18 -2.52 0.57 0.00 0.10 0.00 0.00 66.02 64.35 1pgt s SER 195 CO 0.67 -0.49 1.95 -0.65 0.98 0.00 0.00 173.24 175.69 1pgt h PRO 196 N 1.35 0.94 0.00 4.02 0.11 -1.93 0.75 132.00 137.24 1pgt h PRO 196 Ca -0.48 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 1pgt h PRO 196 Cb 1.18 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1pgt h PRO 196 CO 0.61 0.62 -0.01 1.05 -0.21 0.00 0.00 178.00 180.07 1pgt h GLU 197 N 0.97 0.00 0.00 1.05 4.11 -1.94 0.27 114.58 119.04 1pgt h GLU 197 Ca 0.33 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.51 1pgt h GLU 197 Cb 0.10 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1pgt h GLU 197 CO -0.11 0.01 -1.74 0.98 0.07 0.00 0.00 179.01 178.22 1pgt n TYR 198 N -3.29 0.18 -0.02 2.06 9.36 -0.88 -4.45 117.16 120.12 1pgt n TYR 198 Ca -0.03 0.08 -0.02 0.00 3.32 0.00 0.00 57.90 61.25 1pgt n TYR 198 Cb 0.09 -0.82 0.24 0.00 -0.63 0.00 0.00 39.34 38.22 1pgt n TYR 198 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1pgt h VAL 199 N -1.00 1.23 -0.40 2.97 2.07 -0.82 -2.75 116.25 117.55 1pgt h VAL 199 Ca -0.38 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.18 1pgt h VAL 199 Cb 1.29 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1pgt h VAL 199 CO -0.23 0.32 0.00 0.59 0.02 0.00 0.00 177.57 178.28 1pgt n ASN 200 N -4.22 2.41 -4.65 0.57 3.02 0.08 -4.79 115.26 107.67 1pgt n ASN 200 Ca 0.01 -2.08 -0.35 0.00 -0.03 0.00 0.00 54.58 52.14 1pgt n ASN 200 Cb 0.30 -0.32 -0.10 0.00 -0.61 0.00 0.00 39.78 39.05 1pgt n ASN 200 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1pgt s LEU 201 N -1.08 3.69 0.70 3.41 2.96 -1.04 -5.05 118.68 122.28 1pgt s LEU 201 Ca 0.28 0.10 -0.15 0.00 -0.22 0.00 0.00 54.13 54.14 1pgt s LEU 201 Cb 0.16 -1.89 0.02 0.00 0.50 0.00 0.00 46.19 44.98 1pgt s LEU 201 CO 0.17 0.27 1.17 -2.16 -1.32 0.00 0.00 176.35 174.48 1pgt s PRO 202 N -0.21 2.40 0.03 0.98 0.04 -1.26 -4.71 135.00 132.26 1pgt s PRO 202 Ca 0.06 1.62 -0.19 0.00 0.04 0.00 0.00 61.00 62.54 1pgt s PRO 202 Cb -0.12 -1.88 -0.20 0.00 0.04 0.00 0.00 34.50 32.34 1pgt s PRO 202 CO 0.02 -1.61 1.18 0.82 0.04 0.00 0.00 177.00 177.45 1pgt h ILE 203 N -0.15 1.39 -1.61 0.56 2.04 -1.94 0.60 117.51 118.40 1pgt h ILE 203 Ca -0.47 -1.91 -0.62 0.00 1.00 0.00 0.00 64.86 62.86 1pgt h ILE 203 Cb 1.28 2.35 -0.13 0.00 -0.74 0.00 0.00 36.82 39.58 1pgt h ILE 203 CO 0.51 0.56 -0.59 0.20 0.00 0.00 0.00 178.15 178.84 1pgt s ASN 204 N -6.68 3.76 0.10 1.72 0.01 -1.26 -0.50 114.94 112.08 1pgt s ASN 204 Ca -0.13 -1.41 -0.19 0.00 -0.71 0.00 0.00 52.86 50.42 1pgt s ASN 204 Cb 0.05 -0.23 -0.07 0.00 0.41 0.00 0.00 41.25 41.41 1pgt s ASN 204 CO 0.82 -0.53 1.63 1.23 -1.51 0.00 0.00 177.10 178.74 1pgt h GLY 205 N 1.74 0.42 -3.04 0.66 0.00 -1.91 -3.36 103.07 97.57 1pgt h GLY 205 Ca -0.44 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 46.58 1pgt h GLY 205 CO 0.79 0.22 0.10 1.16 0.00 0.00 0.00 176.54 178.81 1pgt n ASN 206 N -4.76 4.37 0.00 0.19 6.94 -1.26 -4.92 115.26 115.82 1pgt n ASN 206 Ca -0.03 -2.80 0.00 0.00 -0.02 0.00 0.00 54.58 51.73 1pgt n ASN 206 Cb 0.14 -0.66 0.00 0.00 -2.36 0.00 0.00 39.78 36.90 1pgt n ASN 206 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pgt n GLY 207 N 0.23 0.29 3.65 4.83 0.00 -1.26 -5.00 105.19 107.93 1pgt n GLY 207 Ca 0.26 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 1pgt n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pgt s LYS 208 N -0.92 2.39 0.00 1.61 1.02 -1.26 -5.08 119.74 117.50 1pgt s LYS 208 Ca 0.00 -0.99 0.00 0.00 0.02 0.00 0.00 55.97 55.00 1pgt s LYS 208 Cb 0.00 -2.41 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 1pgt s LYS 208 CO 0.00 0.50 0.00 0.00 -0.92 0.00 0.00 175.35 174.93