#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmu n ALA 2 N 0.00 1.53 -2.88 7.33 0.00 0.15 -4.50 120.51 122.14 2jmu n ALA 2 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 2jmu n ALA 2 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2jmu n ALA 2 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jmu s GLN 3 N -1.53 3.84 0.00 0.00 -0.21 0.01 -4.31 119.66 117.46 2jmu s GLN 3 Ca 0.00 -2.09 0.00 0.00 0.02 0.00 0.00 55.36 53.29 2jmu s GLN 3 Cb 0.00 -5.07 0.00 0.00 1.00 0.00 0.00 33.01 28.94 2jmu s GLN 3 CO 0.00 -1.85 0.00 0.41 -2.12 0.00 0.00 175.29 171.73 2jmu n GLY 4 N 5.00 -1.11 3.54 3.09 0.00 -1.25 -5.07 105.19 109.40 2jmu n GLY 4 Ca 0.32 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 2jmu n GLY 4 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jmu s LEU 5 N 0.00 3.98 0.02 0.99 1.43 -1.25 -3.90 118.68 119.95 2jmu s LEU 5 Ca 0.00 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.68 2jmu s LEU 5 Cb 0.00 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 2jmu s LEU 5 CO 0.00 -1.20 0.96 -0.63 0.23 0.00 0.00 176.35 175.71 2jmu s ILE 6 N 4.01 4.79 -0.35 -0.59 1.09 0.25 -4.75 121.20 125.65 2jmu s ILE 6 Ca 0.34 2.04 -0.28 0.00 -1.10 0.00 0.00 60.65 61.65 2jmu s ILE 6 Cb -0.11 -4.31 0.02 0.00 -1.06 0.00 0.00 42.46 37.00 2jmu s ILE 6 CO 0.23 0.20 1.06 -1.61 -0.10 0.00 0.00 174.94 174.72 2jmu s GLU 7 N 0.76 3.98 -0.32 2.79 2.02 -1.26 -0.82 118.70 125.85 2jmu s GLU 7 Ca 0.50 0.92 -0.08 0.00 0.02 0.00 0.00 54.97 56.33 2jmu s GLU 7 Cb -0.21 -3.77 0.01 0.00 0.10 0.00 0.00 34.13 30.26 2jmu s GLU 7 CO 0.28 -0.98 0.12 0.14 0.02 0.00 0.00 175.26 174.84 2jmu s VAL 8 N 3.75 4.16 0.14 2.63 -7.23 0.10 -4.99 120.40 118.96 2jmu s VAL 8 Ca 0.45 -0.74 0.05 0.00 -1.81 0.00 0.00 61.98 59.93 2jmu s VAL 8 Cb -0.11 -3.20 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 2jmu s VAL 8 CO 0.18 -0.02 -0.11 -1.83 -0.31 0.00 0.00 175.10 173.02 2jmu s GLU 9 N 1.52 1.03 0.14 4.82 1.03 -1.25 -1.14 118.70 124.84 2jmu s GLU 9 Ca 0.02 -1.38 -0.14 0.00 0.03 0.00 0.00 54.97 53.50 2jmu s GLU 9 Cb -0.18 -0.67 0.02 0.00 -0.80 0.00 0.00 34.13 32.50 2jmu s GLU 9 CO 0.04 0.09 0.37 0.50 -1.33 0.00 0.00 175.26 174.93 2jmu s ARG 10 N -3.43 1.09 0.06 -4.83 6.06 -0.89 -4.94 118.95 112.08 2jmu s ARG 10 Ca 0.14 -0.84 0.03 0.00 -2.50 0.00 0.00 55.73 52.56 2jmu s ARG 10 Cb 0.00 0.44 -0.04 0.00 0.06 0.00 0.00 34.95 35.42 2jmu s ARG 10 CO 0.01 -0.42 0.03 0.21 -2.50 0.00 0.00 175.30 172.63 2jmu s LYS 11 N -3.85 2.72 -0.02 5.12 2.47 -1.15 -1.27 119.74 123.76 2jmu s LYS 11 Ca 0.06 -0.72 -0.05 0.00 -1.56 0.00 0.00 55.97 53.70 2jmu s LYS 11 Cb 0.02 -2.64 0.01 0.00 -1.46 0.00 0.00 37.83 33.76 2jmu s LYS 11 CO -0.09 0.57 0.11 -0.59 0.16 0.00 0.00 175.35 175.52 2jmu s PHE 12 N -1.27 -0.04 -0.57 4.03 -0.71 -0.14 -0.71 117.98 118.57 2jmu s PHE 12 Ca 0.25 0.09 -0.07 0.00 -1.04 0.00 0.00 56.93 56.17 2jmu s PHE 12 Cb -0.12 -0.01 0.15 0.00 -1.21 0.00 0.00 43.02 41.83 2jmu s PHE 12 CO 0.17 -0.14 0.42 0.00 -1.34 0.00 0.00 175.22 174.33 2jmu s ALA 13 N -0.54 3.53 0.52 1.99 0.00 1.00 -1.28 121.76 126.97 2jmu s ALA 13 Ca -0.06 -2.90 0.01 0.00 0.00 0.00 0.00 51.96 49.01 2jmu s ALA 13 Cb -0.04 -2.81 0.02 0.00 0.00 0.00 0.00 23.12 20.29 2jmu s ALA 13 CO 0.00 -2.01 0.74 -1.25 0.00 0.00 0.00 175.76 173.24 2jmu s PRO 14 N 0.66 2.71 0.55 0.00 0.04 -1.25 -1.01 135.00 136.70 2jmu s PRO 14 Ca 0.12 -0.70 -0.06 0.00 0.04 0.00 0.00 61.00 60.39 2jmu s PRO 14 Cb -0.21 -2.52 -0.01 0.00 0.04 0.00 0.00 34.50 31.80 2jmu s PRO 14 CO -0.03 -0.56 0.87 0.20 0.04 0.00 0.00 177.00 177.51 2jmu s GLY 15 N -4.36 1.57 0.35 0.56 0.00 -1.20 -4.56 107.32 99.68 2jmu s GLY 15 Ca 0.54 -0.56 0.21 0.00 0.00 0.00 0.00 44.72 44.91 2jmu s GLY 15 CO 0.38 -0.33 1.46 -1.55 0.00 0.00 0.00 173.10 173.06 2jmu n PRO 16 N -2.47 -0.05 -0.51 2.90 -0.04 -1.26 -1.67 135.00 131.89 2jmu n PRO 16 Ca 0.03 1.26 -0.06 0.00 -0.04 0.00 0.00 63.50 64.69 2jmu n PRO 16 Cb 0.56 -2.30 0.02 0.00 -0.04 0.00 0.00 33.50 31.75 2jmu n PRO 16 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2jmu n ASP 17 N -5.01 4.80 0.10 3.54 5.75 -1.26 -4.49 116.55 119.98 2jmu n ASP 17 Ca 0.36 -2.55 -0.13 0.00 -0.01 0.00 0.00 54.79 52.45 2jmu n ASP 17 Cb 1.24 -0.90 -0.08 0.00 -1.03 0.00 0.00 41.12 40.35 2jmu n ASP 17 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 2jmu h THR 18 N 0.69 0.91 -0.73 2.12 2.02 -1.69 -1.01 112.91 115.22 2jmu h THR 18 Ca 0.13 -0.34 0.05 0.00 0.77 0.00 0.00 66.41 67.01 2jmu h THR 18 Cb 1.12 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.60 2jmu h THR 18 CO 0.29 0.08 0.44 -0.33 0.37 0.00 0.00 175.52 176.37 2jmu h GLU 19 N -0.39 0.80 -0.70 6.66 3.07 -1.89 0.17 114.58 122.30 2jmu h GLU 19 Ca -0.02 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.78 2jmu h GLU 19 Cb 0.30 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 28.00 2jmu h GLU 19 CO 0.04 0.53 0.40 0.93 -1.40 0.00 0.00 179.01 179.50 2jmu h GLU 20 N 0.82 0.97 -0.43 2.33 5.08 -1.86 -1.48 114.58 120.01 2jmu h GLU 20 Ca 0.31 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 2jmu h GLU 20 Cb 0.12 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2jmu h GLU 20 CO -0.15 0.72 0.02 -0.09 -1.00 0.00 0.00 179.01 178.50 2jmu h ARG 21 N 0.96 0.75 -0.75 2.33 9.65 -0.39 -2.64 114.38 124.29 2jmu h ARG 21 Ca 0.25 -0.23 0.09 0.00 -1.10 0.00 0.00 59.98 58.99 2jmu h ARG 21 Cb 0.01 -0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.45 2jmu h ARG 21 CO -0.04 0.81 0.40 -0.07 2.80 0.00 0.00 179.97 183.87 2jmu h LEU 22 N 0.59 0.56 -0.45 3.80 3.38 -0.21 0.58 115.31 123.55 2jmu h LEU 22 Ca 0.12 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.19 2jmu h LEU 22 Cb 0.46 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2jmu h LEU 22 CO 0.02 0.32 0.22 1.56 0.09 0.00 0.00 178.44 180.65 2jmu h GLN 23 N 0.69 0.43 -0.11 1.13 4.20 -1.07 0.27 115.11 120.65 2jmu h GLN 23 Ca 0.37 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.89 2jmu h GLN 23 Cb 0.35 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2jmu h GLN 23 CO -0.25 0.28 -0.62 0.93 -0.67 0.00 0.00 178.83 178.50 2jmu h GLU 24 N 0.44 0.40 0.00 1.46 5.08 -0.88 -3.03 114.58 118.04 2jmu h GLU 24 Ca 0.20 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 2jmu h GLU 24 Cb 0.11 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2jmu h GLU 24 CO -0.14 0.89 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.33 2jmu h LEU 25 N 0.29 0.00 0.00 1.33 3.38 0.56 -3.47 115.31 117.40 2jmu h LEU 25 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jmu h LEU 25 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2jmu h LEU 25 CO 0.11 0.37 0.00 0.61 0.09 0.00 0.00 178.44 179.61 2jmu n GLY 26 N 0.21 1.54 3.81 0.83 0.00 0.28 -5.06 105.19 106.80 2jmu n GLY 26 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2jmu n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmu s ALA 27 N -2.00 3.29 0.16 4.61 0.00 0.69 -4.80 121.76 123.72 2jmu s ALA 27 Ca 0.00 0.26 0.02 0.00 0.00 0.00 0.00 51.96 52.24 2jmu s ALA 27 Cb 0.00 -2.95 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 2jmu s ALA 27 CO 0.00 0.26 0.31 0.95 0.00 0.00 0.00 175.76 177.28 2jmu s THR 28 N -1.73 5.30 -0.21 0.00 -4.23 0.20 -4.30 115.64 110.67 2jmu s THR 28 Ca 0.50 -0.60 -0.13 0.00 -1.18 0.00 0.00 61.69 60.28 2jmu s THR 28 Cb -0.15 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 69.91 2jmu s THR 28 CO 0.20 -0.10 0.28 -0.22 -0.54 0.00 0.00 174.62 174.23 2jmu s LEU 29 N -3.23 4.15 -0.16 4.79 2.96 -1.26 0.00 118.68 125.93 2jmu s LEU 29 Ca 0.35 0.33 0.09 0.00 -0.22 0.00 0.00 54.13 54.69 2jmu s LEU 29 Cb -0.11 -2.31 -0.16 0.00 0.50 0.00 0.00 46.19 44.11 2jmu s LEU 29 CO 0.29 0.01 -0.02 -1.84 -1.32 0.00 0.00 176.35 173.47 2jmu n GLU 30 N 4.28 1.26 -3.81 1.98 0.28 0.88 -4.94 120.64 120.57 2jmu n GLU 30 Ca -0.12 0.03 -0.12 0.00 -0.16 0.00 0.00 57.16 56.79 2jmu n GLU 30 Cb 0.52 -1.37 -0.09 0.00 1.43 0.00 0.00 31.44 31.93 2jmu n GLU 30 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 2jmu s HIS 31 N -2.36 -0.05 -0.12 -1.84 3.76 -0.98 -4.95 115.29 108.75 2jmu s HIS 31 Ca -0.13 -0.02 -0.05 0.00 -0.15 0.00 0.00 55.06 54.71 2jmu s HIS 31 Cb 0.05 0.02 0.06 0.00 1.11 0.00 0.00 32.58 33.82 2jmu s HIS 31 CO 0.54 -0.38 0.26 1.03 -0.85 0.00 0.00 174.74 175.33 2jmu s ARG 32 N -1.79 0.15 0.02 1.40 1.81 -1.26 -0.68 118.95 118.60 2jmu s ARG 32 Ca -0.11 0.71 0.01 0.00 -1.72 0.00 0.00 55.73 54.62 2jmu s ARG 32 Cb -0.04 -0.06 -0.01 0.00 -0.45 0.00 0.00 34.95 34.38 2jmu s ARG 32 CO 0.01 -0.27 -0.05 0.14 -0.68 0.00 0.00 175.30 174.45 2jmu s VAL 33 N 2.25 0.31 -0.01 3.52 -7.23 0.84 -5.00 120.40 115.08 2jmu s VAL 33 Ca -0.00 -0.66 -0.00 0.00 -1.81 0.00 0.00 61.98 59.51 2jmu s VAL 33 Cb -0.12 -0.36 0.02 0.00 0.56 0.00 0.00 36.38 36.48 2jmu s VAL 33 CO -0.08 -0.23 0.03 0.42 -0.31 0.00 0.00 175.10 174.92 2jmu s THR 34 N -0.88 -0.03 0.30 5.32 -4.23 -1.25 -0.06 115.64 114.80 2jmu s THR 34 Ca -0.07 0.11 -0.05 0.00 -1.18 0.00 0.00 61.69 60.50 2jmu s THR 34 Cb -0.06 -0.06 -0.01 0.00 1.34 0.00 0.00 72.50 73.71 2jmu s THR 34 CO -0.00 0.04 0.43 -0.36 -0.54 0.00 0.00 174.62 174.19 2jmu s PHE 35 N 0.55 0.88 -0.12 3.99 0.40 -0.91 -4.96 117.98 117.80 2jmu s PHE 35 Ca -0.05 -1.15 0.02 0.00 -0.60 0.00 0.00 56.93 55.16 2jmu s PHE 35 Cb -0.06 -0.07 -0.01 0.00 0.51 0.00 0.00 43.02 43.39 2jmu s PHE 35 CO -0.02 -1.03 -0.18 0.50 0.70 0.00 0.00 175.22 175.20 2jmu s ARG 36 N -3.48 3.22 -0.28 0.44 3.52 -1.26 -0.62 118.95 120.48 2jmu s ARG 36 Ca 0.29 -0.77 -0.07 0.00 -0.13 0.00 0.00 55.73 55.05 2jmu s ARG 36 Cb 0.01 -2.50 -0.01 0.00 -1.56 0.00 0.00 34.95 30.89 2jmu s ARG 36 CO 0.16 0.16 0.09 -0.51 -0.81 0.00 0.00 175.30 174.38 2jmu s ASP 37 N 0.45 5.17 -0.29 -2.12 1.01 0.18 0.28 116.67 121.35 2jmu s ASP 37 Ca -0.13 -0.52 -0.04 0.00 0.71 0.00 0.00 52.55 52.58 2jmu s ASP 37 Cb -0.17 -1.91 0.03 0.00 1.01 0.00 0.00 42.92 41.89 2jmu s ASP 37 CO 0.06 -0.14 0.01 0.42 0.21 0.00 0.00 175.17 175.73 2jmu s THR 38 N 1.55 3.29 -0.15 -1.27 -4.23 -0.35 -0.08 115.64 114.41 2jmu s THR 38 Ca 0.04 -1.08 -0.10 0.00 -1.18 0.00 0.00 61.69 59.37 2jmu s THR 38 Cb -0.16 -2.77 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 2jmu s THR 38 CO 0.03 0.02 0.19 -0.31 -0.54 0.00 0.00 174.62 174.01 2jmu s TYR 39 N 1.35 3.51 0.15 3.99 2.02 0.16 -0.34 117.35 128.18 2jmu s TYR 39 Ca -0.01 0.50 0.10 0.00 -0.37 0.00 0.00 57.07 57.28 2jmu s TYR 39 Cb -0.18 -2.13 -0.04 0.00 -0.40 0.00 0.00 41.96 39.20 2jmu s TYR 39 CO -0.01 0.46 -0.18 0.71 -1.57 0.00 0.00 175.55 174.96 2jmu s TYR 40 N -0.19 2.50 0.18 2.71 1.51 -0.76 -0.54 117.35 122.76 2jmu s TYR 40 Ca 0.13 -0.28 -0.24 0.00 -1.01 0.00 0.00 57.07 55.68 2jmu s TYR 40 Cb -0.12 -1.29 0.05 0.00 -0.11 0.00 0.00 41.96 40.49 2jmu s TYR 40 CO 0.02 0.43 0.83 0.34 -1.11 0.00 0.00 175.55 176.06 2jmu s ASP 41 N -2.38 -0.27 1.11 2.29 -1.08 -0.89 -4.26 116.67 111.19 2jmu s ASP 41 Ca 0.20 -0.39 -0.17 0.00 -0.52 0.00 0.00 52.55 51.67 2jmu s ASP 41 Cb -0.10 0.57 0.24 0.00 -1.46 0.00 0.00 42.92 42.18 2jmu s ASP 41 CO 0.11 -1.03 1.14 0.42 0.52 0.00 0.00 175.17 176.32 2jmu s THR 42 N -3.54 1.76 -0.32 1.71 -4.23 -1.26 -1.04 115.64 108.72 2jmu s THR 42 Ca 0.10 0.00 0.24 0.00 -1.18 0.00 0.00 61.69 60.85 2jmu s THR 42 Cb -0.03 -2.58 0.25 0.00 1.34 0.00 0.00 72.50 71.48 2jmu s THR 42 CO 0.01 0.00 1.73 0.77 -0.54 0.00 0.00 174.62 176.59 2jmu h SER 43 N -2.24 0.00 -0.02 3.99 4.64 -1.94 -2.59 113.55 115.40 2jmu h SER 43 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2jmu h SER 43 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2jmu h SER 43 CO 0.42 0.00 -0.09 -0.62 -0.87 0.00 0.00 176.83 175.67 2jmu n GLU 44 N -2.32 1.31 -3.51 4.77 -0.58 -1.26 -4.97 120.64 114.07 2jmu n GLU 44 Ca 0.01 -1.21 -0.20 0.00 -0.42 0.00 0.00 57.16 55.34 2jmu n GLU 44 Cb 0.17 -1.27 0.08 0.00 -0.57 0.00 0.00 31.44 29.85 2jmu n GLU 44 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2jmu n LEU 45 N 0.55 -3.74 0.05 -4.62 4.32 -0.98 -4.93 117.00 107.66 2jmu n LEU 45 Ca 0.08 -0.62 -0.10 0.00 -0.02 0.00 0.00 56.01 55.35 2jmu n LEU 45 Cb 0.35 -3.05 0.02 0.00 -1.62 0.00 0.00 43.42 39.13 2jmu n LEU 45 CO 0.12 0.46 0.34 0.28 -1.22 0.00 0.00 177.39 177.37 2jmu h SER 46 N -2.11 0.48 0.23 -1.43 0.02 -1.93 -3.30 113.55 105.51 2jmu h SER 46 Ca -0.59 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.03 2jmu h SER 46 Cb 1.35 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2jmu h SER 46 CO 0.53 1.06 -0.11 0.25 -1.14 0.00 0.00 176.83 177.42 2jmu h LEU 47 N 0.27 -0.26 -0.90 5.07 5.85 -1.91 -2.75 115.31 120.68 2jmu h LEU 47 Ca -0.03 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.50 2jmu h LEU 47 Cb 1.32 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.35 2jmu h LEU 47 CO 0.13 0.24 0.56 -0.03 -0.34 0.00 0.00 178.44 179.00 2jmu h MET 48 N -0.91 0.97 -0.00 1.25 4.05 -1.72 -0.23 114.93 118.34 2jmu h MET 48 Ca -0.03 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2jmu h MET 48 Cb 0.50 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 2jmu h MET 48 CO 0.05 0.64 -0.10 1.28 0.23 0.00 0.00 176.91 179.01 2jmu n LEU 49 N -4.61 0.18 -1.62 3.39 4.32 -1.24 -3.04 117.00 114.39 2jmu n LEU 49 Ca 0.14 0.27 0.09 0.00 -0.02 0.00 0.00 56.01 56.49 2jmu n LEU 49 Cb 0.21 -0.35 0.36 0.00 -1.62 0.00 0.00 43.42 42.02 2jmu n LEU 49 CO 0.30 0.04 0.83 -1.20 -1.22 0.00 0.00 177.39 176.14 2jmu n SER 50 N -1.34 4.92 -0.10 -1.43 7.64 -0.15 -4.91 113.62 118.25 2jmu n SER 50 Ca 0.10 -2.55 -0.01 0.00 1.01 0.00 0.00 58.87 57.41 2jmu n SER 50 Cb 0.30 -0.59 -0.01 0.00 -1.01 0.00 0.00 64.21 62.90 2jmu n SER 50 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jmu n ASP 51 N 0.98 -4.08 -4.21 6.43 9.92 -1.17 -4.94 116.55 119.48 2jmu n ASP 51 Ca 0.26 0.03 -0.40 0.00 -0.53 0.00 0.00 54.79 54.15 2jmu n ASP 51 Cb 0.95 -1.69 -0.09 0.00 -0.64 0.00 0.00 41.12 39.65 2jmu n ASP 51 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2jmu s HIS 52 N -1.74 3.42 -0.17 1.24 3.76 -0.85 -3.99 115.29 116.97 2jmu s HIS 52 Ca 0.00 -1.86 -0.11 0.00 -0.15 0.00 0.00 55.06 52.95 2jmu s HIS 52 Cb 0.00 -3.38 -0.05 0.00 1.11 0.00 0.00 32.58 30.26 2jmu s HIS 52 CO 0.00 -0.97 0.18 -1.58 -0.85 0.00 0.00 174.74 171.53 2jmu s TRP 53 N 1.35 3.47 -0.17 1.40 0.52 -0.92 -3.33 118.94 121.26 2jmu s TRP 53 Ca 0.05 0.46 0.00 0.00 0.02 0.00 0.00 56.10 56.63 2jmu s TRP 53 Cb -0.25 -2.17 0.03 0.00 -1.15 0.00 0.00 33.47 29.93 2jmu s TRP 53 CO -0.01 0.37 -0.10 -1.17 0.02 0.00 0.00 176.95 176.06 2jmu s LEU 54 N 0.09 1.82 -0.01 2.99 0.20 -1.26 0.66 118.68 123.17 2jmu s LEU 54 Ca 0.12 -0.66 0.03 0.00 0.69 0.00 0.00 54.13 54.31 2jmu s LEU 54 Cb -0.12 -1.09 -0.00 0.00 -0.43 0.00 0.00 46.19 44.55 2jmu s LEU 54 CO 0.01 -0.13 -0.09 0.00 -0.29 0.00 0.00 176.35 175.85 2jmu s ARG 55 N 1.52 0.84 -0.27 1.98 1.70 0.15 -1.84 118.95 123.04 2jmu s ARG 55 Ca 0.02 -0.33 -0.08 0.00 -0.47 0.00 0.00 55.73 54.87 2jmu s ARG 55 Cb -0.15 -0.80 -0.02 0.00 -0.57 0.00 0.00 34.95 33.41 2jmu s ARG 55 CO -0.09 0.17 0.09 -1.14 -1.08 0.00 0.00 175.30 173.25 2jmu s GLN 56 N -0.07 3.47 -0.48 3.89 2.00 0.54 0.18 119.66 129.19 2jmu s GLN 56 Ca 0.01 -0.61 -0.17 0.00 -2.00 0.00 0.00 55.36 52.60 2jmu s GLN 56 Cb -0.06 -3.39 0.06 0.00 0.80 0.00 0.00 33.01 30.43 2jmu s GLN 56 CO -0.00 -0.29 0.48 -0.98 -0.50 0.00 0.00 175.29 174.00 2jmu s ARG 57 N 1.59 3.04 -0.91 1.67 1.70 -1.05 -1.21 118.95 123.78 2jmu s ARG 57 Ca 0.05 -1.12 0.00 0.00 -0.47 0.00 0.00 55.73 54.19 2jmu s ARG 57 Cb -0.16 -4.10 0.00 0.00 -0.57 0.00 0.00 34.95 30.12 2jmu s ARG 57 CO 0.04 -1.07 0.00 -0.85 -1.08 0.00 0.00 175.30 172.34 2jmu n GLU 58 N 5.58 -1.65 -1.00 3.89 0.28 0.14 0.30 120.64 128.19 2jmu n GLU 58 Ca -0.10 0.68 -0.00 0.00 -0.16 0.00 0.00 57.16 57.58 2jmu n GLU 58 Cb 0.45 -4.84 -0.00 0.00 1.43 0.00 0.00 31.44 28.47 2jmu n GLU 58 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jmu n GLY 59 N 0.19 0.41 0.94 -1.84 0.00 -1.26 -4.91 105.19 98.72 2jmu n GLY 59 Ca -0.09 -0.86 0.11 0.00 0.00 0.00 0.00 46.02 45.19 2jmu n GLY 59 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jmu n SER 60 N 1.56 2.99 0.00 1.61 7.64 0.15 -4.97 113.62 122.59 2jmu n SER 60 Ca -0.00 -1.94 0.00 0.00 1.01 0.00 0.00 58.87 57.94 2jmu n SER 60 Cb 0.00 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 2jmu n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jmu n GLY 61 N 1.29 3.33 3.66 0.23 0.00 -1.24 -4.94 105.19 107.53 2jmu n GLY 61 Ca 0.14 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2jmu n GLY 61 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jmu s TRP 62 N 0.00 3.28 -0.15 1.61 0.52 -1.26 -2.54 118.94 120.39 2jmu s TRP 62 Ca 0.00 1.40 -0.03 0.00 0.02 0.00 0.00 56.10 57.50 2jmu s TRP 62 Cb 0.00 -3.30 -0.02 0.00 -1.15 0.00 0.00 33.47 28.99 2jmu s TRP 62 CO 0.00 -0.67 -0.07 -2.00 0.02 0.00 0.00 176.95 174.23 2jmu s GLU 63 N 3.08 3.57 -0.09 4.98 2.12 0.13 -4.11 118.70 128.37 2jmu s GLU 63 Ca 0.47 -0.58 0.04 0.00 0.36 0.00 0.00 54.97 55.26 2jmu s GLU 63 Cb -0.17 -2.83 0.00 0.00 0.26 0.00 0.00 34.13 31.40 2jmu s GLU 63 CO 0.09 0.22 -0.21 -1.17 -0.54 0.00 0.00 175.26 173.65 2jmu s LEU 64 N 0.40 1.99 -0.20 2.70 2.96 0.75 -0.67 118.68 126.61 2jmu s LEU 64 Ca -0.06 -0.50 -0.11 0.00 -0.22 0.00 0.00 54.13 53.24 2jmu s LEU 64 Cb -0.15 -1.28 -0.05 0.00 0.50 0.00 0.00 46.19 45.22 2jmu s LEU 64 CO 0.04 0.13 0.19 -0.75 -1.32 0.00 0.00 176.35 174.64 2jmu s LYS 65 N 0.40 4.18 0.02 1.98 2.47 0.21 -0.91 119.74 128.10 2jmu s LYS 65 Ca -0.18 -0.14 0.05 0.00 -1.56 0.00 0.00 55.97 54.14 2jmu s LYS 65 Cb -0.17 -3.45 -0.02 0.00 -1.46 0.00 0.00 37.83 32.73 2jmu s LYS 65 CO 0.08 0.22 -0.14 0.00 0.16 0.00 0.00 175.35 175.67 2jmu n PRO 67 N 2.17 0.60 0.00 0.00 -0.04 -1.26 0.23 135.00 136.71 2jmu n PRO 67 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2jmu n PRO 67 Cb 0.55 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 2jmu n PRO 67 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jmu n GLY 68 N 1.10 1.90 3.66 0.55 0.00 -0.67 -3.85 105.19 107.88 2jmu n GLY 68 Ca 0.00 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2jmu n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jmu s VAL 69 N 0.00 5.30 -0.18 1.61 -7.23 -1.26 -4.88 120.40 113.76 2jmu s VAL 69 Ca 0.00 0.37 -0.23 0.00 -1.81 0.00 0.00 61.98 60.31 2jmu s VAL 69 Cb 0.00 -3.58 -0.22 0.00 0.56 0.00 0.00 36.38 33.14 2jmu s VAL 69 CO 0.00 0.31 0.39 0.00 -0.31 0.00 0.00 175.10 175.49 2jmu h THR 70 N 5.04 1.16 -0.00 5.32 1.03 -1.94 -3.15 112.91 120.37 2jmu h THR 70 Ca -0.37 -2.24 0.00 0.00 -0.01 0.00 0.00 66.41 63.79 2jmu h THR 70 Cb 1.17 2.58 0.00 0.00 -1.07 0.00 0.00 68.15 70.82 2jmu h THR 70 CO 0.68 0.42 -0.14 0.61 -0.01 0.00 0.00 175.52 177.08 2jmu n GLY 71 N 1.51 -1.23 0.09 2.99 0.00 -1.26 -2.88 105.19 104.40 2jmu n GLY 71 Ca -0.26 -0.21 -0.06 0.00 0.00 0.00 0.00 46.02 45.49 2jmu n GLY 71 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jmu n VAL 72 N -1.29 1.41 -2.86 1.61 0.31 -1.26 -5.06 118.33 111.20 2jmu n VAL 72 Ca 0.10 -0.78 -0.01 0.00 -0.01 0.00 0.00 64.34 63.65 2jmu n VAL 72 Cb 0.31 -0.81 -0.01 0.00 -0.91 0.00 0.00 33.84 32.42 2jmu n VAL 72 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2jmu n SER 73 N -2.92 -6.52 0.00 4.52 3.41 -1.14 -5.07 113.62 105.90 2jmu n SER 73 Ca -0.18 1.11 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 2jmu n SER 73 Cb 1.01 -4.03 0.00 0.00 -0.26 0.00 0.00 64.21 60.93 2jmu n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jmu n GLY 74 N 1.15 2.73 1.56 5.00 0.00 -1.26 -5.01 105.19 109.36 2jmu n GLY 74 Ca -0.06 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2jmu n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jmu n PRO 75 N -0.26 0.35 0.21 1.61 -0.02 -1.26 -4.22 135.00 131.41 2jmu n PRO 75 Ca 0.00 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.63 2jmu n PRO 75 Cb 0.00 -1.33 0.61 0.00 -0.02 0.00 0.00 33.50 32.76 2jmu n PRO 75 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2jmu h HIS 76 N 2.42 0.00 0.00 6.00 3.86 -1.96 -2.19 115.15 123.28 2jmu h HIS 76 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2jmu h HIS 76 Cb 0.35 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.82 2jmu h HIS 76 CO 0.27 0.00 -0.03 -1.71 0.86 0.00 0.00 177.93 177.32 2jmu n ASN 77 N -2.66 1.70 -0.99 2.45 5.15 -1.25 -5.07 115.26 114.60 2jmu n ASN 77 Ca 0.01 -2.15 0.12 0.00 -0.60 0.00 0.00 54.58 51.97 2jmu n ASN 77 Cb 0.26 -0.12 -0.05 0.00 -0.53 0.00 0.00 39.78 39.33 2jmu n ASN 77 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2jmu n GLU 78 N -0.65 -2.19 -2.64 1.20 0.00 -0.82 -4.67 120.64 110.88 2jmu n GLU 78 Ca 0.04 1.70 -0.43 0.00 0.00 0.00 0.00 57.16 58.47 2jmu n GLU 78 Cb 0.41 -2.59 -0.02 0.00 0.00 0.00 0.00 31.44 29.24 2jmu n GLU 78 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 2jmu s TYR 79 N -3.23 3.36 -0.26 4.31 1.51 -1.26 -1.68 117.35 120.10 2jmu s TYR 79 Ca 0.00 1.46 -0.15 0.00 -1.01 0.00 0.00 57.07 57.38 2jmu s TYR 79 Cb 0.00 -3.27 -0.04 0.00 -0.11 0.00 0.00 41.96 38.54 2jmu s TYR 79 CO 0.00 -0.54 0.36 0.08 -1.11 0.00 0.00 175.55 174.34 2jmu s VAL 80 N 2.67 5.19 -0.43 0.71 1.01 0.14 -4.82 120.40 124.86 2jmu s VAL 80 Ca 0.48 0.55 -0.20 0.00 0.00 0.00 0.00 61.98 62.80 2jmu s VAL 80 Cb -0.18 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.54 2jmu s VAL 80 CO 0.13 0.18 0.63 -1.61 0.00 0.00 0.00 175.10 174.43 2jmu s GLU 81 N 1.91 3.28 -0.24 2.72 2.02 -1.26 -1.86 118.70 125.27 2jmu s GLU 81 Ca 0.15 -0.39 -0.11 0.00 0.02 0.00 0.00 54.97 54.64 2jmu s GLU 81 Cb -0.16 -3.95 -0.05 0.00 0.10 0.00 0.00 34.13 30.08 2jmu s GLU 81 CO 0.09 -0.99 0.16 0.14 0.02 0.00 0.00 175.26 174.69 2jmu s VAL 82 N 2.76 5.36 0.00 2.63 -7.23 -0.09 -4.92 120.40 118.91 2jmu s VAL 82 Ca 0.22 0.19 0.00 0.00 -1.81 0.00 0.00 61.98 60.58 2jmu s VAL 82 Cb -0.14 -3.50 0.00 0.00 0.56 0.00 0.00 36.38 33.29 2jmu s VAL 82 CO 0.18 0.35 0.28 0.35 -0.31 0.00 0.00 175.10 175.96 2jmu n THR 83 N 4.22 0.00 -2.49 5.32 -2.24 -1.26 -0.18 114.28 117.65 2jmu n THR 83 Ca -0.15 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.72 2jmu n THR 83 Cb 0.52 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.74 2jmu n THR 83 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2jmu s SER 84 N -0.42 7.06 0.29 3.42 0.01 -1.26 -4.28 113.70 118.51 2jmu s SER 84 Ca 0.00 1.74 0.03 0.00 1.31 0.00 0.00 55.95 59.03 2jmu s SER 84 Cb 0.00 -2.55 0.63 0.00 0.21 0.00 0.00 66.02 64.30 2jmu s SER 84 CO 0.00 -0.60 1.79 -0.33 0.41 0.00 0.00 173.24 174.51 2jmu h GLU 85 N 7.53 0.76 -0.28 12.44 5.08 -1.86 0.82 114.58 139.07 2jmu h GLU 85 Ca -0.32 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 2jmu h GLU 85 Cb 1.15 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 2jmu h GLU 85 CO 0.90 0.50 0.16 0.00 -1.00 0.00 0.00 179.01 179.57 2jmu h ALA 86 N 1.59 1.76 0.13 3.43 0.00 -1.92 0.21 119.26 124.47 2jmu h ALA 86 Ca 0.52 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 55.10 2jmu h ALA 86 Cb 0.72 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 18.42 2jmu h ALA 86 CO -0.35 0.21 -1.25 0.00 0.00 0.00 0.00 179.25 177.86 2jmu h ALA 87 N 1.80 0.01 0.27 0.00 0.00 -1.27 -2.59 119.26 117.48 2jmu h ALA 87 Ca 0.10 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 2jmu h ALA 87 Cb -0.01 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2jmu h ALA 87 CO -0.02 0.72 -0.13 0.82 0.00 0.00 0.00 179.25 180.65 2jmu h ILE 88 N 0.25 0.75 -0.65 0.00 1.08 -0.13 -0.72 117.51 118.08 2jmu h ILE 88 Ca -0.18 -0.07 0.07 0.00 -0.39 0.00 0.00 64.86 64.29 2jmu h ILE 88 Cb 1.93 0.79 -0.06 0.00 -3.07 0.00 0.00 36.82 36.41 2jmu h ILE 88 CO 0.24 0.02 0.32 0.58 -0.69 0.00 0.00 178.15 178.62 2jmu h VAL 89 N -0.40 0.89 0.29 1.67 2.07 -0.71 0.44 116.25 120.51 2jmu h VAL 89 Ca -0.04 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 2jmu h VAL 89 Cb 0.30 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2jmu h VAL 89 CO 0.06 0.11 -0.17 0.00 0.02 0.00 0.00 177.57 177.59 2jmu h ALA 90 N 1.38 -0.42 0.18 1.67 0.00 -1.23 -0.69 119.26 120.14 2jmu h ALA 90 Ca 0.31 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2jmu h ALA 90 Cb 0.27 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2jmu h ALA 90 CO -0.23 -0.74 -0.12 1.96 0.00 0.00 0.00 179.25 180.11 2jmu h GLN 91 N -0.43 -0.30 -0.76 0.00 1.08 -0.47 -2.19 115.11 112.04 2jmu h GLN 91 Ca -0.03 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.24 2jmu h GLN 91 Cb 0.35 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.80 2jmu h GLN 91 CO 0.04 -0.20 0.46 -0.07 -0.95 0.00 0.00 178.83 178.11 2jmu h LEU 92 N -0.31 0.73 -0.49 1.46 -0.00 -0.07 0.52 115.31 117.15 2jmu h LEU 92 Ca -0.01 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.86 2jmu h LEU 92 Cb 0.26 -0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 40.76 2jmu h LEU 92 CO 0.01 0.48 0.23 -0.26 -0.00 0.00 0.00 178.44 178.90 2jmu h PHE 93 N 0.87 0.72 0.01 1.13 -1.00 -1.00 -0.27 116.94 117.40 2jmu h PHE 93 Ca 0.32 -0.04 -0.20 0.00 2.81 0.00 0.00 57.97 60.87 2jmu h PHE 93 Cb 0.11 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 2jmu h PHE 93 CO -0.05 0.57 -0.90 1.05 -1.61 0.00 0.00 178.31 177.37 2jmu h GLU 94 N 0.65 0.13 -0.46 1.51 4.11 -0.72 0.65 114.58 120.44 2jmu h GLU 94 Ca 0.17 -0.15 -0.09 0.00 0.07 0.00 0.00 59.36 59.36 2jmu h GLU 94 Cb 0.13 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2jmu h GLU 94 CO -0.02 0.94 -0.08 -0.07 0.07 0.00 0.00 179.01 179.85 2jmu h LEU 95 N 0.06 0.86 0.00 3.06 3.38 0.14 -3.16 115.31 119.66 2jmu h LEU 95 Ca -0.04 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2jmu h LEU 95 Cb 1.55 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2jmu h LEU 95 CO 0.13 1.01 -0.76 0.18 0.09 0.00 0.00 178.44 179.08 2jmu n LEU 96 N -4.29 0.66 -2.26 1.67 7.99 -0.12 -4.98 117.00 115.68 2jmu n LEU 96 Ca -0.00 0.13 -0.07 0.00 -0.01 0.00 0.00 56.01 56.07 2jmu n LEU 96 Cb 0.36 -0.16 0.03 0.00 -0.11 0.00 0.00 43.42 43.55 2jmu n LEU 96 CO 0.43 -0.01 0.01 0.61 -1.51 0.00 0.00 177.39 176.93 2jmu n GLY 97 N 1.36 0.01 0.00 -0.72 0.00 0.02 -5.02 105.19 100.84 2jmu n GLY 97 Ca 0.03 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2jmu n GLY 97 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jmu n SER 98 N -2.24 0.00 0.00 1.61 2.88 -0.06 -4.93 113.62 110.88 2jmu n SER 98 Ca -0.03 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 2jmu n SER 98 Cb 0.55 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.74 2jmu n SER 98 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jmu n GLY 99 N 2.17 0.64 1.26 0.46 0.00 -1.26 -5.00 105.19 103.45 2jmu n GLY 99 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2jmu n GLY 99 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jmu n GLU 100 N -2.03 -0.53 -1.63 1.61 1.02 -1.26 -4.93 120.64 112.89 2jmu n GLU 100 Ca 0.00 -0.67 -0.43 0.00 -0.02 0.00 0.00 57.16 56.04 2jmu n GLU 100 Cb 0.04 -0.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.97 2jmu n GLU 100 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jmu n GLN 101 N -1.98 2.41 -2.84 3.49 0.00 -1.26 -4.92 117.38 112.28 2jmu n GLN 101 Ca 0.05 0.81 -0.42 0.00 0.00 0.00 0.00 57.00 57.44 2jmu n GLN 101 Cb 0.19 -3.06 -0.04 0.00 0.00 0.00 0.00 30.24 27.33 2jmu n GLN 101 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 2jmu s LYS 102 N 5.25 4.30 -0.00 2.61 2.20 -1.26 -4.92 119.74 127.92 2jmu s LYS 102 Ca 0.95 1.09 0.03 0.00 -0.36 0.00 0.00 55.97 57.68 2jmu s LYS 102 Cb -0.43 -3.58 -0.25 0.00 -1.51 0.00 0.00 37.83 32.06 2jmu s LYS 102 CO 0.40 -0.38 0.83 -1.35 -0.36 0.00 0.00 175.35 174.50 2jmu h PRO 103 N 7.35 0.13 0.00 4.03 0.11 -1.95 -3.48 132.00 138.20 2jmu h PRO 103 Ca -0.28 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2jmu h PRO 103 Cb 1.12 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2jmu h PRO 103 CO 0.86 0.91 0.00 0.00 -0.21 0.00 0.00 178.00 179.56 2jmu n ALA 104 N -2.60 0.00 -2.66 -0.75 0.00 -1.26 -4.98 120.51 108.25 2jmu n ALA 104 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.97 2jmu n ALA 104 Cb 1.03 -0.08 -0.15 0.00 0.00 0.00 0.00 19.45 20.25 2jmu n ALA 104 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jmu s GLY 105 N -2.00 1.40 0.28 0.00 0.00 -1.26 -3.83 107.32 101.90 2jmu s GLY 105 Ca 0.00 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 43.73 2jmu s GLY 105 CO 0.00 -0.65 1.71 -2.08 0.00 0.00 0.00 173.10 172.08 2jmu h VAL 106 N 4.84 1.27 -0.37 1.40 2.07 -1.94 -2.93 116.25 120.60 2jmu h VAL 106 Ca -0.36 -1.32 0.05 0.00 0.82 0.00 0.00 66.70 65.89 2jmu h VAL 106 Cb 1.17 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2jmu h VAL 106 CO 0.49 0.42 0.25 0.00 0.02 0.00 0.00 177.57 178.75 2jmu h ALA 107 N 1.29 2.01 0.17 1.67 0.00 -1.99 0.41 119.26 122.82 2jmu h ALA 107 Ca 0.06 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.65 2jmu h ALA 107 Cb 0.71 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2jmu h ALA 107 CO 0.05 -0.08 -1.40 0.00 0.00 0.00 0.00 179.25 177.83 2jmu h ALA 108 N 1.80 0.05 -0.01 0.00 0.00 -1.94 -3.22 119.26 115.94 2jmu h ALA 108 Ca 0.16 -0.93 -0.09 0.00 0.00 0.00 0.00 54.91 54.05 2jmu h ALA 108 Cb 0.30 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2jmu h ALA 108 CO -0.03 0.92 -0.40 -0.39 0.00 0.00 0.00 179.25 179.34 2jmu h VAL 109 N 0.10 1.29 -0.03 0.00 -1.51 -1.17 -2.07 116.25 112.86 2jmu h VAL 109 Ca -0.20 -1.40 0.01 0.00 -1.23 0.00 0.00 66.70 63.88 2jmu h VAL 109 Cb 2.05 1.74 -0.01 0.00 -2.13 0.00 0.00 31.29 32.94 2jmu h VAL 109 CO 0.22 0.40 -0.04 0.25 -1.23 0.00 0.00 177.57 177.17 2jmu h LEU 110 N 0.02 -0.12 -0.54 4.19 5.85 -1.02 0.27 115.31 123.96 2jmu h LEU 110 Ca -0.00 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.59 2jmu h LEU 110 Cb 0.72 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2jmu h LEU 110 CO 0.05 -0.06 -0.51 1.23 -0.34 0.00 0.00 178.44 178.82 2jmu h GLY 111 N -0.05 0.65 1.37 3.75 0.00 -1.53 -0.82 103.07 106.43 2jmu h GLY 111 Ca 0.03 -0.72 -0.14 0.00 0.00 0.00 0.00 47.33 46.50 2jmu h GLY 111 CO -0.07 0.65 -0.36 0.23 0.00 0.00 0.00 176.54 176.99 2jmu h SER 112 N 0.46 0.73 0.73 0.19 0.87 -0.89 -2.67 113.55 112.97 2jmu h SER 112 Ca 0.02 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2jmu h SER 112 Cb 1.04 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2jmu h SER 112 CO 0.10 1.02 -0.51 0.18 -0.53 0.00 0.00 176.83 177.09 2jmu n LEU 113 N -4.05 0.56 -3.48 2.23 4.77 0.90 -4.96 117.00 112.97 2jmu n LEU 113 Ca -0.01 0.16 -0.18 0.00 -0.03 0.00 0.00 56.01 55.95 2jmu n LEU 113 Cb 0.51 -0.24 0.07 0.00 -2.33 0.00 0.00 43.42 41.43 2jmu n LEU 113 CO 0.46 0.02 0.06 1.17 -1.33 0.00 0.00 177.39 177.77 2jmu n LYS 114 N -1.81 -5.64 -2.86 3.23 0.00 -0.37 -4.96 118.16 105.76 2jmu n LYS 114 Ca 0.05 0.79 -0.40 0.00 0.00 0.00 0.00 58.31 58.75 2jmu n LYS 114 Cb 0.39 -5.66 -0.06 0.00 0.00 0.00 0.00 35.03 29.69 2jmu n LYS 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2jmu s LEU 115 N -6.33 4.60 0.05 3.14 1.43 -0.89 -4.73 118.68 115.95 2jmu s LEU 115 Ca 0.06 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 54.80 2jmu s LEU 115 Cb -0.01 -3.45 -0.06 0.00 0.03 0.00 0.00 46.19 42.70 2jmu s LEU 115 CO 0.75 0.16 0.44 0.00 0.23 0.00 0.00 176.35 177.93 2jmu s GLN 116 N -1.02 3.91 -1.02 1.70 -2.07 -0.21 -4.87 119.66 116.09 2jmu s GLN 116 Ca 0.39 0.40 -0.23 0.00 -1.82 0.00 0.00 55.36 54.10 2jmu s GLN 116 Cb -0.24 -3.12 0.05 0.00 -1.09 0.00 0.00 33.01 28.60 2jmu s GLN 116 CO 0.29 0.62 1.47 -2.00 -1.32 0.00 0.00 175.29 174.35 2jmu s GLU 117 N -1.43 3.57 0.31 9.60 2.12 -1.26 -2.09 118.70 129.52 2jmu s GLU 117 Ca 0.29 -1.12 0.14 0.00 0.36 0.00 0.00 54.97 54.64 2jmu s GLU 117 Cb -0.16 -5.36 0.44 0.00 0.26 0.00 0.00 34.13 29.32 2jmu s GLU 117 CO 0.16 -2.25 1.63 -0.24 -0.54 0.00 0.00 175.26 174.02 2jmu h VAL 118 N 6.79 1.18 -2.72 3.70 3.04 -1.13 -3.44 116.25 123.66 2jmu h VAL 118 Ca 0.20 -1.95 -0.13 0.00 -1.01 0.00 0.00 66.70 63.81 2jmu h VAL 118 Cb 1.01 2.12 -0.27 0.00 -2.01 0.00 0.00 31.29 32.14 2jmu h VAL 118 CO 1.42 0.52 -0.32 0.00 -1.01 0.00 0.00 177.57 178.19 2jmu s ALA 119 N -3.50 -0.97 -0.10 3.17 0.00 -1.09 -5.01 121.76 114.26 2jmu s ALA 119 Ca -0.00 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.34 2jmu s ALA 119 Cb 0.11 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.42 2jmu s ALA 119 CO 0.73 -0.24 -0.08 -1.54 0.00 0.00 0.00 175.76 174.63 2jmu s SER 120 N 1.17 1.98 0.24 0.00 1.04 -1.26 0.37 113.70 117.25 2jmu s SER 120 Ca -0.08 -0.27 0.11 0.00 0.48 0.00 0.00 55.95 56.19 2jmu s SER 120 Cb -0.08 -0.78 -0.05 0.00 0.10 0.00 0.00 66.02 65.22 2jmu s SER 120 CO -0.10 -0.09 -0.20 -0.36 0.98 0.00 0.00 173.24 173.47 2jmu s PHE 121 N 1.49 2.18 -0.09 5.02 0.40 0.89 -4.88 117.98 122.99 2jmu s PHE 121 Ca 0.00 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 55.98 2jmu s PHE 121 Cb -0.13 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.39 2jmu s PHE 121 CO -0.05 0.58 -0.17 0.42 0.70 0.00 0.00 175.22 176.70 2jmu s ILE 122 N -2.31 2.76 -0.09 0.64 1.09 -1.26 0.52 121.20 122.55 2jmu s ILE 122 Ca 0.25 -0.79 0.01 0.00 -1.10 0.00 0.00 60.65 59.02 2jmu s ILE 122 Cb -0.05 -2.10 -0.02 0.00 -1.06 0.00 0.00 42.46 39.22 2jmu s ILE 122 CO 0.12 0.56 -0.11 0.28 -0.10 0.00 0.00 174.94 175.68 2jmu s THR 123 N -0.05 3.29 -0.32 2.92 -1.32 0.20 -1.88 115.64 118.48 2jmu s THR 123 Ca -0.04 -0.61 -0.02 0.00 -1.21 0.00 0.00 61.69 59.81 2jmu s THR 123 Cb -0.14 -2.34 0.06 0.00 -1.51 0.00 0.00 72.50 68.57 2jmu s THR 123 CO 0.04 0.57 0.03 -0.89 -2.21 0.00 0.00 174.62 172.16 2jmu s THR 124 N -0.35 3.00 -0.12 5.08 2.01 -0.24 -2.15 115.64 122.88 2jmu s THR 124 Ca 0.04 -1.54 0.02 0.00 0.31 0.00 0.00 61.69 60.52 2jmu s THR 124 Cb -0.12 -2.80 -0.01 0.00 0.01 0.00 0.00 72.50 69.57 2jmu s THR 124 CO 0.02 -0.22 -0.18 -0.60 -0.69 0.00 0.00 174.62 172.95 2jmu s ARG 125 N 1.22 3.23 -0.00 4.92 3.00 0.91 -0.99 118.95 131.24 2jmu s ARG 125 Ca -0.02 -0.77 0.00 0.00 -1.00 0.00 0.00 55.73 53.94 2jmu s ARG 125 Cb -0.20 -2.49 0.00 0.00 0.00 0.00 0.00 34.95 32.27 2jmu s ARG 125 CO -0.02 0.21 0.00 -1.54 0.00 0.00 0.00 175.30 173.95 2jmu s SER 126 N 0.33 0.02 -0.17 -2.12 1.04 0.13 -0.11 113.70 112.81 2jmu s SER 126 Ca -0.14 0.00 -0.04 0.00 0.48 0.00 0.00 55.95 56.25 2jmu s SER 126 Cb -0.17 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 65.92 2jmu s SER 126 CO 0.07 -0.01 -0.03 -0.44 0.98 0.00 0.00 173.24 173.81 2jmu s SER 127 N 0.11 4.73 0.16 7.02 0.01 0.14 0.34 113.70 126.21 2jmu s SER 127 Ca -0.01 -0.18 0.10 0.00 1.31 0.00 0.00 55.95 57.17 2jmu s SER 127 Cb -0.01 -1.78 -0.04 0.00 0.21 0.00 0.00 66.02 64.39 2jmu s SER 127 CO -0.00 0.12 -0.20 0.26 0.41 0.00 0.00 173.24 173.82 2jmu s TRP 128 N 0.66 2.42 0.00 2.43 0.52 0.17 -0.08 118.94 125.06 2jmu s TRP 128 Ca -0.02 -0.32 -0.00 0.00 0.02 0.00 0.00 56.10 55.79 2jmu s TRP 128 Cb -0.14 -1.24 -0.00 0.00 -1.15 0.00 0.00 33.47 30.94 2jmu s TRP 128 CO 0.02 0.45 -0.00 -1.59 0.02 0.00 0.00 176.95 175.85 2jmu s LYS 129 N -2.46 0.03 -0.05 4.98 -2.85 0.10 0.12 119.74 119.61 2jmu s LYS 129 Ca 0.20 -0.05 -0.01 0.00 -1.00 0.00 0.00 55.97 55.11 2jmu s LYS 129 Cb -0.09 0.01 0.03 0.00 -2.06 0.00 0.00 37.83 35.72 2jmu s LYS 129 CO 0.10 -0.00 0.01 -1.17 0.10 0.00 0.00 175.35 174.39 2jmu s LEU 130 N -0.13 0.74 -0.37 2.77 0.20 0.57 0.59 118.68 123.04 2jmu s LEU 130 Ca -0.01 -0.02 -0.25 0.00 0.69 0.00 0.00 54.13 54.54 2jmu s LEU 130 Cb -0.01 -0.28 0.01 0.00 -0.43 0.00 0.00 46.19 45.48 2jmu s LEU 130 CO -0.00 -0.16 0.86 0.00 -0.29 0.00 0.00 176.35 176.76 2jmu s ALA 131 N 1.59 3.41 -0.05 5.97 0.00 -1.26 -1.31 121.76 130.11 2jmu s ALA 131 Ca -0.02 -0.56 -0.19 0.00 0.00 0.00 0.00 51.96 51.20 2jmu s ALA 131 Cb -0.13 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 2jmu s ALA 131 CO -0.03 -1.58 0.52 -1.17 0.00 0.00 0.00 175.76 173.50 2jmu s LEU 132 N 3.32 4.37 -0.46 0.00 2.96 -1.02 -4.97 118.68 122.88 2jmu s LEU 132 Ca 0.35 0.99 0.07 0.00 -0.22 0.00 0.00 54.13 55.32 2jmu s LEU 132 Cb -0.12 -2.78 0.18 0.00 0.50 0.00 0.00 46.19 43.98 2jmu s LEU 132 CO 0.18 0.10 0.68 -0.44 -1.32 0.00 0.00 176.35 175.55 2jmu s SER 133 N -0.00 -1.48 -0.08 3.68 0.01 -1.26 -1.96 113.70 112.60 2jmu s SER 133 Ca 0.28 -1.19 -0.03 0.00 1.31 0.00 0.00 55.95 56.32 2jmu s SER 133 Cb -0.17 1.92 0.05 0.00 0.21 0.00 0.00 66.02 68.02 2jmu s SER 133 CO 0.14 -0.12 0.17 -0.83 0.41 0.00 0.00 173.24 173.01 2jmu s GLY 134 N 1.42 0.01 0.00 3.44 0.00 -1.26 -4.85 107.32 106.08 2jmu s GLY 134 Ca 0.22 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.57 2jmu s GLY 134 CO -0.06 1.52 0.00 0.00 0.00 0.00 0.00 173.10 174.56 2jmu n ALA 135 N 5.03 0.00 -0.70 3.20 0.00 -1.26 -4.70 120.51 122.09 2jmu n ALA 135 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2jmu n ALA 135 Cb 0.50 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2jmu n ALA 135 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2jmu n HIS 136 N -2.32 0.00 0.00 0.00 8.25 -1.26 -5.04 115.22 114.85 2jmu n HIS 136 Ca 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2jmu n HIS 136 Cb 0.23 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.34 2jmu n HIS 136 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jmu n GLY 137 N -0.04 1.94 2.82 -1.41 0.00 -1.26 -4.74 105.19 102.50 2jmu n GLY 137 Ca 0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 2jmu n GLY 137 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jmu s GLN 138 N 0.00 0.01 0.40 1.61 -0.44 -1.26 -4.72 119.66 115.26 2jmu s GLN 138 Ca 0.00 0.28 0.03 0.00 -2.50 0.00 0.00 55.36 53.18 2jmu s GLN 138 Cb 0.00 -0.24 -0.03 0.00 -1.64 0.00 0.00 33.01 31.10 2jmu s GLN 138 CO 0.00 -0.18 0.09 -1.21 0.50 0.00 0.00 175.29 174.49 2jmu s GLU 139 N 1.22 1.90 0.37 1.67 2.02 -0.83 -4.98 118.70 120.08 2jmu s GLU 139 Ca -0.08 -2.15 -0.27 0.00 0.02 0.00 0.00 54.97 52.49 2jmu s GLU 139 Cb -0.12 -0.82 -0.09 0.00 0.10 0.00 0.00 34.13 33.19 2jmu s GLU 139 CO -0.04 -0.39 1.29 -2.14 0.02 0.00 0.00 175.26 174.00 2jmu s PRO 140 N -3.78 4.16 -0.26 0.39 0.02 -1.26 -4.47 135.00 129.80 2jmu s PRO 140 Ca 0.24 2.15 -0.23 0.00 0.02 0.00 0.00 61.00 63.18 2jmu s PRO 140 Cb 0.04 -2.89 -0.01 0.00 0.02 0.00 0.00 34.50 31.66 2jmu s PRO 140 CO 0.13 -0.33 0.78 -1.14 -0.33 0.00 0.00 177.00 176.11 2jmu s GLN 141 N -2.04 4.10 0.16 5.54 0.74 -1.26 -2.45 119.66 124.46 2jmu s GLN 141 Ca 0.53 0.76 0.11 0.00 0.05 0.00 0.00 55.36 56.81 2jmu s GLN 141 Cb -0.38 -3.67 -0.04 0.00 1.10 0.00 0.00 33.01 30.02 2jmu s GLN 141 CO 0.50 -0.55 -0.23 -0.48 -0.55 0.00 0.00 175.29 173.98 2jmu s LEU 142 N 2.82 2.47 -0.12 3.68 0.05 -0.43 -4.82 118.68 122.33 2jmu s LEU 142 Ca 0.32 -0.76 -0.02 0.00 0.05 0.00 0.00 54.13 53.72 2jmu s LEU 142 Cb -0.15 -1.28 -0.03 0.00 -2.05 0.00 0.00 46.19 42.69 2jmu s LEU 142 CO 0.09 0.15 -0.04 -0.89 -0.55 0.00 0.00 176.35 175.11 2jmu s THR 143 N -1.40 3.93 -0.25 5.48 2.01 -0.67 -0.32 115.64 124.43 2jmu s THR 143 Ca 0.18 -0.36 -0.05 0.00 0.31 0.00 0.00 61.69 61.78 2jmu s THR 143 Cb -0.09 -2.69 0.00 0.00 0.01 0.00 0.00 72.50 69.74 2jmu s THR 143 CO 0.09 0.54 0.00 -0.63 -0.69 0.00 0.00 174.62 173.93 2jmu s ILE 144 N -0.12 3.52 -0.17 1.82 1.01 0.33 -0.10 121.20 127.49 2jmu s ILE 144 Ca 0.03 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 59.94 2jmu s ILE 144 Cb -0.13 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 2jmu s ILE 144 CO 0.02 0.25 0.09 -0.62 0.00 0.00 0.00 174.94 174.69 2jmu s ASP 145 N 1.46 5.91 -0.12 3.58 2.15 0.16 0.43 116.67 130.25 2jmu s ASP 145 Ca 0.03 0.19 0.03 0.00 0.43 0.00 0.00 52.55 53.24 2jmu s ASP 145 Cb -0.16 -1.99 0.00 0.00 -0.30 0.00 0.00 42.92 40.47 2jmu s ASP 145 CO -0.01 0.22 -0.22 -0.76 -0.17 0.00 0.00 175.17 174.23 2jmu s LEU 146 N 0.09 2.17 -0.13 -1.34 1.02 0.15 -0.15 118.68 120.49 2jmu s LEU 146 Ca 0.07 -0.55 0.02 0.00 0.02 0.00 0.00 54.13 53.69 2jmu s LEU 146 Cb -0.12 -1.45 0.02 0.00 0.02 0.00 0.00 46.19 44.66 2jmu s LEU 146 CO 0.00 0.13 -0.18 -0.62 0.02 0.00 0.00 176.35 175.71 2jmu s ASP 147 N 0.51 2.76 -0.08 2.29 2.15 -0.82 0.18 116.67 123.66 2jmu s ASP 147 Ca -0.14 -0.52 0.03 0.00 0.43 0.00 0.00 52.55 52.36 2jmu s ASP 147 Cb -0.17 -1.26 0.01 0.00 -0.30 0.00 0.00 42.92 41.20 2jmu s ASP 147 CO 0.05 0.02 -0.18 -0.94 -0.17 0.00 0.00 175.17 173.95 2jmu s SER 148 N 1.05 2.47 -0.01 -0.34 1.04 -0.16 0.03 113.70 117.79 2jmu s SER 148 Ca -0.03 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.96 2jmu s SER 148 Cb -0.15 -1.14 -0.04 0.00 0.10 0.00 0.00 66.02 64.80 2jmu s SER 148 CO -0.04 0.10 0.05 0.00 0.98 0.00 0.00 173.24 174.32 2jmu s ALA 149 N 0.50 3.47 0.41 5.32 0.00 0.22 -1.08 121.76 130.59 2jmu s ALA 149 Ca -0.17 -0.90 0.21 0.00 0.00 0.00 0.00 51.96 51.10 2jmu s ALA 149 Cb -0.17 -1.49 1.17 0.00 0.00 0.00 0.00 23.12 22.63 2jmu s ALA 149 CO 0.06 0.67 1.74 0.22 0.00 0.00 0.00 175.76 178.45 2jmu h ASP 150 N 4.23 0.40 0.00 0.00 3.58 -1.66 -1.90 116.42 121.07 2jmu h ASP 150 Ca -0.49 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.05 2jmu h ASP 150 Cb 1.18 0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.27 2jmu h ASP 150 CO 0.60 0.03 0.00 0.49 -2.88 0.00 0.00 179.24 177.48 2jmu n PHE 151 N -4.64 0.00 -1.07 0.28 3.72 -1.26 -4.71 117.46 109.77 2jmu n PHE 151 Ca 0.28 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.68 2jmu n PHE 151 Cb 0.99 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.51 2jmu n PHE 151 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jmu n GLY 152 N 0.14 0.54 2.81 1.37 0.00 -0.85 -5.08 105.19 104.12 2jmu n GLY 152 Ca 0.00 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 2jmu n GLY 152 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jmu s TYR 153 N -2.19 0.67 -0.07 1.61 5.04 -0.77 -5.00 117.35 116.64 2jmu s TYR 153 Ca 0.00 -0.17 -0.00 0.00 -2.44 0.00 0.00 57.07 54.46 2jmu s TYR 153 Cb 0.00 -0.74 0.03 0.00 0.35 0.00 0.00 41.96 41.60 2jmu s TYR 153 CO 0.00 -0.28 -0.03 0.00 -1.34 0.00 0.00 175.55 173.90 2jmu s ALA 154 N 1.62 0.77 0.05 3.97 0.00 -1.26 0.71 121.76 127.62 2jmu s ALA 154 Ca -0.00 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.85 2jmu s ALA 154 Cb -0.13 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 2jmu s ALA 154 CO -0.04 -0.28 -0.05 0.54 0.00 0.00 0.00 175.76 175.94 2jmu s VAL 155 N 1.52 3.75 -0.03 0.00 0.11 0.10 -3.89 120.40 121.96 2jmu s VAL 155 Ca -0.01 -0.92 0.05 0.00 -2.93 0.00 0.00 61.98 58.16 2jmu s VAL 155 Cb -0.13 -2.71 -0.01 0.00 -1.53 0.00 0.00 36.38 32.00 2jmu s VAL 155 CO -0.03 0.25 -0.18 -0.83 -3.33 0.00 0.00 175.10 170.98 2jmu s GLY 156 N -1.86 0.93 -0.12 6.54 0.00 -0.40 -1.95 107.32 110.46 2jmu s GLY 156 Ca 0.21 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.18 2jmu s GLY 156 CO 0.12 -0.48 -0.10 -0.54 0.00 0.00 0.00 173.10 172.10 2jmu s GLU 157 N -0.15 1.77 -0.26 2.90 2.02 0.79 -0.97 118.70 124.81 2jmu s GLU 157 Ca 0.00 -0.36 -0.08 0.00 0.02 0.00 0.00 54.97 54.56 2jmu s GLU 157 Cb -0.10 -1.73 -0.03 0.00 0.10 0.00 0.00 34.13 32.37 2jmu s GLU 157 CO 0.01 -0.23 0.09 0.08 0.02 0.00 0.00 175.26 175.23 2jmu s VAL 158 N 1.55 4.43 -0.19 2.63 1.01 -0.40 0.39 120.40 129.82 2jmu s VAL 158 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.85 2jmu s VAL 158 Cb -0.13 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.17 2jmu s VAL 158 CO -0.08 0.30 -0.17 -0.70 0.00 0.00 0.00 175.10 174.45 2jmu s GLU 159 N 1.63 3.02 0.09 2.72 2.12 0.86 -2.09 118.70 127.05 2jmu s GLU 159 Ca 0.06 -0.82 0.06 0.00 0.36 0.00 0.00 54.97 54.64 2jmu s GLU 159 Cb -0.15 -2.64 -0.03 0.00 0.26 0.00 0.00 34.13 31.56 2jmu s GLU 159 CO 0.05 -0.22 -0.17 0.00 -0.54 0.00 0.00 175.26 174.38 2jmu s ALA 160 N 1.31 1.45 -0.13 6.30 0.00 -0.29 -1.66 121.76 128.74 2jmu s ALA 160 Ca 0.05 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.90 2jmu s ALA 160 Cb -0.13 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 22.85 2jmu s ALA 160 CO -0.11 0.24 -0.17 -1.64 0.00 0.00 0.00 175.76 174.08 2jmu s MET 161 N -1.88 2.47 -0.07 0.00 -1.94 -1.26 0.01 119.30 116.64 2jmu s MET 161 Ca 0.02 -0.64 0.01 0.00 -1.71 0.00 0.00 55.69 53.37 2jmu s MET 161 Cb -0.10 -2.12 -0.03 0.00 2.01 0.00 0.00 34.83 34.60 2jmu s MET 161 CO 0.03 -0.11 -0.09 0.14 -0.01 0.00 0.00 175.02 174.98 2jmu s VAL 162 N 1.11 3.54 -2.36 -6.03 -7.23 -0.00 -4.81 120.40 104.61 2jmu s VAL 162 Ca -0.03 -0.54 0.29 0.00 -1.81 0.00 0.00 61.98 59.89 2jmu s VAL 162 Cb -0.14 -2.44 0.64 0.00 0.56 0.00 0.00 36.38 35.00 2jmu s VAL 162 CO -0.05 0.59 1.86 1.57 -0.31 0.00 0.00 175.10 178.77 2jmu n HIS 163 N 2.29 0.01 -3.84 2.82 -0.00 -1.25 0.84 115.22 116.09 2jmu n HIS 163 Ca -0.18 -0.00 -0.12 0.00 0.46 0.00 0.00 57.72 57.88 2jmu n HIS 163 Cb 0.53 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.30 2jmu n HIS 163 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 2jmu s GLU 164 N -1.99 0.52 0.46 1.57 -1.05 -1.25 -3.90 118.70 113.06 2jmu s GLU 164 Ca 0.40 -0.29 0.28 0.00 -0.15 0.00 0.00 54.97 55.21 2jmu s GLU 164 Cb 0.21 0.22 0.83 0.00 -0.44 0.00 0.00 34.13 34.96 2jmu s GLU 164 CO 0.34 -0.13 1.78 -0.22 0.95 0.00 0.00 175.26 177.99 2jmu h LYS 165 N 4.27 0.00 -0.53 -4.83 3.64 -1.87 -3.21 116.57 114.04 2jmu h LYS 165 Ca -0.30 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.06 2jmu h LYS 165 Cb 1.19 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.98 2jmu h LYS 165 CO 0.40 0.00 0.27 0.00 -2.27 0.00 0.00 179.45 177.85 2jmu h ALA 166 N 2.05 1.47 -0.10 5.00 0.00 -1.96 -1.77 119.26 123.95 2jmu h ALA 166 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2jmu h ALA 166 Cb 0.75 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2jmu h ALA 166 CO 0.00 0.43 0.00 -0.85 0.00 0.00 0.00 179.25 178.83 2jmu n GLU 167 N -4.39 1.86 0.29 0.00 0.28 -1.21 -4.28 120.64 113.20 2jmu n GLU 167 Ca 0.05 -1.27 -0.17 0.00 -0.16 0.00 0.00 57.16 55.61 2jmu n GLU 167 Cb 0.11 -1.45 -0.08 0.00 1.43 0.00 0.00 31.44 31.45 2jmu n GLU 167 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2jmu h VAL 168 N 2.85 0.31 -0.79 3.84 2.07 -1.43 0.24 116.25 123.34 2jmu h VAL 168 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 2jmu h VAL 168 Cb 0.61 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 2jmu h VAL 168 CO 0.00 0.00 0.51 1.55 0.02 0.00 0.00 177.57 179.65 2jmu h PRO 169 N -0.81 0.73 0.53 1.57 0.13 -1.75 0.27 132.00 132.67 2jmu h PRO 169 Ca -0.06 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.00 2jmu h PRO 169 Cb 0.67 -0.16 0.01 0.00 0.13 0.00 0.00 31.00 31.64 2jmu h PRO 169 CO 0.04 0.48 -0.26 0.00 -0.23 0.00 0.00 178.00 178.04 2jmu h ALA 170 N 1.60 -0.72 0.20 -0.56 0.00 -1.71 -0.19 119.26 117.87 2jmu h ALA 170 Ca 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2jmu h ALA 170 Cb 0.39 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2jmu h ALA 170 CO -0.13 -0.84 -0.10 0.00 0.00 0.00 0.00 179.25 178.18 2jmu h ALA 171 N -0.44 -0.27 -0.37 0.00 0.00 -0.60 -2.72 119.26 114.86 2jmu h ALA 171 Ca -0.07 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.73 2jmu h ALA 171 Cb 0.60 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2jmu h ALA 171 CO 0.12 -0.58 0.24 1.25 0.00 0.00 0.00 179.25 180.28 2jmu h LEU 172 N -0.41 0.41 -0.99 0.00 6.46 -0.50 -0.97 115.31 119.31 2jmu h LEU 172 Ca -0.03 -0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.64 2jmu h LEU 172 Cb 0.32 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.14 2jmu h LEU 172 CO 0.04 0.29 -0.21 -0.33 -0.62 0.00 0.00 178.44 177.61 2jmu h GLU 173 N 0.49 0.48 -0.70 1.25 5.08 -1.06 0.03 114.58 120.14 2jmu h GLU 173 Ca 0.14 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 2jmu h GLU 173 Cb -0.04 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2jmu h GLU 173 CO -0.04 0.67 0.17 0.87 -1.00 0.00 0.00 179.01 179.68 2jmu h LYS 174 N 0.43 1.13 -0.18 2.33 1.57 -1.11 -0.88 116.57 119.85 2jmu h LYS 174 Ca 0.07 -0.27 0.03 0.00 -1.87 0.00 0.00 60.65 58.61 2jmu h LYS 174 Cb 0.61 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 2jmu h LYS 174 CO 0.04 0.99 0.01 0.82 -0.57 0.00 0.00 179.45 180.75 2jmu h ILE 175 N 1.07 0.89 -0.31 1.86 2.04 -0.35 -1.46 117.51 121.25 2jmu h ILE 175 Ca 0.22 -0.03 -0.07 0.00 1.00 0.00 0.00 64.86 65.99 2jmu h ILE 175 Cb 0.37 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2jmu h ILE 175 CO 0.00 0.01 -0.09 0.40 0.00 0.00 0.00 178.15 178.48 2jmu h ILE 176 N 0.08 1.22 -0.21 -0.67 1.08 -0.76 0.17 117.51 118.42 2jmu h ILE 176 Ca 0.08 -0.95 -0.02 0.00 -0.39 0.00 0.00 64.86 63.58 2jmu h ILE 176 Cb 0.09 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 2jmu h ILE 176 CO -0.13 0.32 0.07 0.74 -0.69 0.00 0.00 178.15 178.45 2jmu h THR 177 N 0.48 1.19 -0.40 -0.27 2.02 -0.70 0.12 112.91 115.35 2jmu h THR 177 Ca 0.09 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.64 2jmu h THR 177 Cb 0.45 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 2jmu h THR 177 CO 0.02 0.19 0.11 0.58 0.37 0.00 0.00 175.52 176.79 2jmu h VAL 178 N 0.17 1.22 -0.71 3.16 2.07 -0.93 -2.39 116.25 118.85 2jmu h VAL 178 Ca 0.07 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.84 2jmu h VAL 178 Cb 0.23 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 2jmu h VAL 178 CO -0.00 0.26 0.47 0.28 0.02 0.00 0.00 177.57 178.60 2jmu h SER 179 N 0.50 0.81 1.04 0.57 0.02 -0.75 -0.68 113.55 115.06 2jmu h SER 179 Ca 0.13 -0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.94 2jmu h SER 179 Cb 0.29 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2jmu h SER 179 CO -0.00 0.58 -0.56 -1.28 -1.14 0.00 0.00 176.83 174.43 2jmu h SER 180 N 0.95 0.00 1.39 3.07 0.87 -0.52 0.11 113.55 119.42 2jmu h SER 180 Ca 0.26 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.77 2jmu h SER 180 Cb -0.10 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 2jmu h SER 180 CO -0.06 0.56 -0.63 0.00 -0.53 0.00 0.00 176.83 176.17 2jmu h MET 181 N 0.00 0.00 0.00 2.24 -0.00 -0.89 -3.26 114.93 113.02 2jmu h MET 181 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 2jmu h MET 181 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.83 2jmu h MET 181 CO 0.07 0.16 -0.74 -0.11 -0.00 0.00 0.00 176.91 176.29 2jmu n LEU 182 N -2.97 0.62 0.00 -0.10 7.94 -0.32 -5.03 117.00 117.14 2jmu n LEU 182 Ca 0.00 -0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 2jmu n LEU 182 Cb 0.63 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 44.42 2jmu n LEU 182 CO 0.39 0.08 0.00 0.61 -1.11 0.00 0.00 177.39 177.36 2jmu n GLY 183 N 1.43 -0.60 3.19 -3.96 0.00 0.36 -3.25 105.19 102.35 2jmu n GLY 183 Ca 0.04 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2jmu n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jmu s VAL 184 N -1.21 2.01 0.36 1.61 1.01 -0.18 -4.14 120.40 119.86 2jmu s VAL 184 Ca 0.00 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.73 2jmu s VAL 184 Cb 0.00 -1.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.53 2jmu s VAL 184 CO 0.00 0.55 1.28 -2.16 0.00 0.00 0.00 175.10 174.76 2jmu s PRO 185 N 0.53 4.21 0.27 2.72 0.04 -1.26 -0.00 135.00 141.52 2jmu s PRO 185 Ca -0.14 2.13 0.02 0.00 0.04 0.00 0.00 61.00 63.05 2jmu s PRO 185 Cb -0.17 -2.93 -0.04 0.00 0.04 0.00 0.00 34.50 31.40 2jmu s PRO 185 CO 0.05 -0.28 0.16 0.00 0.04 0.00 0.00 177.00 176.97 2jmu s ALA 186 N -1.21 1.71 0.38 8.56 0.00 0.11 -4.83 121.76 126.48 2jmu s ALA 186 Ca 0.52 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.69 2jmu s ALA 186 Cb -0.38 1.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 2jmu s ALA 186 CO 0.49 -0.54 0.60 1.14 0.00 0.00 0.00 175.76 177.45 2jmu s GLN 187 N -3.90 3.35 -1.29 0.00 -2.07 -1.26 -2.94 119.66 111.56 2jmu s GLN 187 Ca 0.37 -0.37 -0.18 0.00 -1.82 0.00 0.00 55.36 53.37 2jmu s GLN 187 Cb 0.06 -2.62 0.08 0.00 -1.09 0.00 0.00 33.01 29.43 2jmu s GLN 187 CO 0.17 0.00 1.71 -2.00 -1.32 0.00 0.00 175.29 173.85 2jmu s GLU 188 N -4.41 3.99 0.00 9.60 -6.30 -1.26 -4.37 118.70 115.95 2jmu s GLU 188 Ca 0.43 -2.04 0.10 0.00 -2.50 0.00 0.00 54.97 50.96 2jmu s GLU 188 Cb -0.10 -5.50 0.09 0.00 0.00 0.00 0.00 34.13 28.63 2jmu s GLU 188 CO 0.37 -2.22 0.85 -0.85 0.02 0.00 0.00 175.26 173.43 2jmu n GLU 189 N 8.18 0.58 -1.92 4.30 0.28 -1.26 -2.78 120.64 128.02 2jmu n GLU 189 Ca 0.48 -1.16 0.00 0.00 -0.16 0.00 0.00 57.16 56.32 2jmu n GLU 189 Cb 0.46 -1.19 0.00 0.00 1.43 0.00 0.00 31.44 32.14 2jmu n GLU 189 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2jmu n ALA 190 N 0.54 -1.49 -2.08 -1.84 0.00 -1.26 -4.64 120.51 109.74 2jmu n ALA 190 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.11 2jmu n ALA 190 Cb 0.26 -0.27 -0.03 0.00 0.00 0.00 0.00 19.45 19.41 2jmu n ALA 190 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jmu s PRO 191 N -0.49 2.77 1.06 0.00 0.04 -1.26 -4.97 135.00 132.15 2jmu s PRO 191 Ca 0.00 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.56 2jmu s PRO 191 Cb 0.00 -4.34 0.21 0.00 0.04 0.00 0.00 34.50 30.41 2jmu s PRO 191 CO 0.00 -2.57 1.00 0.00 0.04 0.00 0.00 177.00 175.47 2jmu n ALA 192 N 12.15 -2.08 -0.16 8.56 0.00 -1.26 -4.68 120.51 133.04 2jmu n ALA 192 Ca 0.19 -0.90 -0.03 0.00 0.00 0.00 0.00 53.44 52.70 2jmu n ALA 192 Cb 0.51 -2.05 0.03 0.00 0.00 0.00 0.00 19.45 17.94 2jmu n ALA 192 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2jmu h LYS 193 N -2.29 -0.04 0.00 0.00 1.79 -2.00 0.18 116.57 114.21 2jmu h LYS 193 Ca -0.53 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 57.91 2jmu h LYS 193 Cb 1.31 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.96 2jmu h LYS 193 CO 0.45 -0.03 -0.19 -0.07 -1.08 0.00 0.00 179.45 178.53 2jmu h LEU 194 N -0.04 0.00 -1.20 2.94 3.38 -1.98 -0.61 115.31 117.79 2jmu h LEU 194 Ca 0.24 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.13 2jmu h LEU 194 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2jmu h LEU 194 CO -0.53 0.19 -0.35 0.24 0.09 0.00 0.00 178.44 178.07 2jmu h MET 195 N 0.00 0.08 -0.08 1.13 2.86 -0.99 0.34 114.93 118.28 2jmu h MET 195 Ca -0.00 -0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.45 2jmu h MET 195 Cb 0.56 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.23 2jmu h MET 195 CO 0.02 0.43 -0.55 0.28 1.06 0.00 0.00 176.91 178.15 2jmu h VAL 196 N 0.07 1.37 -0.51 -2.22 2.07 -0.79 -1.19 116.25 115.06 2jmu h VAL 196 Ca 0.01 -1.90 0.08 0.00 0.82 0.00 0.00 66.70 65.70 2jmu h VAL 196 Cb 0.66 2.28 -0.06 0.00 -1.52 0.00 0.00 31.29 32.65 2jmu h VAL 196 CO 0.05 0.57 0.15 0.22 0.02 0.00 0.00 177.57 178.58 2jmu h TYR 197 N 0.10 0.26 -0.01 1.57 3.20 -0.52 -1.12 116.97 120.45 2jmu h TYR 197 Ca -0.05 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 2jmu h TYR 197 Cb 1.21 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.44 2jmu h TYR 197 CO 0.12 0.06 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.62 2jmu h LEU 198 N 0.31 0.02 -1.48 2.82 3.38 -0.33 -0.59 115.31 119.44 2jmu h LEU 198 Ca 0.25 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.86 2jmu h LEU 198 Cb 0.30 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2jmu h LEU 198 CO -0.28 0.41 0.39 0.06 0.09 0.00 0.00 178.44 179.11 2jmu h GLN 199 N -0.37 0.66 0.11 1.13 3.07 -0.86 0.67 115.11 119.52 2jmu h GLN 199 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.70 2jmu h GLN 199 Cb 0.40 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 27.82 2jmu h GLN 199 CO 0.00 0.44 -0.05 -0.09 0.09 0.00 0.00 178.83 179.21 2jmu h ARG 200 N 0.68 -0.14 0.00 0.06 9.65 -1.18 -3.35 114.38 120.09 2jmu h ARG 200 Ca 0.24 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.13 2jmu h ARG 200 Cb 0.09 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2jmu h ARG 200 CO -0.06 0.33 -1.63 1.19 2.80 0.00 0.00 179.97 182.60 2jmu n PHE 201 N -4.90 0.26 -2.79 2.20 3.72 -0.23 -4.74 117.46 110.98 2jmu n PHE 201 Ca -0.08 0.07 -0.09 0.00 -0.05 0.00 0.00 57.45 57.30 2jmu n PHE 201 Cb 0.27 -0.58 0.04 0.00 -0.94 0.00 0.00 39.48 38.27 2jmu n PHE 201 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 2jmu n ARG 202 N -2.30 0.75 -0.35 -1.08 1.85 0.23 -5.04 116.66 110.72 2jmu n ARG 202 Ca -0.02 -1.88 0.01 0.00 -1.00 0.00 0.00 57.85 54.95 2jmu n ARG 202 Cb 0.54 -1.45 0.15 0.00 -1.05 0.00 0.00 32.46 30.65 2jmu n ARG 202 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 2jmu h PRO 203 N 4.10 1.12 -0.26 2.89 0.11 -1.64 -0.39 132.00 137.93 2jmu h PRO 203 Ca -0.11 -0.07 -0.18 0.00 0.11 0.00 0.00 66.00 65.75 2jmu h PRO 203 Cb 1.02 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2jmu h PRO 203 CO 0.31 0.74 -0.57 -0.07 -0.21 0.00 0.00 178.00 178.21 2jmu h LEU 204 N 1.15 0.91 -0.63 2.35 -0.00 -1.93 0.68 115.31 117.84 2jmu h LEU 204 Ca 0.40 -0.50 0.00 0.00 -0.00 0.00 0.00 57.88 57.78 2jmu h LEU 204 Cb 0.09 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 40.46 2jmu h LEU 204 CO -0.15 1.28 0.41 -0.78 -0.00 0.00 0.00 178.44 179.20 2jmu h ASP 205 N 0.62 0.74 0.25 -0.43 3.58 -1.79 0.65 116.42 120.03 2jmu h ASP 205 Ca 0.01 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.42 2jmu h ASP 205 Cb 1.17 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.02 2jmu h ASP 205 CO 0.12 0.55 -0.20 0.22 -2.88 0.00 0.00 179.24 177.05 2jmu h TYR 206 N 0.86 -0.53 -0.77 0.28 3.20 -0.85 -2.60 116.97 116.56 2jmu h TYR 206 Ca 0.23 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.06 2jmu h TYR 206 Cb -0.08 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 2jmu h TYR 206 CO -0.03 -0.31 0.32 1.96 -1.64 0.00 0.00 178.16 178.47 2jmu h GLN 207 N -0.46 1.14 -0.99 1.82 4.20 -0.38 0.42 115.11 120.85 2jmu h GLN 207 Ca -0.01 -0.20 0.05 0.00 0.06 0.00 0.00 58.65 58.55 2jmu h GLN 207 Cb 0.41 -0.19 -0.06 0.00 0.30 0.00 0.00 27.48 27.94 2jmu h GLN 207 CO -0.02 0.92 0.64 0.00 -0.67 0.00 0.00 178.83 179.70 2jmu h ARG 208 N 1.10 1.17 0.11 1.46 3.08 -0.82 0.27 114.38 120.76 2jmu h ARG 208 Ca 0.26 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2jmu h ARG 208 Cb 0.19 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2jmu h ARG 208 CO -0.02 0.77 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.52 2jmu h LEU 209 N 1.20 -0.13 -0.64 3.04 4.07 -1.06 -3.37 115.31 118.43 2jmu h LEU 209 Ca 0.41 -0.44 0.01 0.00 0.08 0.00 0.00 57.88 57.94 2jmu h LEU 209 Cb 0.09 0.03 -0.03 0.00 1.08 0.00 0.00 40.66 41.83 2jmu h LEU 209 CO -0.15 0.45 0.42 0.25 -1.08 0.00 0.00 178.44 178.34 2jmu h LEU 210 N -0.81 0.73 -2.12 1.67 5.85 0.29 0.35 115.31 121.27 2jmu h LEU 210 Ca -0.02 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2jmu h LEU 210 Cb 0.56 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 2jmu h LEU 210 CO 0.03 0.53 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.30 2jmu h GLU 211 N 0.86 0.00 0.01 1.25 5.08 -0.67 -2.38 114.58 118.73 2jmu h GLU 211 Ca 0.24 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.44 2jmu h GLU 211 Cb -0.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2jmu h GLU 211 CO -0.06 0.02 -0.85 0.00 -1.00 0.00 0.00 179.01 177.13 2jmu h ALA 212 N 1.98 0.17 -2.36 3.43 0.00 -1.53 -3.41 119.26 117.54 2jmu h ALA 212 Ca -0.00 -0.97 -0.78 0.00 0.00 0.00 0.00 54.91 53.15 2jmu h ALA 212 Cb 0.05 0.48 -0.25 0.00 0.00 0.00 0.00 17.79 18.07 2jmu h ALA 212 CO 0.00 0.48 0.66 0.00 0.00 0.00 0.00 179.25 180.39 2jmu s ALA 213 N -2.32 4.55 -0.69 0.00 0.00 0.12 -4.77 121.76 118.65 2jmu s ALA 213 Ca -0.25 -3.72 0.25 0.00 0.00 0.00 0.00 51.96 48.24 2jmu s ALA 213 Cb 0.03 -3.70 0.53 0.00 0.00 0.00 0.00 23.12 19.98 2jmu s ALA 213 CO 0.63 -2.34 1.50 0.45 0.00 0.00 0.00 175.76 176.00 2jmu n SER 214 N 3.45 0.73 0.00 0.00 2.88 -0.98 -4.40 113.62 115.30 2jmu n SER 214 Ca 0.27 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2jmu n SER 214 Cb 0.40 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 2jmu n SER 214 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2jmu n SER 215 N -2.15 0.00 -4.92 -3.46 2.88 -1.26 -4.29 113.62 100.43 2jmu n SER 215 Ca 0.04 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.37 2jmu n SER 215 Cb 0.43 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.94 2jmu n SER 215 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2jmu s GLY 216 N 0.00 1.82 -0.20 0.46 0.00 -1.12 -5.05 107.32 103.24 2jmu s GLY 216 Ca 0.00 -1.57 -0.06 0.00 0.00 0.00 0.00 44.72 43.08 2jmu s GLY 216 CO 0.00 -1.22 0.04 1.85 0.00 0.00 0.00 173.10 173.77 2jmu s GLU 217 N -4.78 3.76 0.37 2.90 2.12 -1.26 -4.86 118.70 116.95 2jmu s GLU 217 Ca 0.60 -0.45 0.09 0.00 0.36 0.00 0.00 54.97 55.57 2jmu s GLU 217 Cb -0.09 -3.17 0.82 0.00 0.26 0.00 0.00 34.13 31.95 2jmu s GLU 217 CO 0.39 0.08 1.92 0.00 -0.54 0.00 0.00 175.26 177.11 2jmu h ALA 218 N 7.29 1.82 -2.06 6.30 0.00 -1.95 -3.37 119.26 127.29 2jmu h ALA 218 Ca -0.36 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.31 2jmu h ALA 218 Cb 1.18 -0.15 -0.32 0.00 0.00 0.00 0.00 17.79 18.50 2jmu h ALA 218 CO 0.63 0.00 -0.56 -0.08 0.00 0.00 0.00 179.25 179.25 2jmu s THR 219 N -5.64 -0.50 -0.34 0.00 -1.32 -1.26 -4.99 115.64 101.60 2jmu s THR 219 Ca -0.10 -0.22 -0.00 0.00 -1.21 0.00 0.00 61.69 60.16 2jmu s THR 219 Cb 0.21 -0.86 0.11 0.00 -1.51 0.00 0.00 72.50 70.45 2jmu s THR 219 CO 0.78 -0.25 0.13 -0.83 -2.21 0.00 0.00 174.62 172.24 2jmu s GLY 220 N 2.45 1.12 -0.07 6.08 0.00 -1.26 -5.01 107.32 110.64 2jmu s GLY 220 Ca 0.10 -1.81 -0.14 0.00 0.00 0.00 0.00 44.72 42.87 2jmu s GLY 220 CO -0.22 1.67 0.53 -1.80 0.00 0.00 0.00 173.10 173.28 2jmu h ASP 221 N 7.78 -0.21 -4.05 1.64 3.58 -1.98 -3.50 116.42 119.67 2jmu h ASP 221 Ca -0.10 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.18 2jmu h ASP 221 Cb 0.99 0.06 -0.00 0.00 1.72 0.00 0.00 39.33 42.10 2jmu h ASP 221 CO 0.46 0.31 -0.60 -0.24 -2.88 0.00 0.00 179.24 176.29 2jmu n SER 222 N -4.93 -6.65 -3.94 2.28 2.88 -1.26 -4.95 113.62 97.04 2jmu n SER 222 Ca -0.05 1.14 -0.23 0.00 -1.33 0.00 0.00 58.87 58.40 2jmu n SER 222 Cb 0.19 -3.58 -0.17 0.00 -0.75 0.00 0.00 64.21 59.90 2jmu n SER 222 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jmu s ALA 223 N -0.37 1.04 0.00 -1.46 0.00 -1.26 -4.16 121.76 115.55 2jmu s ALA 223 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.66 2jmu s ALA 223 Cb 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.53 2jmu s ALA 223 CO 0.00 -0.06 0.00 0.45 0.00 0.00 0.00 175.76 176.15