#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j55 n ALA 6 N 0.00 0.00 -1.77 0.62 0.00 -1.26 -5.16 120.51 112.95 2j55 n ALA 6 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 2j55 n ALA 6 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2j55 n ALA 6 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2j55 s GLU 7 N -0.38 4.36 0.74 0.00 2.02 -1.26 -5.07 118.70 119.12 2j55 s GLU 7 Ca 0.00 1.94 -0.12 0.00 0.02 0.00 0.00 54.97 56.82 2j55 s GLU 7 Cb 0.00 -2.98 0.04 0.00 0.10 0.00 0.00 34.13 31.29 2j55 s GLU 7 CO 0.00 -0.09 1.12 0.95 0.02 0.00 0.00 175.26 177.26 2j55 s THR 8 N -1.24 3.04 0.10 3.63 -4.23 -1.26 -4.90 115.64 110.79 2j55 s THR 8 Ca 0.50 0.34 -0.27 0.00 -1.18 0.00 0.00 61.69 61.08 2j55 s THR 8 Cb -0.34 -3.31 -0.10 0.00 1.34 0.00 0.00 72.50 70.09 2j55 s THR 8 CO 0.44 -0.44 1.65 -0.61 -0.54 0.00 0.00 174.62 175.12 2j55 h GLN 9 N -0.81 -0.42 -0.72 3.99 5.75 -1.97 -2.35 115.11 118.57 2j55 h GLN 9 Ca -0.45 0.03 0.14 0.00 -0.15 0.00 0.00 58.65 58.22 2j55 h GLN 9 Cb 1.28 0.10 -0.14 0.00 1.07 0.00 0.00 27.48 29.78 2j55 h GLN 9 CO 0.64 -0.28 -0.17 0.00 -2.65 0.00 0.00 178.83 176.37 2j55 h ALA 10 N 0.32 0.48 -0.35 3.38 0.00 -1.92 -0.36 119.26 120.81 2j55 h ALA 10 Ca 0.02 0.28 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2j55 h ALA 10 Cb 0.44 0.54 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 2j55 h ALA 10 CO -0.10 -0.41 -0.13 1.96 0.00 0.00 0.00 179.25 180.57 2j55 h GLN 11 N 0.00 -0.06 0.03 0.00 4.20 -1.79 -0.34 115.11 117.15 2j55 h GLN 11 Ca 0.35 0.00 0.01 0.00 0.06 0.00 0.00 58.65 59.08 2j55 h GLN 11 Cb 0.53 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2j55 h GLN 11 CO -0.74 -0.04 -0.11 0.93 -0.67 0.00 0.00 178.83 178.20 2j55 h GLU 12 N -0.06 -0.20 -0.56 1.46 5.08 -0.70 0.29 114.58 119.89 2j55 h GLU 12 Ca 0.18 0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2j55 h GLU 12 Cb 0.33 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 2j55 h GLU 12 CO -0.40 -0.13 -0.02 0.00 -1.00 0.00 0.00 179.01 177.46 2j55 h THR 13 N -0.20 1.26 -0.14 1.13 1.03 -0.96 0.23 112.91 115.26 2j55 h THR 13 Ca 0.03 -1.14 -0.02 0.00 -0.01 0.00 0.00 66.41 65.27 2j55 h THR 13 Cb 0.24 0.85 -0.01 0.00 -1.07 0.00 0.00 68.15 68.16 2j55 h THR 13 CO -0.09 0.41 0.00 1.56 -0.01 0.00 0.00 175.52 177.39 2j55 h GLN 14 N 0.90 0.24 -0.97 0.00 4.20 -0.92 -0.70 115.11 117.87 2j55 h GLN 14 Ca 0.16 -0.08 0.14 0.00 0.06 0.00 0.00 58.65 58.93 2j55 h GLN 14 Cb 0.55 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 28.22 2j55 h GLN 14 CO 0.03 0.47 0.61 0.78 -0.67 0.00 0.00 178.83 180.05 2j55 h GLY 15 N -0.02 1.52 0.61 3.46 0.00 -0.33 -1.09 103.07 107.22 2j55 h GLY 15 Ca 0.04 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 2j55 h GLY 15 CO 0.01 0.10 -0.24 1.46 0.00 0.00 0.00 176.54 177.87 2j55 h GLN 16 N 0.86 0.26 -0.16 4.80 4.20 -0.26 -1.56 115.11 123.25 2j55 h GLN 16 Ca 0.49 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.96 2j55 h GLN 16 Cb 0.64 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 2j55 h GLN 16 CO -0.26 0.85 -0.09 0.00 -0.67 0.00 0.00 178.83 178.66 2j55 h ALA 17 N 0.41 1.55 -0.23 3.87 0.00 -1.09 -1.55 119.26 122.23 2j55 h ALA 17 Ca -0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2j55 h ALA 17 Cb 0.89 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2j55 h ALA 17 CO 0.05 0.32 -0.04 0.00 0.00 0.00 0.00 179.25 179.58 2j55 h ALA 18 N 1.68 0.31 -0.59 0.00 0.00 -1.23 -0.32 119.26 119.11 2j55 h ALA 18 Ca 0.05 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2j55 h ALA 18 Cb 0.31 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2j55 h ALA 18 CO 0.02 0.08 0.17 0.00 0.00 0.00 0.00 179.25 179.52 2j55 h ALA 19 N 0.76 1.19 -0.19 0.00 0.00 -0.97 -1.55 119.26 118.50 2j55 h ALA 19 Ca 0.06 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2j55 h ALA 19 Cb 0.49 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2j55 h ALA 19 CO 0.02 0.56 0.01 0.00 0.00 0.00 0.00 179.25 179.84 2j55 h ARG 20 N 0.87 0.34 -0.53 0.00 3.08 -1.21 -1.58 114.38 115.35 2j55 h ARG 20 Ca 0.19 -0.10 0.08 0.00 0.07 0.00 0.00 59.98 60.22 2j55 h ARG 20 Cb 0.27 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.22 2j55 h ARG 20 CO -0.01 0.53 0.17 0.00 -1.07 0.00 0.00 179.97 179.59 2j55 h ALA 21 N 0.80 0.64 -0.03 0.04 0.00 -1.06 -2.02 119.26 117.63 2j55 h ALA 21 Ca 0.06 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 2j55 h ALA 21 Cb 0.37 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2j55 h ALA 21 CO 0.01 -0.24 -0.67 0.00 0.00 0.00 0.00 179.25 178.35 2j55 h ALA 22 N 1.37 0.81 -0.40 0.00 0.00 -1.06 -1.93 119.26 118.05 2j55 h ALA 22 Ca 0.26 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 2j55 h ALA 22 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2j55 h ALA 22 CO -0.28 0.79 -0.02 0.00 0.00 0.00 0.00 179.25 179.74 2j55 h ALA 23 N 1.20 0.55 -0.29 0.00 0.00 -1.08 -1.15 119.26 118.49 2j55 h ALA 23 Ca -0.01 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.64 2j55 h ALA 23 Cb 1.19 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2j55 h ALA 23 CO 0.10 0.34 0.15 0.00 0.00 0.00 0.00 179.25 179.84 2j55 h ALA 24 N 0.88 0.35 -0.20 0.00 0.00 -1.24 -0.55 119.26 118.49 2j55 h ALA 24 Ca 0.11 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.08 2j55 h ALA 24 Cb 0.51 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 2j55 h ALA 24 CO 0.02 -0.24 -0.22 -0.44 0.00 0.00 0.00 179.25 178.38 2j55 h ASP 25 N 0.31 -0.71 -0.23 0.00 3.32 -1.23 -0.40 116.42 117.47 2j55 h ASP 25 Ca 0.12 0.13 0.02 0.00 0.02 0.00 0.00 57.03 57.32 2j55 h ASP 25 Cb 0.03 0.33 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 2j55 h ASP 25 CO -0.07 -0.27 0.08 0.25 -1.72 0.00 0.00 179.24 177.51 2j55 h LEU 26 N -0.25 0.08 -1.66 1.55 5.85 -0.81 -0.91 115.31 119.16 2j55 h LEU 26 Ca 0.12 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 2j55 h LEU 26 Cb 0.43 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2j55 h LEU 26 CO -0.35 0.08 -0.02 0.00 -0.34 0.00 0.00 178.44 177.81 2j55 h ALA 27 N 1.15 1.73 0.00 1.25 0.00 -1.04 0.51 119.26 122.86 2j55 h ALA 27 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2j55 h ALA 27 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2j55 h ALA 27 CO -0.11 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.35 2j55 n ALA 28 N -2.50 2.41 -3.39 0.00 0.00 -0.17 -4.90 120.51 111.95 2j55 n ALA 28 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 2j55 n ALA 28 Cb 0.17 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.60 2j55 n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j55 n GLY 29 N 0.38 -0.47 3.62 0.00 0.00 0.18 -4.97 105.19 103.93 2j55 n GLY 29 Ca 0.00 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2j55 n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j55 s GLN 30 N -6.02 3.91 0.28 1.61 -1.52 -0.41 -5.01 119.66 112.51 2j55 s GLN 30 Ca 0.39 0.75 -0.30 0.00 -1.95 0.00 0.00 55.36 54.25 2j55 s GLN 30 Cb -0.22 -3.79 -0.12 0.00 -0.22 0.00 0.00 33.01 28.67 2j55 s GLN 30 CO 0.48 -0.97 1.63 -0.25 -0.25 0.00 0.00 175.29 175.92 2j55 n ASP 31 N 6.91 3.92 -4.63 5.90 8.00 -1.26 -4.60 116.55 130.80 2j55 n ASP 31 Ca 0.09 1.13 -0.45 0.00 0.71 0.00 0.00 54.79 56.28 2j55 n ASP 31 Cb 0.48 -1.59 -0.04 0.00 -0.02 0.00 0.00 41.12 39.95 2j55 n ASP 31 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2j55 n ASP 32 N 2.53 3.60 -3.82 -2.24 8.00 -1.26 -4.98 116.55 118.38 2j55 n ASP 32 Ca 0.10 0.69 -0.30 0.00 0.71 0.00 0.00 54.79 55.99 2j55 n ASP 32 Cb 0.36 -1.48 -0.09 0.00 -0.02 0.00 0.00 41.12 39.89 2j55 n ASP 32 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2j55 n GLU 33 N 7.71 2.30 -1.60 -1.24 -0.58 -1.26 -5.11 120.64 120.86 2j55 n GLU 33 Ca 0.25 -4.55 -0.46 0.00 -0.42 0.00 0.00 57.16 51.98 2j55 n GLU 33 Cb 0.38 -2.32 -0.03 0.00 -0.57 0.00 0.00 31.44 28.90 2j55 n GLU 33 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 2j55 n PRO 34 N 1.70 1.42 -3.78 3.49 -0.02 -1.26 -4.99 135.00 131.55 2j55 n PRO 34 Ca 0.23 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 62.07 2j55 n PRO 34 Cb 0.37 -1.97 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 2j55 n PRO 34 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2j55 n ARG 35 N 1.33 0.57 -3.83 -0.52 1.85 -1.26 -5.14 116.66 109.66 2j55 n ARG 35 Ca 0.12 -2.60 -0.36 0.00 -1.00 0.00 0.00 57.85 54.01 2j55 n ARG 35 Cb 0.29 2.42 -0.12 0.00 -1.05 0.00 0.00 32.46 34.00 2j55 n ARG 35 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2j55 s ILE 36 N -2.87 4.43 0.69 8.89 1.01 -1.26 -5.09 121.20 127.01 2j55 s ILE 36 Ca 0.28 -0.14 -0.13 0.00 0.00 0.00 0.00 60.65 60.67 2j55 s ILE 36 Cb -0.00 -3.06 0.01 0.00 0.01 0.00 0.00 42.46 39.42 2j55 s ILE 36 CO 0.20 0.36 1.08 -0.76 0.00 0.00 0.00 174.94 175.82 2j55 s LEU 37 N 1.33 3.23 0.00 2.97 1.43 -1.26 -5.06 118.68 121.33 2j55 s LEU 37 Ca 0.05 1.80 -0.01 0.00 -1.03 0.00 0.00 54.13 54.93 2j55 s LEU 37 Cb -0.15 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.51 2j55 s LEU 37 CO 0.04 -1.60 0.15 -1.61 0.23 0.00 0.00 176.35 173.56 2j55 s GLU 38 N -4.60 3.29 0.63 1.70 2.02 -1.26 -4.94 118.70 115.54 2j55 s GLU 38 Ca 0.62 -0.40 -0.16 0.00 0.02 0.00 0.00 54.97 55.05 2j55 s GLU 38 Cb -0.17 -3.00 -0.02 0.00 0.10 0.00 0.00 34.13 31.05 2j55 s GLU 38 CO 0.49 0.65 1.10 0.00 0.02 0.00 0.00 175.26 177.52 2j55 s ALA 39 N -1.31 2.55 0.83 5.21 0.00 -0.08 -5.03 121.76 123.94 2j55 s ALA 39 Ca 0.27 0.56 -0.13 0.00 0.00 0.00 0.00 51.96 52.66 2j55 s ALA 39 Cb -0.12 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.77 2j55 s ALA 39 CO 0.18 -1.11 1.10 -0.35 0.00 0.00 0.00 175.76 175.58 2j55 n PRO 40 N -2.17 0.07 -1.68 0.00 -0.04 -1.26 -4.77 135.00 125.16 2j55 n PRO 40 Ca 0.10 0.10 -0.43 0.00 -0.04 0.00 0.00 63.50 63.23 2j55 n PRO 40 Cb 0.52 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.62 2j55 n PRO 40 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2j55 n ALA 41 N -3.38 1.00 -1.59 0.55 0.00 -1.26 -4.81 120.51 111.01 2j55 n ALA 41 Ca 0.13 0.37 -0.46 0.00 0.00 0.00 0.00 53.44 53.48 2j55 n ALA 41 Cb 0.51 -2.21 -0.02 0.00 0.00 0.00 0.00 19.45 17.73 2j55 n ALA 41 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2j55 n PRO 42 N 0.65 1.35 -4.21 0.00 -0.02 -1.26 -4.99 135.00 126.52 2j55 n PRO 42 Ca 0.06 0.48 -0.17 0.00 -2.02 0.00 0.00 63.50 61.85 2j55 n PRO 42 Cb 0.35 -1.90 -0.07 0.00 -0.02 0.00 0.00 33.50 31.86 2j55 n PRO 42 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2j55 s ASP 43 N -0.36 1.17 0.55 2.55 1.47 -1.26 -5.02 116.67 115.76 2j55 s ASP 43 Ca 0.63 -1.60 0.28 0.00 1.18 0.00 0.00 52.55 53.04 2j55 s ASP 43 Cb -0.73 0.56 1.62 0.00 -0.34 0.00 0.00 42.92 44.02 2j55 s ASP 43 CO 0.57 -1.09 2.16 0.00 0.68 0.00 0.00 175.17 177.49 2j55 h ALA 44 N 2.22 1.41 -0.21 2.11 0.00 -1.94 -2.78 119.26 120.07 2j55 h ALA 44 Ca -0.28 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2j55 h ALA 44 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2j55 h ALA 44 CO 0.40 0.08 0.00 0.54 0.00 0.00 0.00 179.25 180.27 2j55 n ARG 45 N -3.76 2.29 -2.14 0.00 1.74 -1.26 -4.50 116.66 109.02 2j55 n ARG 45 Ca -0.02 -1.92 -0.42 0.00 -0.77 0.00 0.00 57.85 54.72 2j55 n ARG 45 Cb 0.16 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 2j55 n ARG 45 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2j55 s ARG 46 N -1.74 4.31 -0.01 5.56 3.52 -1.05 0.69 118.95 130.22 2j55 s ARG 46 Ca 0.34 2.10 0.03 0.00 -0.13 0.00 0.00 55.73 58.08 2j55 s ARG 46 Cb 0.21 -3.26 -0.01 0.00 -1.56 0.00 0.00 34.95 30.34 2j55 s ARG 46 CO 0.31 -0.46 -0.11 0.54 -0.81 0.00 0.00 175.30 174.76 2j55 s VAL 47 N 1.19 0.89 -0.12 7.11 0.11 0.39 -4.51 120.40 125.46 2j55 s VAL 47 Ca 0.65 -0.48 -0.02 0.00 -2.93 0.00 0.00 61.98 59.20 2j55 s VAL 47 Cb -0.37 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 33.70 2j55 s VAL 47 CO 0.30 0.26 -0.04 -0.31 -3.33 0.00 0.00 175.10 171.97 2j55 s TYR 48 N -0.22 3.01 -0.16 1.54 1.51 -0.13 -0.55 117.35 122.35 2j55 s TYR 48 Ca 0.04 -0.16 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 2j55 s TYR 48 Cb -0.05 -1.87 0.02 0.00 -0.11 0.00 0.00 41.96 39.95 2j55 s TYR 48 CO -0.00 0.12 -0.19 0.08 -1.11 0.00 0.00 175.55 174.44 2j55 s VAL 49 N -0.10 1.95 -0.18 0.71 1.01 -0.08 -1.17 120.40 122.54 2j55 s VAL 49 Ca 0.02 -0.88 -0.07 0.00 0.00 0.00 0.00 61.98 61.05 2j55 s VAL 49 Cb -0.13 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 2j55 s VAL 49 CO 0.03 0.52 0.05 0.20 0.00 0.00 0.00 175.10 175.90 2j55 s ASN 50 N 1.18 5.52 -0.62 3.32 -0.87 0.64 -0.41 114.94 123.70 2j55 s ASN 50 Ca 0.01 0.05 -0.09 0.00 -1.57 0.00 0.00 52.86 51.26 2j55 s ASN 50 Cb -0.14 -1.94 0.16 0.00 -0.02 0.00 0.00 41.25 39.31 2j55 s ASN 50 CO -0.09 0.17 0.50 -0.62 -2.57 0.00 0.00 177.10 174.50 2j55 s ASP 51 N 0.36 5.92 0.00 -1.22 2.15 0.68 -1.34 116.67 123.22 2j55 s ASP 51 Ca 0.02 -2.38 0.08 0.00 0.43 0.00 0.00 52.55 50.70 2j55 s ASP 51 Cb -0.13 -2.04 0.37 0.00 -0.30 0.00 0.00 42.92 40.82 2j55 s ASP 51 CO 0.00 -0.59 1.19 -2.65 -0.17 0.00 0.00 175.17 172.96 2j55 n PRO 52 N 4.29 0.06 -3.83 4.34 -0.02 -1.26 -3.20 135.00 135.38 2j55 n PRO 52 Ca 0.02 0.29 -0.28 0.00 -2.02 0.00 0.00 63.50 61.51 2j55 n PRO 52 Cb 0.42 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.44 2j55 n PRO 52 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j55 n ALA 53 N -1.40 -1.31 -4.05 3.55 0.00 -1.26 -2.22 120.51 113.83 2j55 n ALA 53 Ca 0.03 0.24 -0.28 0.00 0.00 0.00 0.00 53.44 53.43 2j55 n ALA 53 Cb 0.08 -4.71 -0.03 0.00 0.00 0.00 0.00 19.45 14.79 2j55 n ALA 53 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2j55 n HIS 54 N -4.76 -1.64 -0.92 0.00 8.25 -1.26 -2.05 115.22 112.83 2j55 n HIS 54 Ca 0.03 0.75 0.00 0.00 -0.26 0.00 0.00 57.72 58.23 2j55 n HIS 54 Cb 0.54 -3.47 0.00 0.00 1.12 0.00 0.00 29.99 28.18 2j55 n HIS 54 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2j55 n PHE 55 N -4.42 0.00 -1.88 4.41 3.72 -0.94 -5.02 117.46 113.33 2j55 n PHE 55 Ca -0.22 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.81 2j55 n PHE 55 Cb 0.64 -0.08 0.05 0.00 -0.94 0.00 0.00 39.48 39.15 2j55 n PHE 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2j55 s ALA 56 N -2.00 2.55 0.46 4.37 0.00 -0.87 -4.90 121.76 121.37 2j55 s ALA 56 Ca 0.00 1.15 0.20 0.00 0.00 0.00 0.00 51.96 53.31 2j55 s ALA 56 Cb 0.00 -3.51 1.26 0.00 0.00 0.00 0.00 23.12 20.87 2j55 s ALA 56 CO 0.00 -1.35 2.06 0.00 0.00 0.00 0.00 175.76 176.47 2j55 h ALA 57 N 0.92 1.56 -3.53 0.00 0.00 -1.91 -3.41 119.26 112.89 2j55 h ALA 57 Ca -0.51 -0.12 -0.45 0.00 0.00 0.00 0.00 54.91 53.83 2j55 h ALA 57 Cb 1.31 -0.02 -0.22 0.00 0.00 0.00 0.00 17.79 18.86 2j55 h ALA 57 CO 0.55 0.16 -0.79 0.14 0.00 0.00 0.00 179.25 179.31 2j55 s VAL 58 N -4.52 1.26 0.13 0.00 -7.23 -1.26 -2.57 120.40 106.21 2j55 s VAL 58 Ca -0.04 -1.32 -0.01 0.00 -1.81 0.00 0.00 61.98 58.80 2j55 s VAL 58 Cb 0.15 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.86 2j55 s VAL 58 CO 0.64 -0.15 0.04 0.42 -0.31 0.00 0.00 175.10 175.74 2j55 s THR 59 N -1.18 0.17 0.02 5.32 -4.23 -0.23 -4.88 115.64 110.62 2j55 s THR 59 Ca 0.01 -1.91 0.04 0.00 -1.18 0.00 0.00 61.69 58.65 2j55 s THR 59 Cb -0.10 -1.99 -0.02 0.00 1.34 0.00 0.00 72.50 71.73 2j55 s THR 59 CO 0.03 -0.52 -0.13 -1.10 -0.54 0.00 0.00 174.62 172.35 2j55 s GLN 60 N -4.02 0.95 -0.08 3.99 -0.21 -1.19 -0.67 119.66 118.42 2j55 s GLN 60 Ca 0.22 -0.62 0.01 0.00 0.02 0.00 0.00 55.36 55.00 2j55 s GLN 60 Cb 0.07 -0.94 -0.02 0.00 1.00 0.00 0.00 33.01 33.12 2j55 s GLN 60 CO 0.01 0.24 -0.11 -1.14 -2.12 0.00 0.00 175.29 172.17 2j55 s GLN 61 N -0.78 2.87 -0.20 2.91 0.74 0.37 -0.23 119.66 125.34 2j55 s GLN 61 Ca 0.03 -0.64 -0.04 0.00 0.05 0.00 0.00 55.36 54.75 2j55 s GLN 61 Cb -0.07 -2.53 -0.02 0.00 1.10 0.00 0.00 33.01 31.49 2j55 s GLN 61 CO 0.00 0.50 -0.03 -0.06 -0.55 0.00 0.00 175.29 175.15 2j55 s PHE 62 N -0.40 2.98 -0.26 1.67 0.40 0.45 -1.30 117.98 121.52 2j55 s PHE 62 Ca 0.05 -0.67 -0.16 0.00 -0.60 0.00 0.00 56.93 55.54 2j55 s PHE 62 Cb -0.12 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.31 2j55 s PHE 62 CO 0.02 -0.36 0.43 0.08 0.70 0.00 0.00 175.22 176.09 2j55 s VAL 63 N 1.11 5.14 -0.03 -0.44 1.01 0.57 -0.91 120.40 126.85 2j55 s VAL 63 Ca 0.02 0.69 0.05 0.00 0.00 0.00 0.00 61.98 62.74 2j55 s VAL 63 Cb -0.15 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 2j55 s VAL 63 CO 0.00 0.14 -0.17 -0.63 0.00 0.00 0.00 175.10 174.44 2j55 s ILE 64 N 2.10 1.37 -0.53 2.22 1.01 0.29 -0.50 121.20 127.16 2j55 s ILE 64 Ca 0.18 -0.71 -0.25 0.00 0.00 0.00 0.00 60.65 59.87 2j55 s ILE 64 Cb -0.16 -1.16 0.04 0.00 0.01 0.00 0.00 42.46 41.19 2j55 s ILE 64 CO 0.09 0.39 0.97 -0.62 0.00 0.00 0.00 174.94 175.77 2j55 s ASP 65 N -0.14 6.40 0.50 3.58 2.15 -0.15 -0.46 116.67 128.53 2j55 s ASP 65 Ca 0.01 -0.17 0.29 0.00 0.43 0.00 0.00 52.55 53.11 2j55 s ASP 65 Cb -0.09 -2.45 1.16 0.00 -0.30 0.00 0.00 42.92 41.24 2j55 s ASP 65 CO 0.01 -1.21 1.92 1.23 -0.17 0.00 0.00 175.17 176.95 2j55 h GLY 66 N 10.97 0.00 0.96 2.66 0.00 -0.05 0.20 103.07 117.81 2j55 h GLY 66 Ca -0.25 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 2j55 h GLY 66 CO 1.08 0.00 -0.16 -2.09 0.00 0.00 0.00 176.54 175.37 2j55 h GLU 67 N 0.00 0.72 0.00 4.80 4.57 -1.92 -3.25 114.58 119.51 2j55 h GLU 67 Ca -0.00 -0.31 -0.01 0.00 -1.18 0.00 0.00 59.36 57.86 2j55 h GLU 67 Cb 0.61 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2j55 h GLU 67 CO 0.01 0.92 -1.67 0.00 -1.18 0.00 0.00 179.01 177.09 2j55 n ALA 68 N -2.46 2.68 -3.18 2.92 0.00 -1.15 -4.98 120.51 114.34 2j55 n ALA 68 Ca -0.02 -0.44 -0.15 0.00 0.00 0.00 0.00 53.44 52.83 2j55 n ALA 68 Cb 0.39 -0.86 0.06 0.00 0.00 0.00 0.00 19.45 19.04 2j55 n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j55 n GLY 69 N 1.24 -0.10 3.24 0.00 0.00 0.68 -4.94 105.19 105.31 2j55 n GLY 69 Ca -0.03 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 2j55 n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j55 s ARG 70 N -5.61 2.49 -0.17 1.61 3.52 -1.07 -4.77 118.95 114.96 2j55 s ARG 70 Ca 0.28 -0.86 -0.29 0.00 -0.13 0.00 0.00 55.73 54.73 2j55 s ARG 70 Cb -0.12 -2.09 -0.03 0.00 -1.56 0.00 0.00 34.95 31.15 2j55 s ARG 70 CO 0.51 0.34 1.48 0.08 -0.81 0.00 0.00 175.30 176.89 2j55 s VAL 71 N -0.07 3.90 -1.70 7.11 1.01 -1.26 -0.98 120.40 128.41 2j55 s VAL 71 Ca -0.05 1.06 0.19 0.00 0.00 0.00 0.00 61.98 63.17 2j55 s VAL 71 Cb -0.14 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2j55 s VAL 71 CO 0.04 -0.21 0.95 2.30 0.00 0.00 0.00 175.10 178.18 2j55 n ILE 72 N 5.83 0.00 -0.54 2.22 -5.35 0.35 -4.95 119.36 116.93 2j55 n ILE 72 Ca 0.16 -0.30 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 2j55 n ILE 72 Cb 0.45 1.22 0.00 0.00 -1.74 0.00 0.00 39.64 39.57 2j55 n ILE 72 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2j55 n GLY 73 N 1.26 -1.44 3.42 3.28 0.00 -1.09 -4.61 105.19 106.00 2j55 n GLY 73 Ca 0.08 -1.05 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 2j55 n GLY 73 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2j55 s MET 74 N -1.74 1.07 -0.04 1.61 -1.94 -1.26 -0.32 119.30 116.68 2j55 s MET 74 Ca 0.00 -0.19 0.00 0.00 -1.71 0.00 0.00 55.69 53.80 2j55 s MET 74 Cb 0.00 0.49 0.03 0.00 2.01 0.00 0.00 34.83 37.36 2j55 s MET 74 CO 0.00 -0.39 -0.01 0.42 -0.01 0.00 0.00 175.02 175.03 2j55 s ILE 75 N -2.41 0.33 0.36 2.53 -1.09 -0.42 -4.95 121.20 115.55 2j55 s ILE 75 Ca -0.05 0.03 -0.27 0.00 -2.23 0.00 0.00 60.65 58.13 2j55 s ILE 75 Cb -0.01 -0.42 -0.09 0.00 -1.58 0.00 0.00 42.46 40.36 2j55 s ILE 75 CO -0.01 0.20 1.19 -1.81 -1.23 0.00 0.00 174.94 173.27 2j55 s ASP 76 N 1.22 6.74 0.34 3.58 1.01 -1.26 -0.48 116.67 127.81 2j55 s ASP 76 Ca -0.07 2.41 0.06 0.00 0.71 0.00 0.00 52.55 55.66 2j55 s ASP 76 Cb -0.13 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.15 2j55 s ASP 76 CO -0.02 -0.53 0.20 0.61 0.21 0.00 0.00 175.17 175.65 2j55 n GLY 77 N 0.79 3.14 0.00 0.21 0.00 0.15 -4.92 105.19 104.56 2j55 n GLY 77 Ca 0.02 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.07 2j55 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j55 n GLY 78 N -0.58 1.85 3.60 -0.02 0.00 -1.26 -1.07 105.19 107.71 2j55 n GLY 78 Ca 0.02 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 2j55 n GLY 78 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2j55 s PHE 79 N 4.94 3.22 -1.31 1.61 5.36 0.25 -3.36 117.98 128.70 2j55 s PHE 79 Ca 0.00 0.60 -0.02 0.00 -0.96 0.00 0.00 56.93 56.55 2j55 s PHE 79 Cb 0.00 -2.95 -0.00 0.00 -0.34 0.00 0.00 43.02 39.73 2j55 s PHE 79 CO 0.00 -0.45 0.66 1.28 -1.46 0.00 0.00 175.22 175.25 2j55 n LEU 80 N 5.83 -2.99 -4.76 6.12 4.77 -1.26 -4.10 117.00 120.62 2j55 n LEU 80 Ca -0.01 -0.87 -0.31 0.00 -0.03 0.00 0.00 56.01 54.79 2j55 n LEU 80 Cb 0.49 -2.58 0.10 0.00 -2.33 0.00 0.00 43.42 39.10 2j55 n LEU 80 CO 0.45 0.41 0.70 -2.16 -1.33 0.00 0.00 177.39 175.45 2j55 s PRO 81 N -6.04 2.08 -0.32 3.23 0.05 -1.26 -4.83 135.00 127.92 2j55 s PRO 81 Ca 0.05 1.16 -0.07 0.00 0.05 0.00 0.00 61.00 62.19 2j55 s PRO 81 Cb -0.01 -1.88 0.02 0.00 0.05 0.00 0.00 34.50 32.68 2j55 s PRO 81 CO 0.83 -1.76 0.11 -0.80 0.05 0.00 0.00 177.00 175.42 2j55 s ASN 82 N -3.35 5.28 0.29 6.66 -0.87 0.14 -4.92 114.94 118.17 2j55 s ASN 82 Ca 0.62 -0.82 -0.10 0.00 -1.57 0.00 0.00 52.86 50.98 2j55 s ASN 82 Cb -0.18 -1.91 -0.07 0.00 -0.02 0.00 0.00 41.25 39.08 2j55 s ASN 82 CO 0.56 -0.25 0.63 -2.16 -2.57 0.00 0.00 177.10 173.32 2j55 s PRO 83 N 1.49 3.81 0.04 -0.60 0.04 -1.26 -1.57 135.00 136.95 2j55 s PRO 83 Ca 0.02 0.35 -0.00 0.00 0.04 0.00 0.00 61.00 61.41 2j55 s PRO 83 Cb -0.18 -2.55 -0.03 0.00 0.04 0.00 0.00 34.50 31.78 2j55 s PRO 83 CO 0.03 0.20 -0.04 0.14 0.04 0.00 0.00 177.00 177.38 2j55 s VAL 84 N -2.00 0.21 -0.06 -0.36 -7.23 -0.41 -4.96 120.40 105.60 2j55 s VAL 84 Ca 0.49 -1.34 0.00 0.00 -1.81 0.00 0.00 61.98 59.32 2j55 s VAL 84 Cb -0.11 -0.86 0.02 0.00 0.56 0.00 0.00 36.38 35.99 2j55 s VAL 84 CO 0.24 -0.71 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.59 2j55 s VAL 85 N -2.56 0.50 0.14 1.32 1.01 -1.26 -2.08 120.40 117.47 2j55 s VAL 85 Ca -0.05 -0.04 -0.32 0.00 0.00 0.00 0.00 61.98 61.56 2j55 s VAL 85 Cb -0.02 -0.57 -0.12 0.00 0.00 0.00 0.00 36.38 35.68 2j55 s VAL 85 CO -0.05 0.24 1.75 0.00 0.00 0.00 0.00 175.10 177.05 2j55 n ALA 86 N 4.45 2.08 -0.12 5.51 0.00 -0.61 -4.86 120.51 126.96 2j55 n ALA 86 Ca -0.19 0.36 0.20 0.00 0.00 0.00 0.00 53.44 53.82 2j55 n ALA 86 Cb 0.50 -2.51 0.61 0.00 0.00 0.00 0.00 19.45 18.05 2j55 n ALA 86 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2j55 h ASP 87 N 7.54 0.20 -0.18 0.00 3.32 -1.90 -1.87 116.42 123.53 2j55 h ASP 87 Ca -0.45 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2j55 h ASP 87 Cb 1.23 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2j55 h ASP 87 CO 0.94 0.09 0.00 -0.90 -1.72 0.00 0.00 179.24 177.65 2j55 n ASP 88 N -4.41 1.29 0.00 6.45 5.75 -1.26 -2.86 116.55 121.51 2j55 n ASP 88 Ca 0.14 -1.79 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 2j55 n ASP 88 Cb 0.65 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.62 2j55 n ASP 88 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2j55 n GLY 89 N 0.99 0.53 0.19 6.12 0.00 -0.70 -4.92 105.19 107.40 2j55 n GLY 89 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 2j55 n GLY 89 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2j55 h SER 90 N 0.00 0.00 -4.87 1.61 4.64 -1.91 -3.44 113.55 109.57 2j55 h SER 90 Ca 0.00 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.42 2j55 h SER 90 Cb 0.14 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.10 2j55 h SER 90 CO 0.00 0.14 0.44 0.72 -0.87 0.00 0.00 176.83 177.26 2j55 s PHE 91 N -3.15 -0.32 0.37 4.77 -0.12 -1.26 -4.51 117.98 113.75 2j55 s PHE 91 Ca 0.05 0.12 0.05 0.00 -0.05 0.00 0.00 56.93 57.10 2j55 s PHE 91 Cb 0.06 0.57 -0.07 0.00 -0.63 0.00 0.00 43.02 42.95 2j55 s PHE 91 CO 0.70 -0.69 0.04 0.96 -0.05 0.00 0.00 175.22 176.18 2j55 s ILE 92 N -3.29 1.57 0.05 -4.49 -4.36 -0.86 -1.57 121.20 108.26 2j55 s ILE 92 Ca 0.06 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.19 2j55 s ILE 92 Cb -0.01 -2.88 0.09 0.00 1.25 0.00 0.00 42.46 40.91 2j55 s ILE 92 CO -0.06 0.00 0.77 0.00 0.24 0.00 0.00 174.94 175.89 2j55 s ALA 93 N -3.01 -1.74 0.06 2.27 0.00 -0.88 -0.62 121.76 117.84 2j55 s ALA 93 Ca 0.35 0.85 -0.11 0.00 0.00 0.00 0.00 51.96 53.06 2j55 s ALA 93 Cb 0.09 0.53 0.01 0.00 0.00 0.00 0.00 23.12 23.75 2j55 s ALA 93 CO 0.17 -0.69 0.23 -3.38 0.00 0.00 0.00 175.76 172.09 2j55 s HIS 94 N -3.18 0.02 -0.16 0.00 -3.43 -0.33 -1.28 115.29 106.93 2j55 s HIS 94 Ca 0.02 -0.27 -0.16 0.00 -0.80 0.00 0.00 55.06 53.85 2j55 s HIS 94 Cb -0.01 0.01 -0.04 0.00 -1.43 0.00 0.00 32.58 31.11 2j55 s HIS 94 CO -0.09 -0.49 0.41 0.00 -2.00 0.00 0.00 174.74 172.57 2j55 s ALA 95 N -2.91 3.54 0.19 -1.38 0.00 -0.61 -0.98 121.76 119.61 2j55 s ALA 95 Ca -0.02 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 2j55 s ALA 95 Cb 0.00 -2.60 -0.04 0.00 0.00 0.00 0.00 23.12 20.49 2j55 s ALA 95 CO -0.06 -0.12 0.12 0.45 0.00 0.00 0.00 175.76 176.15 2j55 s SER 96 N 0.78 0.23 -0.07 0.00 0.15 0.12 -0.68 113.70 114.23 2j55 s SER 96 Ca 0.21 -1.36 -0.03 0.00 0.70 0.00 0.00 55.95 55.47 2j55 s SER 96 Cb -0.14 0.36 0.04 0.00 -1.71 0.00 0.00 66.02 64.56 2j55 s SER 96 CO 0.08 -0.82 0.15 -0.89 1.20 0.00 0.00 173.24 172.96 2j55 s THR 97 N -4.12 -0.10 0.28 6.45 2.01 -1.26 -1.63 115.64 117.27 2j55 s THR 97 Ca 0.37 0.22 0.07 0.00 0.31 0.00 0.00 61.69 62.66 2j55 s THR 97 Cb 0.07 -0.25 -0.06 0.00 0.01 0.00 0.00 72.50 72.27 2j55 s THR 97 CO 0.10 0.09 -0.08 0.68 -0.69 0.00 0.00 174.62 174.73 2j55 s VAL 98 N 1.44 1.76 0.02 3.82 -7.23 0.70 -0.58 120.40 120.33 2j55 s VAL 98 Ca -0.06 -2.16 0.06 0.00 -1.81 0.00 0.00 61.98 58.01 2j55 s VAL 98 Cb -0.12 -2.42 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 2j55 s VAL 98 CO -0.06 -0.33 -0.17 -0.36 -0.31 0.00 0.00 175.10 173.87 2j55 s PHE 99 N -2.94 1.54 0.39 2.82 0.40 -1.26 -0.35 117.98 118.58 2j55 s PHE 99 Ca 0.29 -0.33 0.25 0.00 -0.60 0.00 0.00 56.93 56.54 2j55 s PHE 99 Cb 0.03 -0.95 1.33 0.00 0.51 0.00 0.00 43.02 43.94 2j55 s PHE 99 CO 0.12 0.03 2.03 0.66 0.70 0.00 0.00 175.22 178.76 2j55 h SER 100 N 5.22 0.00 -2.10 1.36 4.64 -1.05 -3.25 113.55 118.37 2j55 h SER 100 Ca -0.39 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.36 2j55 h SER 100 Cb 1.16 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.85 2j55 h SER 100 CO 0.46 0.15 -0.86 0.54 -0.87 0.00 0.00 176.83 176.24 2j55 n ARG 101 N -3.68 1.72 0.00 4.77 5.12 0.58 -4.98 116.66 120.18 2j55 n ARG 101 Ca -0.02 -3.98 0.00 0.00 -1.93 0.00 0.00 57.85 51.92 2j55 n ARG 101 Cb 0.27 -1.78 0.00 0.00 -1.16 0.00 0.00 32.46 29.78 2j55 n ARG 101 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2j55 n ILE 102 N 0.92 0.00 -0.07 0.55 -0.00 -1.23 -2.37 119.36 117.16 2j55 n ILE 102 Ca 0.26 0.00 0.01 0.00 -0.00 0.00 0.00 62.75 63.02 2j55 n ILE 102 Cb 0.48 0.00 0.01 0.00 -0.00 0.00 0.00 39.64 40.13 2j55 n ILE 102 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2j55 n ALA 103 N 2.22 2.00 -3.96 -1.39 0.00 -1.26 -4.19 120.51 113.92 2j55 n ALA 103 Ca 0.00 -1.08 -0.14 0.00 0.00 0.00 0.00 53.44 52.22 2j55 n ALA 103 Cb 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.39 2j55 n ALA 103 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2j55 n ARG 104 N -0.54 0.55 0.00 0.00 1.85 -1.00 -5.03 116.66 112.49 2j55 n ARG 104 Ca 0.01 -2.57 0.00 0.00 -1.00 0.00 0.00 57.85 54.29 2j55 n ARG 104 Cb 0.27 2.37 0.00 0.00 -1.05 0.00 0.00 32.46 34.06 2j55 n ARG 104 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2j55 n GLY 105 N -0.52 -1.82 3.74 2.89 0.00 -1.26 -0.30 105.19 107.91 2j55 n GLY 105 Ca 0.02 -1.77 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2j55 n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j55 s GLU 106 N 0.00 4.21 -0.04 1.61 2.12 -1.26 -4.61 118.70 120.73 2j55 s GLU 106 Ca 0.00 2.40 -0.19 0.00 0.36 0.00 0.00 54.97 57.54 2j55 s GLU 106 Cb 0.00 -3.09 -0.05 0.00 0.26 0.00 0.00 34.13 31.25 2j55 s GLU 106 CO 0.00 -0.51 0.54 0.50 -0.54 0.00 0.00 175.26 175.25 2j55 s ARG 107 N -0.21 4.28 -0.12 4.30 3.52 -1.26 -0.90 118.95 128.56 2j55 s ARG 107 Ca 0.62 0.62 0.01 0.00 -0.13 0.00 0.00 55.73 56.84 2j55 s ARG 107 Cb -0.44 -3.36 0.02 0.00 -1.56 0.00 0.00 34.95 29.61 2j55 s ARG 107 CO 0.43 0.33 -0.12 0.99 -0.81 0.00 0.00 175.30 176.12 2j55 s THR 108 N -0.01 1.35 -0.04 4.11 2.01 0.52 -4.89 115.64 118.68 2j55 s THR 108 Ca 0.29 -0.52 -0.07 0.00 0.31 0.00 0.00 61.69 61.70 2j55 s THR 108 Cb -0.17 -1.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 2j55 s THR 108 CO 0.15 0.42 0.22 -1.81 -0.69 0.00 0.00 174.62 172.90 2j55 s ASP 109 N 1.32 6.46 0.04 3.53 1.11 -1.26 -0.21 116.67 127.66 2j55 s ASP 109 Ca -0.00 0.52 -0.27 0.00 0.18 0.00 0.00 52.55 52.98 2j55 s ASP 109 Cb -0.14 -2.08 0.07 0.00 1.07 0.00 0.00 42.92 41.84 2j55 s ASP 109 CO -0.06 0.31 0.62 -0.72 1.18 0.00 0.00 175.17 176.51 2j55 s TYR 110 N -1.20 -0.57 -0.14 4.23 1.13 -0.65 -0.85 117.35 119.29 2j55 s TYR 110 Ca 0.23 0.73 -0.05 0.00 -1.41 0.00 0.00 57.07 56.57 2j55 s TYR 110 Cb -0.13 0.45 -0.04 0.00 -1.10 0.00 0.00 41.96 41.15 2j55 s TYR 110 CO 0.12 -0.70 0.02 0.08 -2.51 0.00 0.00 175.55 172.57 2j55 s VAL 111 N -2.32 4.47 -0.06 -3.49 1.01 0.89 -0.70 120.40 120.19 2j55 s VAL 111 Ca -0.06 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 61.80 2j55 s VAL 111 Cb -0.00 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 2j55 s VAL 111 CO -0.00 0.52 -0.19 -1.61 0.00 0.00 0.00 175.10 173.82 2j55 s GLU 112 N -0.08 2.65 -0.03 2.72 2.02 -0.15 0.13 118.70 125.95 2j55 s GLU 112 Ca 0.05 -0.79 0.03 0.00 0.02 0.00 0.00 54.97 54.28 2j55 s GLU 112 Cb -0.12 -2.32 -0.03 0.00 0.10 0.00 0.00 34.13 31.75 2j55 s GLU 112 CO 0.02 0.46 -0.10 0.08 0.02 0.00 0.00 175.26 175.74 2j55 s VAL 113 N -0.32 3.44 -0.01 2.63 1.01 -0.78 -1.18 120.40 125.18 2j55 s VAL 113 Ca 0.02 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.35 2j55 s VAL 113 Cb -0.13 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 2j55 s VAL 113 CO 0.02 0.51 -0.15 -0.36 0.00 0.00 0.00 175.10 175.13 2j55 s PHE 114 N -0.85 1.31 0.07 5.22 0.08 0.21 -0.13 117.98 123.89 2j55 s PHE 114 Ca 0.14 -0.25 -0.31 0.00 0.12 0.00 0.00 56.93 56.63 2j55 s PHE 114 Cb -0.11 -0.84 -0.09 0.00 -0.57 0.00 0.00 43.02 41.41 2j55 s PHE 114 CO 0.03 -0.03 1.68 0.34 -0.10 0.00 0.00 175.22 177.15 2j55 s ASP 115 N -0.33 6.58 0.00 1.36 -1.08 -0.22 -2.02 116.67 120.96 2j55 s ASP 115 Ca 0.05 2.52 0.30 0.00 -0.52 0.00 0.00 52.55 54.90 2j55 s ASP 115 Cb -0.06 -2.56 1.53 0.00 -1.46 0.00 0.00 42.92 40.37 2j55 s ASP 115 CO -0.01 -0.90 2.04 -0.81 0.52 0.00 0.00 175.17 176.01 2j55 n PRO 116 N 5.65 0.48 -0.10 4.34 -0.04 -1.26 -0.20 135.00 143.86 2j55 n PRO 116 Ca 0.16 0.01 -0.18 0.00 -0.04 0.00 0.00 63.50 63.45 2j55 n PRO 116 Cb 0.40 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.28 2j55 n PRO 116 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2j55 n VAL 117 N -1.25 1.16 0.33 0.52 0.24 -1.26 -4.65 118.33 113.41 2j55 n VAL 117 Ca 0.15 -0.38 0.12 0.00 -2.04 0.00 0.00 64.34 62.19 2j55 n VAL 117 Cb 0.22 -1.44 0.18 0.00 -1.47 0.00 0.00 33.84 31.33 2j55 n VAL 117 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2j55 h THR 118 N -0.31 0.00 -0.47 3.34 1.35 -1.89 -0.17 112.91 114.76 2j55 h THR 118 Ca -0.49 -0.82 -0.20 0.00 -0.55 0.00 0.00 66.41 64.35 2j55 h THR 118 Cb 1.61 1.65 -0.08 0.00 -1.73 0.00 0.00 68.15 69.60 2j55 h THR 118 CO -0.17 0.00 -0.18 0.18 -0.25 0.00 0.00 175.52 175.09 2j55 n LEU 119 N -2.70 -0.20 -4.75 3.87 4.77 0.71 -4.94 117.00 113.77 2j55 n LEU 119 Ca 0.03 0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.85 2j55 n LEU 119 Cb 0.50 -2.65 -0.05 0.00 -2.33 0.00 0.00 43.42 38.89 2j55 n LEU 119 CO 0.35 -1.03 0.74 -0.76 -1.33 0.00 0.00 177.39 175.36 2j55 s LEU 120 N -2.24 4.58 0.23 2.23 1.43 -1.25 -4.71 118.68 118.95 2j55 s LEU 120 Ca 0.00 2.13 -0.30 0.00 -1.03 0.00 0.00 54.13 54.93 2j55 s LEU 120 Cb 0.00 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.50 2j55 s LEU 120 CO 0.00 -0.04 1.49 -2.16 0.23 0.00 0.00 176.35 175.87 2j55 s PRO 121 N -1.23 4.24 -0.01 1.29 0.04 -1.26 -1.05 135.00 137.02 2j55 s PRO 121 Ca 0.44 2.34 0.10 0.00 0.04 0.00 0.00 61.00 63.92 2j55 s PRO 121 Cb -0.29 -3.12 -0.13 0.00 0.04 0.00 0.00 34.50 31.00 2j55 s PRO 121 CO 0.37 -0.49 0.35 0.25 0.04 0.00 0.00 177.00 177.52 2j55 n THR 122 N 2.79 0.00 -3.79 1.26 -2.24 0.82 -4.89 114.28 108.23 2j55 n THR 122 Ca 0.09 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.50 2j55 n THR 122 Cb 0.39 0.73 -0.08 0.00 -2.10 0.00 0.00 70.33 69.28 2j55 n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j55 s ALA 123 N -2.23 -0.57 -0.26 6.98 0.00 -1.17 -4.96 121.76 119.54 2j55 s ALA 123 Ca 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 51.96 51.89 2j55 s ALA 123 Cb 0.07 0.28 0.13 0.00 0.00 0.00 0.00 23.12 23.60 2j55 s ALA 123 CO 0.42 -0.37 0.30 0.34 0.00 0.00 0.00 175.76 176.45 2j55 s ASP 124 N -1.98 1.21 -0.23 0.00 -1.08 -1.25 -1.87 116.67 111.47 2j55 s ASP 124 Ca -0.06 -0.39 -0.01 0.00 -0.52 0.00 0.00 52.55 51.57 2j55 s ASP 124 Cb -0.02 0.65 0.02 0.00 -1.46 0.00 0.00 42.92 42.11 2j55 s ASP 124 CO -0.03 -0.35 -0.09 -0.63 0.52 0.00 0.00 175.17 174.59 2j55 s ILE 125 N 2.40 2.75 0.32 4.11 1.01 0.35 -4.94 121.20 127.20 2j55 s ILE 125 Ca 0.09 -0.96 -0.27 0.00 0.00 0.00 0.00 60.65 59.51 2j55 s ILE 125 Cb -0.15 -2.34 -0.09 0.00 0.01 0.00 0.00 42.46 39.89 2j55 s ILE 125 CO -0.24 0.29 1.05 -0.70 0.00 0.00 0.00 174.94 175.34 2j55 s GLU 126 N 1.33 4.51 -0.25 2.79 2.12 -1.26 -0.08 118.70 127.85 2j55 s GLU 126 Ca 0.01 1.63 -0.08 0.00 0.36 0.00 0.00 54.97 56.90 2j55 s GLU 126 Cb -0.16 -2.95 -0.03 0.00 0.26 0.00 0.00 34.13 31.25 2j55 s GLU 126 CO -0.06 0.14 0.09 -0.51 -0.54 0.00 0.00 175.26 174.38 2j55 s LEU 127 N -1.86 3.53 0.43 2.70 1.43 -0.03 -4.58 118.68 120.29 2j55 s LEU 127 Ca 0.49 -0.20 -0.26 0.00 -1.03 0.00 0.00 54.13 53.14 2j55 s LEU 127 Cb -0.27 -1.95 -0.09 0.00 0.03 0.00 0.00 46.19 43.92 2j55 s LEU 127 CO 0.34 -0.04 1.38 -2.84 0.23 0.00 0.00 176.35 175.42 2j55 s PRO 128 N 1.63 3.83 -1.05 1.29 0.02 -1.26 -3.66 135.00 135.80 2j55 s PRO 128 Ca 0.06 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.40 2j55 s PRO 128 Cb -0.15 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.65 2j55 s PRO 128 CO 0.05 -0.66 0.00 -0.25 -0.33 0.00 0.00 177.00 175.80 2j55 n ASP 129 N -0.02 -4.06 -3.77 2.53 8.00 -1.26 -3.96 116.55 114.01 2j55 n ASP 129 Ca 0.04 0.19 -0.31 0.00 0.71 0.00 0.00 54.79 55.43 2j55 n ASP 129 Cb 0.42 -2.67 0.03 0.00 -0.02 0.00 0.00 41.12 38.88 2j55 n ASP 129 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j55 n ALA 130 N 0.55 -2.42 1.36 2.24 0.00 -1.24 -4.91 120.51 116.10 2j55 n ALA 130 Ca -0.11 -0.27 0.14 0.00 0.00 0.00 0.00 53.44 53.20 2j55 n ALA 130 Cb 0.40 -3.36 0.56 0.00 0.00 0.00 0.00 19.45 17.05 2j55 n ALA 130 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2j55 n PRO 131 N -4.30 0.70 -2.03 0.00 -0.04 -1.25 -4.95 135.00 123.12 2j55 n PRO 131 Ca -0.15 -0.28 -0.36 0.00 -0.04 0.00 0.00 63.50 62.68 2j55 n PRO 131 Cb 0.61 -1.49 0.03 0.00 -0.04 0.00 0.00 33.50 32.61 2j55 n PRO 131 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2j55 s ARG 132 N -2.49 3.00 -0.42 0.54 0.52 -1.26 -4.23 118.95 114.60 2j55 s ARG 132 Ca 0.27 1.80 -0.19 0.00 -0.52 0.00 0.00 55.73 57.09 2j55 s ARG 132 Cb 0.20 -1.94 0.02 0.00 0.52 0.00 0.00 34.95 33.75 2j55 s ARG 132 CO 0.49 -1.17 0.54 0.12 0.02 0.00 0.00 175.30 175.29 2j55 s PHE 133 N -1.63 3.12 -0.74 -0.53 5.36 -1.17 -4.83 117.98 117.56 2j55 s PHE 133 Ca 0.77 -0.20 -0.27 0.00 -0.96 0.00 0.00 56.93 56.28 2j55 s PHE 133 Cb -0.29 -3.10 0.02 0.00 -0.34 0.00 0.00 43.02 39.30 2j55 s PHE 133 CO 0.33 -0.77 1.42 -0.51 -1.46 0.00 0.00 175.22 174.23 2j55 s LEU 134 N 2.46 3.21 0.02 6.12 1.43 -1.26 -4.96 118.68 125.70 2j55 s LEU 134 Ca 0.17 -0.38 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 2j55 s LEU 134 Cb -0.16 -2.55 -0.00 0.00 0.03 0.00 0.00 46.19 43.51 2j55 s LEU 134 CO 0.16 -1.94 0.13 0.54 0.23 0.00 0.00 176.35 175.47 2j55 s VAL 135 N 6.44 0.10 0.39 -1.59 0.11 -1.26 -5.15 120.40 119.44 2j55 s VAL 135 Ca 0.43 -0.84 -0.24 0.00 -2.93 0.00 0.00 61.98 58.40 2j55 s VAL 135 Cb -0.08 -0.61 -0.13 0.00 -1.53 0.00 0.00 36.38 34.03 2j55 s VAL 135 CO 0.14 -0.46 0.70 0.61 -3.33 0.00 0.00 175.10 172.75 2j55 n GLY 136 N 1.17 -1.09 3.67 6.54 0.00 -1.26 -4.72 105.19 109.49 2j55 n GLY 136 Ca -0.21 0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 2j55 n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j55 s THR 137 N -1.34 4.44 -0.26 2.61 2.01 -1.26 -4.98 115.64 116.85 2j55 s THR 137 Ca 0.63 1.74 -0.02 0.00 0.31 0.00 0.00 61.69 64.35 2j55 s THR 137 Cb -0.63 -4.12 0.03 0.00 0.01 0.00 0.00 72.50 67.79 2j55 s THR 137 CO 0.58 -0.11 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.05 2j55 s TYR 138 N 3.03 3.13 0.30 4.92 2.02 -1.26 -4.97 117.35 124.51 2j55 s TYR 138 Ca 0.51 -1.64 0.06 0.00 -0.37 0.00 0.00 57.07 55.64 2j55 s TYR 138 Cb -0.20 -2.07 0.82 0.00 -0.40 0.00 0.00 41.96 40.10 2j55 s TYR 138 CO 0.14 -0.75 1.67 -1.35 -1.57 0.00 0.00 175.55 173.70 2j55 h PRO 139 N 8.01 0.32 -0.74 -1.71 0.11 -1.93 -2.51 132.00 133.56 2j55 h PRO 139 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2j55 h PRO 139 Cb 1.09 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2j55 h PRO 139 CO 0.56 0.21 0.00 0.91 -0.21 0.00 0.00 178.00 179.48 2j55 n TRP 140 N -5.09 0.94 1.07 0.65 7.02 -1.26 -3.12 117.44 117.64 2j55 n TRP 140 Ca 0.24 -0.33 0.12 0.00 -1.02 0.00 0.00 57.50 56.52 2j55 n TRP 140 Cb 0.75 -0.26 0.33 0.00 -2.42 0.00 0.00 31.31 29.71 2j55 n TRP 140 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2j55 n MET 141 N 0.33 0.19 -3.74 -0.99 2.81 -0.94 -0.56 117.12 114.22 2j55 n MET 141 Ca 0.13 -0.10 -0.14 0.00 -1.81 0.00 0.00 57.70 55.78 2j55 n MET 141 Cb 0.65 -1.50 -0.14 0.00 -0.71 0.00 0.00 33.22 31.52 2j55 n MET 141 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2j55 s THR 142 N -2.88 -0.07 -0.09 2.03 2.01 -1.18 -1.81 115.64 113.65 2j55 s THR 142 Ca 0.15 0.20 -0.12 0.00 0.31 0.00 0.00 61.69 62.23 2j55 s THR 142 Cb 0.18 -0.25 0.03 0.00 0.01 0.00 0.00 72.50 72.47 2j55 s THR 142 CO 0.64 0.08 0.31 -0.44 -0.69 0.00 0.00 174.62 174.52 2j55 s SER 143 N 1.28 -0.28 0.24 3.53 0.01 0.97 -4.87 113.70 114.58 2j55 s SER 143 Ca -0.08 0.47 -0.23 0.00 1.31 0.00 0.00 55.95 57.42 2j55 s SER 143 Cb -0.12 0.55 -0.09 0.00 0.21 0.00 0.00 66.02 66.57 2j55 s SER 143 CO -0.06 -0.21 0.80 -0.76 0.41 0.00 0.00 173.24 173.42 2j55 s LEU 144 N -0.27 4.39 0.74 2.44 1.43 -1.26 -0.37 118.68 125.78 2j55 s LEU 144 Ca -0.04 1.58 -0.13 0.00 -1.03 0.00 0.00 54.13 54.51 2j55 s LEU 144 Cb -0.03 -3.65 0.04 0.00 0.03 0.00 0.00 46.19 42.58 2j55 s LEU 144 CO 0.01 0.04 1.13 0.42 0.23 0.00 0.00 176.35 178.18 2j55 s THR 145 N -1.47 2.93 0.60 5.49 -4.23 -0.67 -4.65 115.64 113.64 2j55 s THR 145 Ca 0.44 0.38 0.36 0.00 -1.18 0.00 0.00 61.69 61.69 2j55 s THR 145 Cb -0.19 -2.83 0.39 0.00 1.34 0.00 0.00 72.50 71.21 2j55 s THR 145 CO 0.23 -0.32 2.29 -0.65 -0.54 0.00 0.00 174.62 175.63 2j55 h PRO 146 N -0.62 0.00 -0.12 3.99 0.11 -1.87 0.04 132.00 133.52 2j55 h PRO 146 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2j55 h PRO 146 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2j55 h PRO 146 CO 0.51 0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 2j55 n ASP 147 N -3.48 1.64 0.00 -2.05 5.68 -1.26 -4.95 116.55 112.13 2j55 n ASP 147 Ca -0.03 -1.65 0.00 0.00 -0.50 0.00 0.00 54.79 52.61 2j55 n ASP 147 Cb 0.09 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 2j55 n ASP 147 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2j55 n GLY 148 N 1.15 0.26 0.06 6.12 0.00 -0.00 -4.87 105.19 107.90 2j55 n GLY 148 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 2j55 n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2j55 n LYS 149 N -1.39 0.16 -4.23 1.61 5.02 -1.26 -4.76 118.16 113.31 2j55 n LYS 149 Ca 0.00 0.11 -0.17 0.00 -2.02 0.00 0.00 58.31 56.24 2j55 n LYS 149 Cb 0.12 -1.67 -0.14 0.00 -0.02 0.00 0.00 35.03 33.31 2j55 n LYS 149 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2j55 s THR 150 N -3.07 0.51 -0.02 -0.18 2.01 -1.26 -0.21 115.64 113.42 2j55 s THR 150 Ca 0.11 -0.28 0.07 0.00 0.31 0.00 0.00 61.69 61.90 2j55 s THR 150 Cb 0.15 -0.43 -0.02 0.00 0.01 0.00 0.00 72.50 72.20 2j55 s THR 150 CO 0.60 0.14 -0.23 -0.22 -0.69 0.00 0.00 174.62 174.22 2j55 s LEU 151 N -0.16 2.25 -0.08 4.42 0.20 -0.21 -1.66 118.68 123.44 2j55 s LEU 151 Ca 0.02 -0.42 0.04 0.00 0.69 0.00 0.00 54.13 54.47 2j55 s LEU 151 Cb -0.03 -1.39 -0.00 0.00 -0.43 0.00 0.00 46.19 44.34 2j55 s LEU 151 CO -0.00 0.31 -0.22 -0.76 -0.29 0.00 0.00 176.35 175.39 2j55 s LEU 152 N -0.76 2.02 0.06 -0.68 1.43 0.50 -0.32 118.68 120.93 2j55 s LEU 152 Ca 0.11 -0.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2j55 s LEU 152 Cb -0.10 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.79 2j55 s LEU 152 CO 0.00 0.16 -0.11 0.72 0.23 0.00 0.00 176.35 177.35 2j55 s PHE 153 N 0.26 0.93 0.00 0.29 -0.71 -0.98 -0.02 117.98 117.75 2j55 s PHE 153 Ca -0.14 -0.49 -0.18 0.00 -1.04 0.00 0.00 56.93 55.08 2j55 s PHE 153 Cb -0.16 -0.53 -0.06 0.00 -1.21 0.00 0.00 43.02 41.05 2j55 s PHE 153 CO 0.07 -0.02 0.52 -0.47 -1.34 0.00 0.00 175.22 173.98 2j55 s TYR 154 N -1.38 3.71 -0.14 3.49 5.04 -0.75 -1.02 117.35 126.30 2j55 s TYR 154 Ca -0.06 1.12 -0.03 0.00 -2.44 0.00 0.00 57.07 55.66 2j55 s TYR 154 Cb -0.10 -2.48 -0.03 0.00 0.35 0.00 0.00 41.96 39.70 2j55 s TYR 154 CO 0.01 0.48 -0.02 -1.14 -1.34 0.00 0.00 175.55 173.53 2j55 s GLN 155 N -0.59 3.53 -0.23 4.97 0.74 -0.02 -3.04 119.66 125.03 2j55 s GLN 155 Ca 0.28 -0.49 -0.10 0.00 0.05 0.00 0.00 55.36 55.10 2j55 s GLN 155 Cb -0.18 -2.90 -0.18 0.00 1.10 0.00 0.00 33.01 30.85 2j55 s GLN 155 CO 0.16 0.35 -0.05 0.34 -0.55 0.00 0.00 175.29 175.54 2j55 n PHE 156 N 3.21 0.50 -4.71 1.67 7.35 -1.26 -2.46 117.46 121.76 2j55 n PHE 156 Ca -0.17 0.16 -0.29 0.00 -0.76 0.00 0.00 57.45 56.38 2j55 n PHE 156 Cb 0.53 -1.06 -0.14 0.00 0.35 0.00 0.00 39.48 39.16 2j55 n PHE 156 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2j55 s SER 157 N -7.01 3.06 0.21 -2.13 0.15 -1.26 -3.51 113.70 103.20 2j55 s SER 157 Ca -0.32 -0.62 0.26 0.00 0.70 0.00 0.00 55.95 55.96 2j55 s SER 157 Cb 0.10 -0.25 0.85 0.00 -1.71 0.00 0.00 66.02 65.00 2j55 s SER 157 CO 0.60 0.21 1.78 -0.81 1.20 0.00 0.00 173.24 176.22 2j55 n PRO 158 N 1.54 0.24 -3.95 5.44 -0.04 -1.26 -4.95 135.00 132.02 2j55 n PRO 158 Ca -0.17 0.23 -0.09 0.00 -0.04 0.00 0.00 63.50 63.42 2j55 n PRO 158 Cb 0.52 -1.80 -0.10 0.00 -0.04 0.00 0.00 33.50 32.09 2j55 n PRO 158 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2j55 s ALA 159 N -3.12 -0.00 0.23 0.55 0.00 -1.25 -5.14 121.76 113.03 2j55 s ALA 159 Ca 0.10 -0.55 -0.32 0.00 0.00 0.00 0.00 51.96 51.19 2j55 s ALA 159 Cb 0.12 0.20 -0.13 0.00 0.00 0.00 0.00 23.12 23.31 2j55 s ALA 159 CO 0.57 -0.26 1.56 -0.35 0.00 0.00 0.00 175.76 177.28 2j55 n PRO 160 N 1.06 2.40 -3.54 0.00 -0.04 -1.23 -4.41 135.00 129.25 2j55 n PRO 160 Ca -0.21 0.86 -0.10 0.00 -0.04 0.00 0.00 63.50 64.02 2j55 n PRO 160 Cb 0.57 -2.62 -0.02 0.00 -0.04 0.00 0.00 33.50 31.40 2j55 n PRO 160 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2j55 s ALA 161 N 0.41 -1.60 -0.16 0.55 0.00 -1.03 -3.16 121.76 116.78 2j55 s ALA 161 Ca 0.71 0.46 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2j55 s ALA 161 Cb -0.58 0.75 0.03 0.00 0.00 0.00 0.00 23.12 23.32 2j55 s ALA 161 CO 0.43 -0.82 -0.12 0.08 0.00 0.00 0.00 175.76 175.34 2j55 s VAL 162 N -3.59 1.52 0.22 0.00 1.01 -0.41 -0.84 120.40 118.32 2j55 s VAL 162 Ca 0.04 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 2j55 s VAL 162 Cb -0.02 -1.51 -0.08 0.00 0.00 0.00 0.00 36.38 34.77 2j55 s VAL 162 CO -0.08 0.34 1.08 -0.83 0.00 0.00 0.00 175.10 175.61 2j55 s GLY 163 N 1.49 2.95 -0.22 4.51 0.00 -0.19 -0.88 107.32 114.98 2j55 s GLY 163 Ca 0.03 0.82 -0.06 0.00 0.00 0.00 0.00 44.72 45.51 2j55 s GLY 163 CO -0.10 1.56 0.03 0.14 0.00 0.00 0.00 173.10 174.73 2j55 s VAL 164 N -0.64 4.14 -0.19 1.40 1.01 -0.23 -2.32 120.40 123.58 2j55 s VAL 164 Ca 0.47 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 2j55 s VAL 164 Cb -0.30 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.19 2j55 s VAL 164 CO 0.37 0.40 -0.14 -0.69 0.00 0.00 0.00 175.10 175.03 2j55 s VAL 165 N 1.19 2.57 -0.59 2.92 1.01 0.57 -0.26 120.40 127.80 2j55 s VAL 165 Ca 0.04 -0.77 -0.26 0.00 0.00 0.00 0.00 61.98 60.99 2j55 s VAL 165 Cb -0.14 -2.11 0.04 0.00 0.00 0.00 0.00 36.38 34.16 2j55 s VAL 165 CO 0.02 0.50 1.06 -0.62 0.00 0.00 0.00 175.10 176.06 2j55 s ASP 166 N 1.24 6.34 0.11 3.32 2.15 0.06 -1.04 116.67 128.85 2j55 s ASP 166 Ca 0.03 -0.28 -0.12 0.00 0.43 0.00 0.00 52.55 52.61 2j55 s ASP 166 Cb -0.14 -2.49 -0.13 0.00 -0.30 0.00 0.00 42.92 39.87 2j55 s ASP 166 CO -0.07 -1.40 1.34 -0.07 -0.17 0.00 0.00 175.17 174.80 2j55 h LEU 167 N 11.56 0.96 -0.82 -1.34 3.38 -0.87 -0.42 115.31 127.76 2j55 h LEU 167 Ca -0.26 -0.59 0.02 0.00 0.09 0.00 0.00 57.88 57.14 2j55 h LEU 167 Cb 1.06 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 2j55 h LEU 167 CO 1.15 1.39 0.53 -0.08 0.09 0.00 0.00 178.44 181.53 2j55 h GLU 168 N 0.59 1.02 -0.38 1.13 4.81 -1.78 -2.73 114.58 117.24 2j55 h GLU 168 Ca -0.03 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2j55 h GLU 168 Cb 1.32 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2j55 h GLU 168 CO 0.15 0.68 0.00 0.41 -0.73 0.00 0.00 179.01 179.51 2j55 n GLY 169 N -1.32 1.68 3.78 1.92 0.00 -1.21 -4.97 105.19 105.06 2j55 n GLY 169 Ca 0.09 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 2j55 n GLY 169 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2j55 n LYS 170 N 1.46 -4.46 -3.82 1.61 5.02 -0.44 -4.99 118.16 112.55 2j55 n LYS 170 Ca 0.19 0.56 -0.12 0.00 -2.02 0.00 0.00 58.31 56.92 2j55 n LYS 170 Cb 0.60 -5.00 -0.12 0.00 -0.02 0.00 0.00 35.03 30.49 2j55 n LYS 170 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j55 s ALA 171 N -3.75 -0.40 0.29 7.82 0.00 -0.30 -4.91 121.76 120.51 2j55 s ALA 171 Ca 0.01 0.46 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 2j55 s ALA 171 Cb -0.01 -0.27 -0.10 0.00 0.00 0.00 0.00 23.12 22.74 2j55 s ALA 171 CO 0.83 -0.08 1.45 0.12 0.00 0.00 0.00 175.76 178.09 2j55 s PHE 172 N 0.10 2.92 -0.04 0.00 5.36 -1.26 -0.76 117.98 124.30 2j55 s PHE 172 Ca -0.00 1.07 -0.04 0.00 -0.96 0.00 0.00 56.93 57.00 2j55 s PHE 172 Cb -0.01 -3.86 -0.01 0.00 -0.34 0.00 0.00 43.02 38.79 2j55 s PHE 172 CO 0.00 -2.73 -0.08 1.63 -1.46 0.00 0.00 175.22 172.59 2j55 n LYS 173 N 1.80 0.13 -3.59 10.12 4.76 0.64 -4.84 118.16 127.17 2j55 n LYS 173 Ca 0.05 0.12 -0.05 0.00 -2.87 0.00 0.00 58.31 55.56 2j55 n LYS 173 Cb 0.40 -0.79 -0.03 0.00 -1.84 0.00 0.00 35.03 32.77 2j55 n LYS 173 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2j55 s ARG 174 N -1.44 0.34 -0.07 1.97 1.70 -1.20 -5.01 118.95 115.24 2j55 s ARG 174 Ca -0.06 -0.07 -0.23 0.00 -0.47 0.00 0.00 55.73 54.90 2j55 s ARG 174 Cb 0.01 0.16 -0.04 0.00 -0.57 0.00 0.00 34.95 34.51 2j55 s ARG 174 CO 0.10 -0.14 0.66 -1.64 -1.08 0.00 0.00 175.30 173.20 2j55 s MET 175 N -2.03 4.42 -0.13 3.89 -1.94 -1.26 -1.07 119.30 121.18 2j55 s MET 175 Ca 0.07 0.81 -0.15 0.00 -1.71 0.00 0.00 55.69 54.72 2j55 s MET 175 Cb -0.01 -3.44 -0.05 0.00 2.01 0.00 0.00 34.83 33.35 2j55 s MET 175 CO -0.05 0.09 0.34 -0.51 -0.01 0.00 0.00 175.02 174.89 2j55 s LEU 176 N 0.72 4.28 0.22 -0.03 1.43 -0.06 -4.94 118.68 120.30 2j55 s LEU 176 Ca 0.36 0.63 -0.30 0.00 -1.03 0.00 0.00 54.13 53.78 2j55 s LEU 176 Cb -0.17 -2.46 -0.09 0.00 0.03 0.00 0.00 46.19 43.50 2j55 s LEU 176 CO 0.17 0.11 1.04 -1.81 0.23 0.00 0.00 176.35 176.09 2j55 s ASP 177 N 0.30 7.40 0.20 2.29 1.01 -1.26 -1.29 116.67 125.33 2j55 s ASP 177 Ca 0.19 2.08 -0.01 0.00 0.71 0.00 0.00 52.55 55.53 2j55 s ASP 177 Cb -0.14 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.14 2j55 s ASP 177 CO 0.06 -0.07 0.12 0.68 0.21 0.00 0.00 175.17 176.17 2j55 s VAL 178 N -0.81 0.12 0.88 -1.27 -7.23 -1.19 -4.67 120.40 106.23 2j55 s VAL 178 Ca 0.45 -1.99 -0.15 0.00 -1.81 0.00 0.00 61.98 58.48 2j55 s VAL 178 Cb -0.29 -2.47 0.22 0.00 0.56 0.00 0.00 36.38 34.40 2j55 s VAL 178 CO 0.36 -0.05 0.70 -2.65 -0.31 0.00 0.00 175.10 173.14 2j55 n PRO 179 N -0.29 -2.89 -1.53 4.82 -0.02 -1.26 -4.68 135.00 129.15 2j55 n PRO 179 Ca 0.01 -1.13 -0.42 0.00 -2.02 0.00 0.00 63.50 59.94 2j55 n PRO 179 Cb 0.66 -1.16 -0.02 0.00 -0.02 0.00 0.00 33.50 32.96 2j55 n PRO 179 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2j55 n ASP 180 N -4.45 3.50 -4.43 2.55 8.00 -1.26 -4.83 116.55 115.63 2j55 n ASP 180 Ca 0.10 -2.78 -0.21 0.00 0.71 0.00 0.00 54.79 52.61 2j55 n ASP 180 Cb 0.40 -1.48 -0.10 0.00 -0.02 0.00 0.00 41.12 39.92 2j55 n ASP 180 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j55 s TYR 182 N -3.19 -0.41 0.18 0.00 1.51 0.28 -4.90 117.35 110.82 2j55 s TYR 182 Ca 0.33 0.98 0.00 0.00 -1.01 0.00 0.00 57.07 57.37 2j55 s TYR 182 Cb 0.06 0.14 0.00 0.00 -0.11 0.00 0.00 41.96 42.06 2j55 s TYR 182 CO 0.13 -0.20 0.00 0.72 -1.11 0.00 0.00 175.55 175.09 2j55 n HIS 183 N 2.99 -1.09 -3.63 2.71 8.25 -1.26 -0.81 115.22 122.37 2j55 n HIS 183 Ca -0.14 0.60 -0.19 0.00 -0.26 0.00 0.00 57.72 57.74 2j55 n HIS 183 Cb 0.57 -1.00 -0.16 0.00 1.12 0.00 0.00 29.99 30.53 2j55 n HIS 183 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2j55 s ILE 184 N -3.35 -0.23 -0.50 1.59 1.01 0.27 -4.11 121.20 115.88 2j55 s ILE 184 Ca 0.00 0.24 0.03 0.00 0.00 0.00 0.00 60.65 60.92 2j55 s ILE 184 Cb 0.00 -0.36 0.13 0.00 0.01 0.00 0.00 42.46 42.24 2j55 s ILE 184 CO 0.00 0.05 0.27 -0.36 0.00 0.00 0.00 174.94 174.90 2j55 s PHE 185 N 2.26 2.76 0.37 3.97 0.08 0.65 -4.75 117.98 123.32 2j55 s PHE 185 Ca 0.04 -2.91 -0.27 0.00 0.12 0.00 0.00 56.93 53.91 2j55 s PHE 185 Cb -0.13 -2.47 -0.09 0.00 -0.57 0.00 0.00 43.02 39.76 2j55 s PHE 185 CO -0.07 -0.75 1.21 -2.14 -0.10 0.00 0.00 175.22 173.38 2j55 s PRO 186 N -0.12 4.18 0.00 0.24 0.02 -1.26 -1.48 135.00 136.58 2j55 s PRO 186 Ca 0.18 1.96 0.05 0.00 0.02 0.00 0.00 61.00 63.20 2j55 s PRO 186 Cb -0.24 -2.83 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 2j55 s PRO 186 CO -0.01 -0.25 0.27 0.25 -0.33 0.00 0.00 177.00 176.93 2j55 n THR 187 N 0.37 0.00 -3.85 0.99 -2.24 -0.48 -4.80 114.28 104.27 2j55 n THR 187 Ca 0.03 -0.41 -0.03 0.00 -2.27 0.00 0.00 64.05 61.37 2j55 n THR 187 Cb 0.45 1.02 0.01 0.00 -2.10 0.00 0.00 70.33 69.71 2j55 n THR 187 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j55 s ALA 188 N -1.27 -1.66 0.48 6.98 0.00 -1.18 -4.87 121.76 120.23 2j55 s ALA 188 Ca 0.02 -0.21 0.18 0.00 0.00 0.00 0.00 51.96 51.96 2j55 s ALA 188 Cb 0.04 0.73 1.19 0.00 0.00 0.00 0.00 23.12 25.07 2j55 s ALA 188 CO 0.17 -1.06 2.00 -1.35 0.00 0.00 0.00 175.76 175.51 2j55 h PRO 189 N 2.00 0.21 0.00 0.00 0.11 -1.99 -3.26 132.00 129.08 2j55 h PRO 189 Ca -0.27 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 2j55 h PRO 189 Cb 1.22 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 2j55 h PRO 189 CO 0.34 0.14 -0.47 -0.40 -0.21 0.00 0.00 178.00 177.40 2j55 n ASP 190 N -4.45 0.94 -3.92 -2.05 5.68 -1.26 -4.98 116.55 106.51 2j55 n ASP 190 Ca 0.09 -2.46 -0.16 0.00 -0.50 0.00 0.00 54.79 51.75 2j55 n ASP 190 Cb 0.44 -0.31 -0.15 0.00 -1.14 0.00 0.00 41.12 39.96 2j55 n ASP 190 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2j55 s THR 191 N -1.04 0.37 0.17 2.12 2.01 -1.23 -0.73 115.64 117.30 2j55 s THR 191 Ca 0.18 -0.14 -0.19 0.00 0.31 0.00 0.00 61.69 61.85 2j55 s THR 191 Cb 0.17 -0.35 0.05 0.00 0.01 0.00 0.00 72.50 72.38 2j55 s THR 191 CO -0.03 0.13 0.53 0.72 -0.69 0.00 0.00 174.62 175.29 2j55 s PHE 192 N 0.27 -0.31 0.20 4.92 -0.71 -0.50 -1.38 117.98 120.47 2j55 s PHE 192 Ca -0.03 0.02 0.10 0.00 -1.04 0.00 0.00 56.93 55.98 2j55 s PHE 192 Cb -0.06 0.44 -0.04 0.00 -1.21 0.00 0.00 43.02 42.14 2j55 s PHE 192 CO -0.00 -0.85 -0.14 -0.06 -1.34 0.00 0.00 175.22 172.83 2j55 s PHE 193 N -3.81 2.51 0.13 3.49 0.40 -0.55 -0.61 117.98 119.54 2j55 s PHE 193 Ca 0.04 -0.27 -0.01 0.00 -0.60 0.00 0.00 56.93 56.09 2j55 s PHE 193 Cb -0.00 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.28 2j55 s PHE 193 CO -0.09 0.54 0.05 -1.64 0.70 0.00 0.00 175.22 174.78 2j55 s MET 194 N -2.93 0.91 -0.19 0.44 -1.94 -0.21 -0.25 119.30 115.13 2j55 s MET 194 Ca 0.25 -1.43 -0.05 0.00 -1.71 0.00 0.00 55.69 52.75 2j55 s MET 194 Cb -0.08 0.21 -0.02 0.00 2.01 0.00 0.00 34.83 36.95 2j55 s MET 194 CO 0.14 -0.24 -0.01 -1.58 -0.01 0.00 0.00 175.02 173.32 2j55 s HIS 195 N -4.02 3.03 0.30 -0.03 2.46 0.01 -0.93 115.29 116.12 2j55 s HIS 195 Ca 0.23 -0.45 0.04 0.00 0.47 0.00 0.00 55.06 55.35 2j55 s HIS 195 Cb 0.07 -2.07 -0.03 0.00 -0.13 0.00 0.00 32.58 30.43 2j55 s HIS 195 CO 0.01 -0.22 0.45 0.00 -2.47 0.00 0.00 174.74 172.51 2j55 h ARG 197 N 0.96 0.76 -0.28 0.00 2.43 -1.39 -1.01 114.38 115.84 2j55 h ARG 197 Ca -0.50 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.62 2j55 h ARG 197 Cb 1.23 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2j55 h ARG 197 CO 0.60 0.50 0.00 -0.40 -1.51 0.00 0.00 179.97 179.16 2j55 n ASP 198 N -4.54 1.57 0.00 -3.80 5.68 -1.26 -4.87 116.55 109.33 2j55 n ASP 198 Ca 0.16 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.49 2j55 n ASP 198 Cb 0.38 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 2j55 n ASP 198 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2j55 n GLY 199 N 0.99 0.54 3.91 6.12 0.00 -0.38 -4.85 105.19 111.51 2j55 n GLY 199 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 2j55 n GLY 199 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j55 s SER 200 N -2.17 5.26 0.15 1.61 1.04 -1.26 -1.42 113.70 116.91 2j55 s SER 200 Ca 0.00 0.71 -0.07 0.00 0.48 0.00 0.00 55.95 57.07 2j55 s SER 200 Cb 0.00 -1.53 -0.06 0.00 0.10 0.00 0.00 66.02 64.53 2j55 s SER 200 CO 0.00 -1.33 0.42 -0.76 0.98 0.00 0.00 173.24 172.56 2j55 s LEU 201 N -5.17 4.26 -0.19 2.42 1.43 -1.26 -0.23 118.68 119.94 2j55 s LEU 201 Ca 0.57 0.71 -0.07 0.00 -1.03 0.00 0.00 54.13 54.31 2j55 s LEU 201 Cb -0.11 -3.32 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 2j55 s LEU 201 CO 0.46 0.05 0.06 0.00 0.23 0.00 0.00 176.35 177.15 2j55 s ALA 202 N -1.64 3.34 -0.05 4.21 0.00 -0.10 -1.16 121.76 126.35 2j55 s ALA 202 Ca 0.41 -0.81 -0.21 0.00 0.00 0.00 0.00 51.96 51.34 2j55 s ALA 202 Cb -0.12 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 21.03 2j55 s ALA 202 CO 0.22 0.07 0.62 0.21 0.00 0.00 0.00 175.76 176.89 2j55 s LYS 203 N 0.57 4.38 -0.17 0.00 2.20 0.62 -1.04 119.74 126.30 2j55 s LYS 203 Ca 0.03 0.75 0.01 0.00 -0.36 0.00 0.00 55.97 56.39 2j55 s LYS 203 Cb -0.13 -3.40 0.02 0.00 -1.51 0.00 0.00 37.83 32.81 2j55 s LYS 203 CO 0.01 0.20 -0.18 0.08 -0.36 0.00 0.00 175.35 175.10 2j55 s VAL 204 N 0.37 1.91 -0.07 4.02 1.01 0.22 -1.85 120.40 126.00 2j55 s VAL 204 Ca 0.33 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.47 2j55 s VAL 204 Cb -0.17 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.48 2j55 s VAL 204 CO 0.16 0.52 -0.09 0.00 0.00 0.00 0.00 175.10 175.69 2j55 s ALA 205 N 1.35 1.11 -0.02 5.51 0.00 -0.22 -1.41 121.76 128.08 2j55 s ALA 205 Ca 0.05 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.70 2j55 s ALA 205 Cb -0.13 -0.62 -0.00 0.00 0.00 0.00 0.00 23.12 22.37 2j55 s ALA 205 CO -0.12 -0.06 -0.12 -0.59 0.00 0.00 0.00 175.76 174.87 2j55 s PHE 206 N 1.02 1.16 0.67 0.00 -0.71 0.09 -1.44 117.98 118.76 2j55 s PHE 206 Ca -0.08 -0.27 -0.02 0.00 -1.04 0.00 0.00 56.93 55.52 2j55 s PHE 206 Cb -0.15 -0.78 0.08 0.00 -1.21 0.00 0.00 43.02 40.97 2j55 s PHE 206 CO -0.00 -0.07 0.94 0.20 -1.34 0.00 0.00 175.22 174.94 2j55 s GLY 207 N -0.05 1.77 0.38 1.99 0.00 -1.26 -4.77 107.32 105.38 2j55 s GLY 207 Ca 0.00 -1.39 0.24 0.00 0.00 0.00 0.00 44.72 43.57 2j55 s GLY 207 CO 0.00 -0.94 1.55 2.41 0.00 0.00 0.00 173.10 176.12 2j55 n THR 208 N -2.73 -0.37 -3.95 0.90 -1.04 -1.26 -4.72 114.28 101.11 2j55 n THR 208 Ca 0.11 1.94 -0.09 0.00 -2.04 0.00 0.00 64.05 63.97 2j55 n THR 208 Cb 0.60 -3.15 -0.09 0.00 -1.82 0.00 0.00 70.33 65.87 2j55 n THR 208 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2j55 s GLU 209 N -5.42 0.65 0.00 -2.82 -6.30 -1.26 -5.10 118.70 98.45 2j55 s GLU 209 Ca -0.08 -0.93 0.00 0.00 -2.50 0.00 0.00 54.97 51.46 2j55 s GLU 209 Cb 0.33 0.25 0.00 0.00 0.00 0.00 0.00 34.13 34.71 2j55 s GLU 209 CO 0.78 -0.17 0.00 0.41 0.02 0.00 0.00 175.26 176.30 2j55 n GLY 210 N 0.40 -0.92 3.70 -1.50 0.00 -1.26 -4.93 105.19 100.68 2j55 n GLY 210 Ca -0.17 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 2j55 n GLY 210 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2j55 n THR 211 N -1.08 2.46 -2.07 2.61 5.66 -1.26 -4.69 114.28 115.91 2j55 n THR 211 Ca 0.00 -0.50 -0.31 0.00 -3.05 0.00 0.00 64.05 60.19 2j55 n THR 211 Cb 0.00 -1.55 -0.00 0.00 -1.55 0.00 0.00 70.33 67.23 2j55 n THR 211 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2j55 s PRO 212 N -2.14 3.70 -0.25 1.09 0.04 -1.26 -4.77 135.00 131.41 2j55 s PRO 212 Ca 0.60 0.78 -0.29 0.00 0.04 0.00 0.00 61.00 62.14 2j55 s PRO 212 Cb -0.52 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 31.92 2j55 s PRO 212 CO 0.59 -0.46 1.02 -2.00 0.04 0.00 0.00 177.00 176.19 2j55 s GLU 213 N -4.81 4.21 -0.09 4.56 2.56 -0.52 -4.93 118.70 119.67 2j55 s GLU 213 Ca 0.56 1.25 -0.01 0.00 0.00 0.00 0.00 54.97 56.77 2j55 s GLU 213 Cb -0.11 -3.66 -0.03 0.00 2.00 0.00 0.00 34.13 32.33 2j55 s GLU 213 CO 0.47 -0.68 -0.03 0.42 -0.56 0.00 0.00 175.26 174.88 2j55 s ILE 214 N 3.26 4.04 -0.17 -3.70 1.01 -1.26 -1.05 121.20 123.33 2j55 s ILE 214 Ca 0.43 -0.34 -0.05 0.00 0.00 0.00 0.00 60.65 60.69 2j55 s ILE 214 Cb -0.14 -2.69 0.06 0.00 0.01 0.00 0.00 42.46 39.69 2j55 s ILE 214 CO 0.08 0.59 0.10 -0.89 0.00 0.00 0.00 174.94 174.82 2j55 s THR 215 N -0.67 -0.12 0.45 2.92 2.01 -0.77 -4.99 115.64 114.48 2j55 s THR 215 Ca 0.10 -0.14 -0.09 0.00 0.31 0.00 0.00 61.69 61.87 2j55 s THR 215 Cb -0.12 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.77 2j55 s THR 215 CO 0.02 -0.26 0.80 -1.00 -0.69 0.00 0.00 174.62 173.49 2j55 s HIS 216 N 2.16 3.52 0.25 4.92 3.76 -1.26 -0.27 115.29 128.36 2j55 s HIS 216 Ca 0.03 0.99 0.04 0.00 -0.15 0.00 0.00 55.06 55.96 2j55 s HIS 216 Cb -0.16 -2.42 0.04 0.00 1.11 0.00 0.00 32.58 31.15 2j55 s HIS 216 CO -0.09 -0.22 0.31 0.25 -0.85 0.00 0.00 174.74 174.14 2j55 n THR 217 N -1.77 0.00 -1.48 1.30 -2.24 -0.31 -4.93 114.28 104.84 2j55 n THR 217 Ca 0.02 -0.87 -0.34 0.00 -2.27 0.00 0.00 64.05 60.60 2j55 n THR 217 Cb 0.54 -0.69 0.08 0.00 -2.10 0.00 0.00 70.33 68.17 2j55 n THR 217 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2j55 s GLU 218 N -3.11 2.27 0.29 -0.78 2.02 -1.26 -4.66 118.70 113.46 2j55 s GLU 218 Ca 0.24 1.63 -0.30 0.00 0.02 0.00 0.00 54.97 56.56 2j55 s GLU 218 Cb -0.02 -1.86 -0.12 0.00 0.10 0.00 0.00 34.13 32.23 2j55 s GLU 218 CO 0.15 -1.71 1.59 0.28 0.02 0.00 0.00 175.26 175.60 2j55 n VAL 219 N -2.72 0.97 -0.01 2.63 0.31 -1.26 -4.39 118.33 113.86 2j55 n VAL 219 Ca 0.12 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2j55 n VAL 219 Cb 0.51 -1.94 0.01 0.00 -0.91 0.00 0.00 33.84 31.51 2j55 n VAL 219 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 2j55 n PHE 220 N 2.21 0.02 -3.54 3.52 -1.74 -0.51 -4.93 117.46 112.49 2j55 n PHE 220 Ca 0.09 -0.47 -0.13 0.00 -0.56 0.00 0.00 57.45 56.38 2j55 n PHE 220 Cb 0.36 -0.05 -0.05 0.00 1.52 0.00 0.00 39.48 41.27 2j55 n PHE 220 CO 0.00 0.00 0.00 -3.38 -0.56 0.00 0.00 176.76 172.82 2j55 s HIS 221 N -0.95 -0.47 0.90 2.97 -3.43 -1.26 -5.11 115.29 107.94 2j55 s HIS 221 Ca 0.01 0.74 -0.12 0.00 -0.80 0.00 0.00 55.06 54.89 2j55 s HIS 221 Cb 0.00 0.45 0.13 0.00 -1.43 0.00 0.00 32.58 31.74 2j55 s HIS 221 CO 0.01 -0.47 1.10 -1.25 -2.00 0.00 0.00 174.74 172.12 2j55 s PRO 222 N -1.46 1.23 0.00 -0.38 0.04 -1.26 -4.76 135.00 128.40 2j55 s PRO 222 Ca -0.04 0.61 0.27 0.00 0.04 0.00 0.00 61.00 61.87 2j55 s PRO 222 Cb -0.00 -1.82 1.16 0.00 0.04 0.00 0.00 34.50 33.88 2j55 s PRO 222 CO 0.03 -2.20 1.86 0.39 0.04 0.00 0.00 177.00 177.11 2j55 n GLU 223 N -3.83 0.06 -0.18 4.56 1.02 -1.26 -2.20 120.64 118.80 2j55 n GLU 223 Ca 0.06 0.04 0.05 0.00 -0.02 0.00 0.00 57.16 57.30 2j55 n GLU 223 Cb 0.57 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.63 2j55 n GLU 223 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2j55 n ASP 224 N -1.47 2.86 -4.26 1.62 5.75 -1.26 -4.83 116.55 114.96 2j55 n ASP 224 Ca 0.07 -2.33 -0.40 0.00 -0.01 0.00 0.00 54.79 52.12 2j55 n ASP 224 Cb 0.30 -0.27 -0.10 0.00 -1.03 0.00 0.00 41.12 40.02 2j55 n ASP 224 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2j55 s GLU 225 N -1.58 2.59 -0.44 0.11 2.12 -0.94 -5.11 118.70 115.46 2j55 s GLU 225 Ca 0.23 -1.50 -0.26 0.00 0.36 0.00 0.00 54.97 53.80 2j55 s GLU 225 Cb 0.16 -3.80 0.02 0.00 0.26 0.00 0.00 34.13 30.77 2j55 s GLU 225 CO 0.09 -0.99 0.94 -0.06 -0.54 0.00 0.00 175.26 174.71 2j55 s PHE 226 N 1.42 2.95 -0.19 5.30 0.08 -1.26 -4.73 117.98 121.55 2j55 s PHE 226 Ca 0.03 0.52 -0.24 0.00 0.12 0.00 0.00 56.93 57.36 2j55 s PHE 226 Cb -0.23 -3.92 -0.01 0.00 -0.57 0.00 0.00 43.02 38.28 2j55 s PHE 226 CO 0.02 -1.04 0.79 -0.51 -0.10 0.00 0.00 175.22 174.38 2j55 s LEU 227 N 3.74 4.15 0.86 -0.37 1.02 -1.26 -1.55 118.68 125.27 2j55 s LEU 227 Ca 0.38 1.07 -0.12 0.00 0.02 0.00 0.00 54.13 55.49 2j55 s LEU 227 Cb -0.10 -3.15 0.12 0.00 0.02 0.00 0.00 46.19 43.07 2j55 s LEU 227 CO 0.25 -0.40 1.17 2.30 0.02 0.00 0.00 176.35 179.69 2j55 n ILE 228 N 4.84 1.03 0.66 -0.59 -5.35 -0.51 -4.92 119.36 114.52 2j55 n ILE 228 Ca 0.03 -0.10 0.11 0.00 -0.27 0.00 0.00 62.75 62.51 2j55 n ILE 228 Cb 0.49 -1.10 0.44 0.00 -1.74 0.00 0.00 39.64 37.73 2j55 n ILE 228 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2j55 n ASN 229 N -3.76 0.17 -3.11 7.28 3.02 -1.26 -4.06 115.26 113.55 2j55 n ASN 229 Ca 0.13 0.53 -0.28 0.00 -0.03 0.00 0.00 54.58 54.93 2j55 n ASN 229 Cb 0.51 -0.57 -0.05 0.00 -0.61 0.00 0.00 39.78 39.07 2j55 n ASN 229 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2j55 n HIS 230 N -1.67 3.88 -1.04 3.10 8.25 -1.26 -4.84 115.22 121.64 2j55 n HIS 230 Ca 0.05 -3.94 -0.31 0.00 -0.26 0.00 0.00 57.72 53.25 2j55 n HIS 230 Cb 0.26 -0.55 0.12 0.00 1.12 0.00 0.00 29.99 30.94 2j55 n HIS 230 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2j55 s PRO 231 N -3.27 1.72 -0.10 -0.41 0.04 -1.26 -4.41 135.00 127.31 2j55 s PRO 231 Ca 0.46 1.39 -0.10 0.00 0.04 0.00 0.00 61.00 62.79 2j55 s PRO 231 Cb 0.24 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.91 2j55 s PRO 231 CO -0.10 -2.08 0.24 0.00 0.04 0.00 0.00 177.00 175.09 2j55 s ALA 232 N -2.70 3.77 -0.06 8.56 0.00 -0.52 -4.91 121.76 125.90 2j55 s ALA 232 Ca 0.65 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 52.11 2j55 s ALA 232 Cb -0.21 -2.17 0.03 0.00 0.00 0.00 0.00 23.12 20.77 2j55 s ALA 232 CO 0.55 0.47 -0.01 -0.47 0.00 0.00 0.00 175.76 176.31 2j55 s TYR 233 N -0.73 0.61 -0.41 0.00 5.04 -1.26 0.34 117.35 120.93 2j55 s TYR 233 Ca 0.17 -0.14 -0.11 0.00 -2.44 0.00 0.00 57.07 54.55 2j55 s TYR 233 Cb -0.13 -0.70 0.06 0.00 0.35 0.00 0.00 41.96 41.54 2j55 s TYR 233 CO 0.06 -0.26 0.27 0.45 -1.34 0.00 0.00 175.55 174.74 2j55 s SER 234 N 1.57 5.79 0.27 4.32 0.15 -0.05 -4.96 113.70 120.80 2j55 s SER 234 Ca -0.01 -1.28 -0.01 0.00 0.70 0.00 0.00 55.95 55.35 2j55 s SER 234 Cb -0.13 -2.05 0.38 0.00 -1.71 0.00 0.00 66.02 62.52 2j55 s SER 234 CO -0.03 -0.51 1.80 -0.61 1.20 0.00 0.00 173.24 175.09 2j55 h GLN 235 N 8.50 0.79 -0.31 5.44 4.15 -1.91 0.30 115.11 132.07 2j55 h GLN 235 Ca -0.25 -0.19 -0.10 0.00 0.77 0.00 0.00 58.65 58.88 2j55 h GLN 235 Cb 1.10 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.67 2j55 h GLN 235 CO 0.75 0.76 -0.21 0.87 -1.93 0.00 0.00 178.83 179.07 2j55 h LYS 236 N 0.76 0.70 0.00 1.69 1.57 -1.96 -2.80 116.57 116.52 2j55 h LYS 236 Ca 0.16 -0.33 -0.06 0.00 -1.87 0.00 0.00 60.65 58.54 2j55 h LYS 236 Cb 0.37 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2j55 h LYS 236 CO 0.01 0.94 -0.31 0.00 -0.57 0.00 0.00 179.45 179.52 2j55 h ALA 237 N 0.74 0.92 -5.22 3.86 0.00 -1.95 -3.48 119.26 114.13 2j55 h ALA 237 Ca 0.06 -0.28 -0.38 0.00 0.00 0.00 0.00 54.91 54.31 2j55 h ALA 237 Cb 0.76 -0.05 0.11 0.00 0.00 0.00 0.00 17.79 18.62 2j55 h ALA 237 CO 0.06 0.39 -0.62 0.41 0.00 0.00 0.00 179.25 179.48 2j55 n GLY 238 N 0.52 -0.46 3.36 0.00 0.00 0.98 -4.44 105.19 105.16 2j55 n GLY 238 Ca 0.01 0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2j55 n GLY 238 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j55 s ARG 239 N -6.09 3.46 -0.19 1.61 6.06 -0.70 0.57 118.95 123.68 2j55 s ARG 239 Ca 0.49 -0.59 -0.05 0.00 -2.50 0.00 0.00 55.73 53.08 2j55 s ARG 239 Cb -0.21 -3.02 -0.03 0.00 0.06 0.00 0.00 34.95 31.75 2j55 s ARG 239 CO 0.60 -0.11 -0.00 -1.17 -2.50 0.00 0.00 175.30 172.12 2j55 s LEU 240 N 1.26 3.31 -0.23 -0.88 0.20 -0.01 -0.87 118.68 121.46 2j55 s LEU 240 Ca 0.03 -0.15 0.02 0.00 0.69 0.00 0.00 54.13 54.72 2j55 s LEU 240 Cb -0.14 -1.83 0.05 0.00 -0.43 0.00 0.00 46.19 43.84 2j55 s LEU 240 CO -0.01 0.10 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.36 2j55 s VAL 241 N 0.76 1.89 -0.34 1.68 1.01 0.15 -0.54 120.40 125.02 2j55 s VAL 241 Ca 0.00 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.67 2j55 s VAL 241 Cb -0.14 -2.00 0.10 0.00 0.00 0.00 0.00 36.38 34.34 2j55 s VAL 241 CO 0.02 0.05 0.07 0.86 0.00 0.00 0.00 175.10 176.10 2j55 s TRP 242 N 1.25 3.15 0.45 5.22 -0.11 0.18 -1.44 118.94 127.64 2j55 s TRP 242 Ca -0.05 -2.64 -0.18 0.00 1.22 0.00 0.00 56.10 54.44 2j55 s TRP 242 Cb -0.18 -2.57 -0.10 0.00 -1.50 0.00 0.00 33.47 29.12 2j55 s TRP 242 CO -0.07 -0.92 0.93 -2.14 -4.62 0.00 0.00 176.95 170.13 2j55 s PRO 243 N 1.08 4.09 0.65 5.86 0.02 -1.26 -1.26 135.00 144.18 2j55 s PRO 243 Ca 0.11 0.99 0.02 0.00 0.02 0.00 0.00 61.00 62.14 2j55 s PRO 243 Cb -0.19 -2.20 0.10 0.00 0.02 0.00 0.00 34.50 32.23 2j55 s PRO 243 CO -0.13 -0.10 0.89 0.95 -0.33 0.00 0.00 177.00 178.29 2j55 s THR 244 N -2.33 2.28 0.66 0.99 -4.23 0.19 -1.42 115.64 111.78 2j55 s THR 244 Ca 0.60 -0.71 0.39 0.00 -1.18 0.00 0.00 61.69 60.79 2j55 s THR 244 Cb -0.09 -2.57 0.40 0.00 1.34 0.00 0.00 72.50 71.58 2j55 s THR 244 CO 0.21 0.00 2.23 1.88 -0.54 0.00 0.00 174.62 178.39 2j55 h TYR 245 N -0.22 0.00 -0.05 3.99 -1.99 -1.61 -1.34 116.97 115.75 2j55 h TYR 245 Ca -0.36 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.37 2j55 h TYR 245 Cb 1.28 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.01 2j55 h TYR 245 CO 0.06 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.47 2j55 n THR 246 N -3.14 0.02 -0.70 -2.88 -2.24 -1.26 -4.16 114.28 99.92 2j55 n THR 246 Ca -0.02 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 2j55 n THR 246 Cb 0.17 1.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.86 2j55 n THR 246 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j55 n GLY 247 N 1.35 0.72 3.76 3.38 0.00 -0.50 -4.68 105.19 109.23 2j55 n GLY 247 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 2j55 n GLY 247 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j55 s LYS 248 N -0.30 3.69 -0.14 1.61 2.20 -1.26 -0.67 119.74 124.87 2j55 s LYS 248 Ca 0.00 2.05 0.00 0.00 -0.36 0.00 0.00 55.97 57.66 2j55 s LYS 248 Cb 0.00 -2.51 0.03 0.00 -1.51 0.00 0.00 37.83 33.83 2j55 s LYS 248 CO 0.00 -0.69 -0.11 0.42 -0.36 0.00 0.00 175.35 174.61 2j55 s ILE 249 N -1.37 1.34 -0.21 5.43 1.01 0.13 -0.63 121.20 126.90 2j55 s ILE 249 Ca 0.63 -0.53 -0.26 0.00 0.00 0.00 0.00 60.65 60.49 2j55 s ILE 249 Cb -0.35 -1.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 2j55 s ILE 249 CO 0.44 0.38 0.87 -1.00 0.00 0.00 0.00 174.94 175.62 2j55 s HIS 250 N 1.57 3.36 -0.15 3.97 3.76 -0.39 -2.43 115.29 125.00 2j55 s HIS 250 Ca 0.04 1.25 -0.03 0.00 -0.15 0.00 0.00 55.06 56.17 2j55 s HIS 250 Cb -0.13 -3.07 -0.03 0.00 1.11 0.00 0.00 32.58 30.46 2j55 s HIS 250 CO -0.09 -0.34 -0.06 -0.65 -0.85 0.00 0.00 174.74 172.75 2j55 s GLN 251 N 2.60 3.57 -0.12 1.40 -0.21 -1.26 0.51 119.66 126.15 2j55 s GLN 251 Ca 0.38 -0.55 0.03 0.00 0.02 0.00 0.00 55.36 55.24 2j55 s GLN 251 Cb -0.16 -2.84 0.01 0.00 1.00 0.00 0.00 33.01 31.01 2j55 s GLN 251 CO 0.09 0.26 -0.23 0.42 -2.12 0.00 0.00 175.29 173.72 2j55 s ILE 252 N 0.29 2.04 -0.42 1.08 1.09 0.30 -0.99 121.20 124.58 2j55 s ILE 252 Ca -0.05 -0.99 -0.18 0.00 -1.10 0.00 0.00 60.65 58.34 2j55 s ILE 252 Cb -0.14 -1.78 0.02 0.00 -1.06 0.00 0.00 42.46 39.49 2j55 s ILE 252 CO 0.03 0.55 0.46 -0.62 -0.10 0.00 0.00 174.94 175.27 2j55 s ASP 253 N 0.59 6.21 0.00 3.58 -1.08 0.41 -0.83 116.67 125.56 2j55 s ASP 253 Ca -0.13 -0.61 0.17 0.00 -0.52 0.00 0.00 52.55 51.46 2j55 s ASP 253 Cb -0.17 -2.24 0.43 0.00 -1.46 0.00 0.00 42.92 39.49 2j55 s ASP 253 CO 0.03 -0.60 1.35 0.18 0.52 0.00 0.00 175.17 176.65 2j55 n LEU 254 N 5.69 3.31 0.31 -1.34 4.77 0.19 -0.46 117.00 129.46 2j55 n LEU 254 Ca -0.07 -1.87 0.17 0.00 -0.03 0.00 0.00 56.01 54.21 2j55 n LEU 254 Cb 0.47 -0.31 0.99 0.00 -2.33 0.00 0.00 43.42 42.24 2j55 n LEU 254 CO 0.47 0.80 1.14 0.77 -1.33 0.00 0.00 177.39 179.24 2j55 h SER 255 N 3.17 0.00 -0.05 -1.43 4.64 -1.74 -1.87 113.55 116.27 2j55 h SER 255 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2j55 h SER 255 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2j55 h SER 255 CO 0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 2j55 n SER 256 N -3.63 2.13 -0.03 4.97 3.41 -1.26 -4.94 113.62 114.27 2j55 n SER 256 Ca -0.03 -1.71 -0.00 0.00 -0.26 0.00 0.00 58.87 56.86 2j55 n SER 256 Cb 0.09 -0.02 -0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2j55 n SER 256 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j55 n GLY 257 N 1.25 0.47 2.88 5.00 0.00 -0.70 -5.03 105.19 109.06 2j55 n GLY 257 Ca 0.17 -0.28 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 2j55 n GLY 257 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j55 s ASP 258 N -2.27 0.28 -0.17 1.61 1.01 -1.26 -5.06 116.67 110.82 2j55 s ASP 258 Ca 0.00 -0.03 -0.29 0.00 0.71 0.00 0.00 52.55 52.94 2j55 s ASP 258 Cb 0.00 -0.08 -0.04 0.00 1.01 0.00 0.00 42.92 43.81 2j55 s ASP 258 CO 0.00 -0.01 1.80 0.00 0.21 0.00 0.00 175.17 177.17 2j55 s ALA 259 N 0.27 3.24 -0.28 5.23 0.00 -1.26 -4.47 121.76 124.49 2j55 s ALA 259 Ca -0.02 0.71 -0.10 0.00 0.00 0.00 0.00 51.96 52.54 2j55 s ALA 259 Cb -0.05 -3.89 -0.04 0.00 0.00 0.00 0.00 23.12 19.14 2j55 s ALA 259 CO -0.01 -2.02 0.16 0.15 0.00 0.00 0.00 175.76 174.04 2j55 s LYS 260 N 4.94 3.86 0.09 0.00 1.02 0.39 -4.99 119.74 125.05 2j55 s LYS 260 Ca 0.80 -0.37 -0.29 0.00 0.02 0.00 0.00 55.97 56.13 2j55 s LYS 260 Cb -0.30 -3.59 -0.06 0.00 -0.52 0.00 0.00 37.83 33.37 2j55 s LYS 260 CO 0.33 -0.19 0.91 -0.06 -0.92 0.00 0.00 175.35 175.41 2j55 s PHE 261 N 1.72 3.79 0.26 3.18 0.40 -1.26 -0.44 117.98 125.63 2j55 s PHE 261 Ca 0.07 1.72 0.03 0.00 -0.60 0.00 0.00 56.93 58.15 2j55 s PHE 261 Cb -0.16 -3.00 -0.03 0.00 0.51 0.00 0.00 43.02 40.34 2j55 s PHE 261 CO 0.09 0.22 0.40 -0.51 0.70 0.00 0.00 175.22 176.13 2j55 s LEU 262 N -0.01 4.24 0.32 -0.37 1.02 -0.16 -4.91 118.68 118.80 2j55 s LEU 262 Ca 0.45 0.20 -0.29 0.00 0.02 0.00 0.00 54.13 54.51 2j55 s LEU 262 Cb -0.23 -3.01 -0.12 0.00 0.02 0.00 0.00 46.19 42.85 2j55 s LEU 262 CO 0.28 -0.11 1.33 -2.65 0.02 0.00 0.00 176.35 175.22 2j55 n PRO 263 N -1.36 2.15 -1.59 1.29 -0.02 -1.26 -4.47 135.00 129.74 2j55 n PRO 263 Ca -0.07 0.76 -0.32 0.00 -2.02 0.00 0.00 63.50 61.85 2j55 n PRO 263 Cb 0.56 -2.37 0.06 0.00 -0.02 0.00 0.00 33.50 31.73 2j55 n PRO 263 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j55 s ALA 264 N -0.84 2.50 -0.05 3.55 0.00 -1.26 -4.59 121.76 121.08 2j55 s ALA 264 Ca 0.58 0.30 -0.06 0.00 0.00 0.00 0.00 51.96 52.78 2j55 s ALA 264 Cb -0.58 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.31 2j55 s ALA 264 CO 0.59 -1.34 0.16 0.54 0.00 0.00 0.00 175.76 175.71 2j55 s VAL 265 N -2.74 0.02 -0.19 0.00 0.11 -1.02 -4.96 120.40 111.63 2j55 s VAL 265 Ca 0.62 -0.17 -0.12 0.00 -2.93 0.00 0.00 61.98 59.38 2j55 s VAL 265 Cb -0.17 -0.29 -0.05 0.00 -1.53 0.00 0.00 36.38 34.34 2j55 s VAL 265 CO 0.49 -0.09 0.23 -1.61 -3.33 0.00 0.00 175.10 170.79 2j55 s GLU 266 N -0.27 4.19 0.26 1.54 0.41 -1.26 0.22 118.70 123.79 2j55 s GLU 266 Ca -0.04 -0.05 0.14 0.00 -0.41 0.00 0.00 54.97 54.61 2j55 s GLU 266 Cb -0.03 -3.46 0.14 0.00 -1.78 0.00 0.00 34.13 29.00 2j55 s GLU 266 CO 0.01 0.18 1.47 0.00 -0.49 0.00 0.00 175.26 176.43 2j55 h ALA 267 N 6.93 0.68 -3.45 5.21 0.00 -1.22 -3.44 119.26 123.96 2j55 h ALA 267 Ca -0.40 -0.55 -0.67 0.00 0.00 0.00 0.00 54.91 53.29 2j55 h ALA 267 Cb 1.16 -0.10 -0.18 0.00 0.00 0.00 0.00 17.79 18.67 2j55 h ALA 267 CO 0.73 0.76 -0.66 -0.51 0.00 0.00 0.00 179.25 179.57 2j55 s LEU 268 N -6.72 3.34 0.82 0.00 1.43 -1.26 -4.99 118.68 111.31 2j55 s LEU 268 Ca 0.02 0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 53.02 2j55 s LEU 268 Cb 0.09 -1.76 0.09 0.00 0.03 0.00 0.00 46.19 44.64 2j55 s LEU 268 CO 0.75 0.32 1.13 0.42 0.23 0.00 0.00 176.35 179.20 2j55 s THR 269 N -0.55 2.67 0.31 5.49 -4.23 -1.26 -4.81 115.64 113.27 2j55 s THR 269 Ca 0.09 0.23 0.03 0.00 -1.18 0.00 0.00 61.69 60.86 2j55 s THR 269 Cb -0.12 -2.53 0.29 0.00 1.34 0.00 0.00 72.50 71.49 2j55 s THR 269 CO 0.02 -0.27 1.87 -0.08 -0.54 0.00 0.00 174.62 175.62 2j55 h GLU 270 N -1.31 0.90 -0.12 3.99 4.81 -1.99 0.22 114.58 121.08 2j55 h GLU 270 Ca -0.44 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.69 2j55 h GLU 270 Cb 1.25 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.43 2j55 h GLU 270 CO 0.47 0.59 -0.09 0.00 -0.73 0.00 0.00 179.01 179.25 2j55 h ALA 271 N 1.55 0.18 -0.44 2.92 0.00 -1.99 -0.57 119.26 120.90 2j55 h ALA 271 Ca 0.45 -0.29 0.09 0.00 0.00 0.00 0.00 54.91 55.16 2j55 h ALA 271 Cb 0.45 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.11 2j55 h ALA 271 CO -0.21 0.00 -0.25 0.93 0.00 0.00 0.00 179.25 179.72 2j55 h GLU 272 N -0.09 -0.16 -0.71 0.00 5.08 -1.89 0.97 114.58 117.78 2j55 h GLU 272 Ca 0.02 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.48 2j55 h GLU 272 Cb 0.59 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.80 2j55 h GLU 272 CO 0.02 -0.11 0.36 0.00 -1.00 0.00 0.00 179.01 178.29 2j55 h ARG 273 N -0.16 0.60 -0.78 2.33 3.08 -0.45 -1.37 114.38 117.63 2j55 h ARG 273 Ca 0.20 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2j55 h ARG 273 Cb 0.49 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 2j55 h ARG 273 CO -0.54 0.40 0.44 0.00 -1.07 0.00 0.00 179.97 179.20 2j55 h ALA 274 N 1.42 1.29 0.00 0.04 0.00 -0.49 -2.13 119.26 119.39 2j55 h ALA 274 Ca 0.34 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2j55 h ALA 274 Cb 0.34 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2j55 h ALA 274 CO -0.25 0.58 0.00 -0.25 0.00 0.00 0.00 179.25 179.33 2j55 n ASP 275 N -4.36 0.00 0.00 0.00 8.00 0.28 -4.89 116.55 115.58 2j55 n ASP 275 Ca 0.08 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.64 2j55 n ASP 275 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 2j55 n ASP 275 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2j55 n GLY 276 N 0.28 0.79 3.73 0.44 0.00 -0.80 -4.91 105.19 104.72 2j55 n GLY 276 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2j55 n GLY 276 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j55 s TRP 277 N -2.17 3.68 0.02 1.61 0.52 -0.56 -1.05 118.94 120.99 2j55 s TRP 277 Ca 0.00 1.67 -0.20 0.00 0.02 0.00 0.00 56.10 57.59 2j55 s TRP 277 Cb 0.00 -3.19 0.04 0.00 -1.15 0.00 0.00 33.47 29.18 2j55 s TRP 277 CO 0.00 -0.28 0.45 1.03 0.02 0.00 0.00 176.95 178.17 2j55 s ARG 278 N -0.11 0.91 0.75 4.98 0.52 0.39 -4.42 118.95 121.97 2j55 s ARG 278 Ca 0.49 -0.21 -0.15 0.00 -0.52 0.00 0.00 55.73 55.34 2j55 s ARG 278 Cb -0.27 0.41 0.02 0.00 0.52 0.00 0.00 34.95 35.64 2j55 s ARG 278 CO 0.32 -0.30 0.96 -0.35 0.02 0.00 0.00 175.30 175.95 2j55 n PRO 279 N 0.70 0.39 -3.60 3.54 -0.04 -1.26 -1.95 135.00 132.78 2j55 n PRO 279 Ca -0.19 0.19 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2j55 n PRO 279 Cb 0.59 -2.22 -0.06 0.00 -0.04 0.00 0.00 33.50 31.76 2j55 n PRO 279 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2j55 s GLY 280 N -1.74 -0.29 0.00 0.55 0.00 -0.92 -4.84 107.32 100.09 2j55 s GLY 280 Ca 0.72 2.23 0.00 0.00 0.00 0.00 0.00 44.72 47.67 2j55 s GLY 280 CO 0.52 1.47 0.00 0.61 0.00 0.00 0.00 173.10 175.69 2j55 n GLY 281 N 1.65 0.44 0.00 0.20 0.00 -0.55 -4.04 105.19 102.89 2j55 n GLY 281 Ca -0.13 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2j55 n GLY 281 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2j55 n TRP 282 N 0.63 0.00 -2.59 1.61 -0.00 0.94 -4.28 117.44 113.76 2j55 n TRP 282 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.50 57.08 2j55 n TRP 282 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.31 31.30 2j55 n TRP 282 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 2j55 s GLN 283 N 0.00 3.82 0.42 5.87 -0.21 -1.15 -4.61 119.66 123.80 2j55 s GLN 283 Ca 0.00 -1.65 0.23 0.00 0.02 0.00 0.00 55.36 53.96 2j55 s GLN 283 Cb 0.00 -5.43 0.82 0.00 1.00 0.00 0.00 33.01 29.40 2j55 s GLN 283 CO 0.00 -2.21 1.78 1.96 -2.12 0.00 0.00 175.29 174.71 2j55 h GLN 284 N 8.51 0.00 -5.81 2.91 4.20 -1.79 -1.90 115.11 121.22 2j55 h GLN 284 Ca 0.33 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.53 2j55 h GLN 284 Cb 0.93 0.00 -0.23 0.00 0.30 0.00 0.00 27.48 28.48 2j55 h GLN 284 CO 1.43 0.25 -0.81 0.54 -0.67 0.00 0.00 178.83 179.57 2j55 s VAL 285 N -3.58 1.46 0.10 -0.54 0.11 -1.26 -0.31 120.40 116.39 2j55 s VAL 285 Ca 0.01 -1.30 0.03 0.00 -2.93 0.00 0.00 61.98 57.79 2j55 s VAL 285 Cb 0.10 -1.33 -0.04 0.00 -1.53 0.00 0.00 36.38 33.58 2j55 s VAL 285 CO 0.65 -0.02 -0.09 0.00 -3.33 0.00 0.00 175.10 172.31 2j55 s ALA 286 N -1.03 1.11 -0.04 1.54 0.00 -0.56 -4.53 121.76 118.25 2j55 s ALA 286 Ca 0.04 -1.27 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 2j55 s ALA 286 Cb -0.09 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.13 2j55 s ALA 286 CO 0.03 -0.10 0.03 -0.47 0.00 0.00 0.00 175.76 175.24 2j55 s TYR 287 N -2.89 0.19 -0.32 0.00 5.04 -1.26 -1.46 117.35 116.65 2j55 s TYR 287 Ca 0.09 0.11 -0.13 0.00 -2.44 0.00 0.00 57.07 54.70 2j55 s TYR 287 Cb 0.00 -0.44 -0.03 0.00 0.35 0.00 0.00 41.96 41.84 2j55 s TYR 287 CO -0.01 -0.17 0.28 -1.58 -1.34 0.00 0.00 175.55 172.73 2j55 s HIS 288 N 1.60 3.22 0.04 4.97 5.65 0.16 -4.90 115.29 126.03 2j55 s HIS 288 Ca -0.02 0.01 -0.30 0.00 0.25 0.00 0.00 55.06 54.99 2j55 s HIS 288 Cb -0.13 -2.51 -0.17 0.00 -1.18 0.00 0.00 32.58 28.59 2j55 s HIS 288 CO -0.03 -0.31 1.38 -0.09 -0.65 0.00 0.00 174.74 175.04 2j55 h ARG 289 N 8.41 -0.88 -0.77 2.88 2.43 -1.90 0.32 114.38 124.88 2j55 h ARG 289 Ca -0.32 0.06 0.05 0.00 -0.81 0.00 0.00 59.98 58.96 2j55 h ARG 289 Cb 1.16 0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 30.87 2j55 h ARG 289 CO 0.63 -0.55 0.50 0.00 -1.51 0.00 0.00 179.97 179.04 2j55 h ALA 290 N -0.85 1.59 0.00 2.80 0.00 -1.95 -1.86 119.26 118.99 2j55 h ALA 290 Ca -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2j55 h ALA 290 Cb 0.73 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2j55 h ALA 290 CO 0.15 0.31 -0.43 1.28 0.00 0.00 0.00 179.25 180.57 2j55 n LEU 291 N -4.47 0.50 -3.65 0.00 4.77 -1.23 -4.94 117.00 107.98 2j55 n LEU 291 Ca 0.10 0.19 -0.23 0.00 -0.03 0.00 0.00 56.01 56.05 2j55 n LEU 291 Cb 0.16 -0.27 0.06 0.00 -2.33 0.00 0.00 43.42 41.04 2j55 n LEU 291 CO 0.34 0.03 0.10 -0.67 -1.33 0.00 0.00 177.39 175.86 2j55 n ASP 292 N -1.74 -3.54 -4.36 -1.43 2.03 0.06 -4.84 116.55 102.73 2j55 n ASP 292 Ca 0.05 -0.69 -0.29 0.00 0.52 0.00 0.00 54.79 54.38 2j55 n ASP 292 Cb 0.38 -4.56 -0.14 0.00 -0.72 0.00 0.00 41.12 36.08 2j55 n ASP 292 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2j55 s ARG 293 N -6.04 1.55 -0.11 -0.67 0.52 -0.92 -0.75 118.95 112.54 2j55 s ARG 293 Ca 0.30 -1.22 -0.02 0.00 -0.52 0.00 0.00 55.73 54.27 2j55 s ARG 293 Cb -0.14 -1.89 -0.03 0.00 0.52 0.00 0.00 34.95 33.41 2j55 s ARG 293 CO 0.77 0.47 -0.04 0.42 0.02 0.00 0.00 175.30 176.94 2j55 s ILE 294 N -0.95 3.89 -0.12 1.52 1.01 -0.44 -0.67 121.20 125.44 2j55 s ILE 294 Ca 0.12 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.41 2j55 s ILE 294 Cb -0.10 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.73 2j55 s ILE 294 CO 0.04 0.56 -0.21 -0.31 0.00 0.00 0.00 174.94 175.01 2j55 s TYR 295 N -0.33 2.64 -0.05 3.97 1.51 -0.53 -0.61 117.35 123.95 2j55 s TYR 295 Ca 0.05 -1.10 0.02 0.00 -1.01 0.00 0.00 57.07 55.03 2j55 s TYR 295 Cb -0.12 -1.77 0.01 0.00 -0.11 0.00 0.00 41.96 39.96 2j55 s TYR 295 CO 0.02 -0.47 -0.10 -1.17 -1.11 0.00 0.00 175.55 172.73 2j55 s LEU 296 N 0.54 1.64 -0.17 -1.29 2.96 0.67 -1.49 118.68 121.54 2j55 s LEU 296 Ca -0.13 -0.23 -0.29 0.00 -0.22 0.00 0.00 54.13 53.26 2j55 s LEU 296 Cb -0.17 -0.67 -0.01 0.00 0.50 0.00 0.00 46.19 45.85 2j55 s LEU 296 CO 0.04 0.03 1.10 -0.76 -1.32 0.00 0.00 176.35 175.45 2j55 s LEU 297 N 0.52 4.17 0.05 -0.68 1.43 0.58 -1.23 118.68 123.52 2j55 s LEU 297 Ca -0.10 1.54 0.01 0.00 -1.03 0.00 0.00 54.13 54.55 2j55 s LEU 297 Cb -0.13 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 2j55 s LEU 297 CO 0.02 -0.63 -0.06 0.68 0.23 0.00 0.00 176.35 176.59 2j55 s VAL 298 N 2.88 0.47 0.27 -1.59 -7.23 0.06 -2.17 120.40 113.10 2j55 s VAL 298 Ca 0.49 -1.37 -0.17 0.00 -1.81 0.00 0.00 61.98 59.12 2j55 s VAL 298 Cb -0.18 -0.95 0.01 0.00 0.56 0.00 0.00 36.38 35.82 2j55 s VAL 298 CO 0.12 -0.61 0.60 -0.62 -0.31 0.00 0.00 175.10 174.29 2j55 s ASP 299 N -2.11 -0.17 -0.06 4.85 -1.08 -0.82 -2.21 116.67 115.07 2j55 s ASP 299 Ca -0.03 -0.77 -0.30 0.00 -0.52 0.00 0.00 52.55 50.93 2j55 s ASP 299 Cb -0.04 0.66 -0.02 0.00 -1.46 0.00 0.00 42.92 42.06 2j55 s ASP 299 CO -0.02 -1.25 1.06 -1.10 0.52 0.00 0.00 175.17 174.38 2j55 s GLN 300 N -3.95 4.44 -0.03 4.34 -0.21 -1.26 -0.46 119.66 122.52 2j55 s GLN 300 Ca 0.17 1.50 -0.29 0.00 0.02 0.00 0.00 55.36 56.75 2j55 s GLN 300 Cb -0.03 -3.51 0.07 0.00 1.00 0.00 0.00 33.01 30.53 2j55 s GLN 300 CO 0.08 -0.28 0.65 -0.98 -2.12 0.00 0.00 175.29 172.64 2j55 s ARG 301 N 1.75 1.05 0.88 2.91 1.70 -0.22 -4.97 118.95 122.05 2j55 s ARG 301 Ca 0.52 0.18 -0.11 0.00 -0.47 0.00 0.00 55.73 55.85 2j55 s ARG 301 Cb -0.21 0.49 0.13 0.00 -0.57 0.00 0.00 34.95 34.78 2j55 s ARG 301 CO 0.22 -0.33 1.17 -3.47 -1.08 0.00 0.00 175.30 171.81 2j55 n ASP 302 N 0.85 0.59 0.28 -2.89 2.03 -1.26 -4.75 116.55 111.40 2j55 n ASP 302 Ca -0.19 0.48 0.18 0.00 0.52 0.00 0.00 54.79 55.78 2j55 n ASP 302 Cb 0.57 -1.49 0.81 0.00 -0.72 0.00 0.00 41.12 40.30 2j55 n ASP 302 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2j55 h GLU 303 N -1.54 0.00 -0.55 -0.67 4.11 -1.99 -2.99 114.58 110.94 2j55 h GLU 303 Ca -0.44 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 58.86 2j55 h GLU 303 Cb 1.28 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.45 2j55 h GLU 303 CO 0.43 0.00 0.13 0.91 0.07 0.00 0.00 179.01 180.55 2j55 n TRP 304 N -2.97 1.88 -1.83 2.06 7.02 -1.26 -4.37 117.44 117.97 2j55 n TRP 304 Ca -0.00 -1.11 -0.27 0.00 -1.02 0.00 0.00 57.50 55.09 2j55 n TRP 304 Cb 0.22 -0.55 0.04 0.00 -2.42 0.00 0.00 31.31 28.60 2j55 n TRP 304 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2j55 n ARG 305 N -0.26 3.34 -0.01 -0.99 5.12 -1.13 -4.86 116.66 117.86 2j55 n ARG 305 Ca 0.34 -3.92 0.14 0.00 -1.93 0.00 0.00 57.85 52.48 2j55 n ARG 305 Cb 1.20 -2.28 0.68 0.00 -1.16 0.00 0.00 32.46 30.90 2j55 n ARG 305 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 2j55 n HIS 306 N -0.76 0.02 0.27 -1.55 1.44 -1.26 -3.12 115.22 110.25 2j55 n HIS 306 Ca 0.49 -0.01 0.03 0.00 -2.01 0.00 0.00 57.72 56.23 2j55 n HIS 306 Cb 0.87 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.99 2j55 n HIS 306 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2j55 n LYS 307 N -0.37 1.45 -1.71 -1.40 5.02 -1.26 -1.88 118.16 118.01 2j55 n LYS 307 Ca 0.20 -0.62 -0.32 0.00 -2.02 0.00 0.00 58.31 55.55 2j55 n LYS 307 Cb 0.23 -1.02 0.04 0.00 -0.02 0.00 0.00 35.03 34.26 2j55 n LYS 307 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2j55 s THR 308 N -0.84 3.82 0.71 -0.18 -4.23 -1.18 -4.29 115.64 109.45 2j55 s THR 308 Ca 0.06 0.70 -0.16 0.00 -1.18 0.00 0.00 61.69 61.11 2j55 s THR 308 Cb 0.05 -3.32 0.03 0.00 1.34 0.00 0.00 72.50 70.60 2j55 s THR 308 CO 0.13 -0.67 1.26 0.00 -0.54 0.00 0.00 174.62 174.79 2j55 s ALA 309 N -2.78 2.16 0.20 3.99 0.00 -1.26 -1.48 121.76 122.59 2j55 s ALA 309 Ca 0.61 1.07 0.10 0.00 0.00 0.00 0.00 51.96 53.74 2j55 s ALA 309 Cb -0.15 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 2j55 s ALA 309 CO 0.48 -1.88 -0.21 -1.12 0.00 0.00 0.00 175.76 173.03 2j55 s SER 310 N -1.70 3.17 0.00 0.00 0.01 0.05 -4.83 113.70 110.40 2j55 s SER 310 Ca 0.79 -0.89 0.18 0.00 1.31 0.00 0.00 55.95 57.34 2j55 s SER 310 Cb -0.34 -0.22 0.23 0.00 0.21 0.00 0.00 66.02 65.89 2j55 s SER 310 CO 0.44 0.05 1.16 0.54 0.41 0.00 0.00 173.24 175.84 2j55 n ARG 311 N 0.12 1.85 -4.01 12.44 1.74 -1.23 -1.65 116.66 125.92 2j55 n ARG 311 Ca -0.11 -1.79 -0.09 0.00 -0.77 0.00 0.00 57.85 55.09 2j55 n ARG 311 Cb 0.57 -1.38 -0.11 0.00 -1.02 0.00 0.00 32.46 30.53 2j55 n ARG 311 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2j55 s PHE 312 N -1.43 0.37 -0.10 -1.55 0.40 -0.94 -0.56 117.98 114.16 2j55 s PHE 312 Ca 0.25 -0.65 0.01 0.00 -0.60 0.00 0.00 56.93 55.95 2j55 s PHE 312 Cb 0.17 -0.26 0.02 0.00 0.51 0.00 0.00 43.02 43.45 2j55 s PHE 312 CO 0.24 -0.22 -0.13 0.08 0.70 0.00 0.00 175.22 175.89 2j55 s VAL 313 N -2.02 1.35 -0.02 -0.44 1.01 -0.82 -0.76 120.40 118.70 2j55 s VAL 313 Ca -0.10 -0.55 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 2j55 s VAL 313 Cb -0.06 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 2j55 s VAL 313 CO -0.03 0.41 0.36 0.68 0.00 0.00 0.00 175.10 176.53 2j55 s VAL 314 N 1.09 5.11 -0.09 2.92 -7.23 -0.37 0.18 120.40 122.00 2j55 s VAL 314 Ca -0.05 0.73 0.04 0.00 -1.81 0.00 0.00 61.98 60.89 2j55 s VAL 314 Cb -0.14 -3.66 -0.00 0.00 0.56 0.00 0.00 36.38 33.14 2j55 s VAL 314 CO -0.02 0.58 -0.23 -0.69 -0.31 0.00 0.00 175.10 174.43 2j55 s VAL 315 N -1.06 1.96 0.07 1.32 1.01 -0.36 -0.24 120.40 123.10 2j55 s VAL 315 Ca 0.22 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.26 2j55 s VAL 315 Cb -0.16 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 2j55 s VAL 315 CO 0.12 0.54 -0.09 -1.48 0.00 0.00 0.00 175.10 174.18 2j55 s LEU 316 N 0.30 2.32 -0.12 3.92 2.34 0.22 0.12 118.68 127.78 2j55 s LEU 316 Ca -0.16 -0.67 -0.29 0.00 0.06 0.00 0.00 54.13 53.06 2j55 s LEU 316 Cb -0.17 -0.25 -0.02 0.00 -0.56 0.00 0.00 46.19 45.19 2j55 s LEU 316 CO 0.08 -0.22 1.26 -0.62 -1.06 0.00 0.00 176.35 175.78 2j55 s ASP 317 N -1.96 6.97 0.20 1.48 -1.08 -0.37 -1.33 116.67 120.57 2j55 s ASP 317 Ca -0.03 1.76 -0.05 0.00 -0.52 0.00 0.00 52.55 53.71 2j55 s ASP 317 Cb -0.07 -2.55 0.13 0.00 -1.46 0.00 0.00 42.92 38.98 2j55 s ASP 317 CO 0.00 -0.71 1.57 0.00 0.52 0.00 0.00 175.17 176.56 2j55 h ALA 318 N 7.97 0.78 -0.49 3.66 0.00 -1.26 -3.08 119.26 126.84 2j55 h ALA 318 Ca -0.30 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.17 2j55 h ALA 318 Cb 1.13 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2j55 h ALA 318 CO 0.94 0.65 0.23 -0.22 0.00 0.00 0.00 179.25 180.85 2j55 h LYS 319 N 0.62 0.71 0.00 0.00 3.64 -1.92 -3.40 116.57 116.23 2j55 h LYS 319 Ca 0.07 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 2j55 h LYS 319 Cb 0.86 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.56 2j55 h LYS 319 CO 0.08 0.60 -1.13 0.25 -2.27 0.00 0.00 179.45 176.98 2j55 n THR 320 N -4.61 0.57 -2.04 1.00 -2.24 -1.17 -4.97 114.28 100.83 2j55 n THR 320 Ca 0.02 -0.55 -0.35 0.00 -2.27 0.00 0.00 64.05 60.90 2j55 n THR 320 Cb 0.12 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.00 2j55 n THR 320 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j55 n GLY 321 N 1.20 1.80 3.68 3.38 0.00 -1.22 -5.05 105.19 108.97 2j55 n GLY 321 Ca -0.01 -1.00 -0.46 0.00 0.00 0.00 0.00 46.02 44.55 2j55 n GLY 321 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2j55 n GLU 322 N 8.00 2.28 -1.69 1.61 2.13 -1.25 -4.61 120.64 127.10 2j55 n GLU 322 Ca 0.47 0.83 -0.43 0.00 0.66 0.00 0.00 57.16 58.68 2j55 n GLU 322 Cb 0.45 -2.63 -0.03 0.00 0.27 0.00 0.00 31.44 29.50 2j55 n GLU 322 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2j55 n ARG 323 N 4.38 2.66 -0.07 5.31 0.63 -1.26 -1.24 116.66 127.06 2j55 n ARG 323 Ca 0.18 0.96 -0.05 0.00 -0.92 0.00 0.00 57.85 58.03 2j55 n ARG 323 Cb 0.30 -2.83 -0.16 0.00 0.45 0.00 0.00 32.46 30.23 2j55 n ARG 323 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2j55 n LEU 324 N 5.11 0.08 -3.54 6.15 4.77 0.12 -4.91 117.00 124.77 2j55 n LEU 324 Ca 0.18 0.04 -0.07 0.00 -0.03 0.00 0.00 56.01 56.12 2j55 n LEU 324 Cb 0.35 0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 41.77 2j55 n LEU 324 CO 0.66 0.36 0.72 0.00 -1.33 0.00 0.00 177.39 177.80 2j55 s ALA 325 N -2.76 -1.82 -0.05 -1.18 0.00 -1.03 -4.99 121.76 109.93 2j55 s ALA 325 Ca -0.09 0.92 -0.02 0.00 0.00 0.00 0.00 51.96 52.77 2j55 s ALA 325 Cb 0.08 0.42 0.04 0.00 0.00 0.00 0.00 23.12 23.65 2j55 s ALA 325 CO 0.85 -0.74 0.10 0.21 0.00 0.00 0.00 175.76 176.18 2j55 s LYS 326 N -3.09 -0.02 -0.02 0.00 2.20 -1.26 -1.22 119.74 116.32 2j55 s LYS 326 Ca 0.06 0.41 0.05 0.00 -0.36 0.00 0.00 55.97 56.13 2j55 s LYS 326 Cb -0.01 -0.36 -0.03 0.00 -1.51 0.00 0.00 37.83 35.92 2j55 s LYS 326 CO -0.07 -0.28 -0.14 -0.06 -0.36 0.00 0.00 175.35 174.43 2j55 s PHE 327 N 1.93 2.68 -0.31 4.03 0.08 0.13 -4.95 117.98 121.57 2j55 s PHE 327 Ca 0.01 -0.17 -0.16 0.00 0.12 0.00 0.00 56.93 56.72 2j55 s PHE 327 Cb -0.12 -1.58 -0.02 0.00 -0.57 0.00 0.00 43.02 40.73 2j55 s PHE 327 CO -0.04 0.22 0.44 -2.00 -0.10 0.00 0.00 175.22 173.74 2j55 s GLU 328 N -0.99 3.82 0.24 0.44 2.12 -1.26 -1.95 118.70 121.12 2j55 s GLU 328 Ca 0.13 -0.06 0.15 0.00 0.36 0.00 0.00 54.97 55.56 2j55 s GLU 328 Cb -0.11 -3.73 0.03 0.00 0.26 0.00 0.00 34.13 30.58 2j55 s GLU 328 CO 0.03 -0.45 1.35 0.52 -0.54 0.00 0.00 175.26 176.17 2j55 h MET 329 N 8.29 0.00 0.00 4.30 2.86 -1.19 -3.48 114.93 125.71 2j55 h MET 329 Ca -0.30 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 2j55 h MET 329 Cb 1.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.80 2j55 h MET 329 CO 0.70 0.47 0.00 0.41 1.06 0.00 0.00 176.91 179.56 2j55 n GLY 330 N 1.25 0.70 3.42 8.32 0.00 -1.26 -4.91 105.19 112.70 2j55 n GLY 330 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 2j55 n GLY 330 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2j55 s HIS 331 N -2.45 -0.03 -0.58 1.61 3.76 -1.26 -5.11 115.29 111.24 2j55 s HIS 331 Ca 0.00 -0.32 -0.27 0.00 -0.15 0.00 0.00 55.06 54.32 2j55 s HIS 331 Cb 0.00 0.25 0.03 0.00 1.11 0.00 0.00 32.58 33.98 2j55 s HIS 331 CO 0.00 -0.81 1.14 -1.21 -0.85 0.00 0.00 174.74 173.01 2j55 s GLU 332 N -3.87 3.47 -0.24 1.40 0.41 -1.26 -4.50 118.70 114.10 2j55 s GLU 332 Ca 0.09 0.13 -0.08 0.00 -0.41 0.00 0.00 54.97 54.70 2j55 s GLU 332 Cb 0.01 -4.02 -0.04 0.00 -1.78 0.00 0.00 34.13 28.30 2j55 s GLU 332 CO -0.05 -1.65 0.10 0.42 -0.49 0.00 0.00 175.26 173.60 2j55 s ILE 333 N 4.75 4.67 -0.14 -1.63 -1.09 -0.66 -4.33 121.20 122.77 2j55 s ILE 333 Ca 0.40 -0.06 0.07 0.00 -2.23 0.00 0.00 60.65 58.84 2j55 s ILE 333 Cb -0.08 -3.18 -0.23 0.00 -1.58 0.00 0.00 42.46 37.38 2j55 s ILE 333 CO 0.24 0.34 0.27 0.47 -1.23 0.00 0.00 174.94 175.03 2j55 n ASP 334 N 4.70 1.15 -3.96 3.58 8.00 -0.52 -0.77 116.55 128.72 2j55 n ASP 334 Ca -0.16 0.15 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 2j55 n ASP 334 Cb 0.52 -0.04 -0.13 0.00 -0.02 0.00 0.00 41.12 41.45 2j55 n ASP 334 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2j55 s SER 335 N -6.24 0.46 0.08 -2.24 0.01 -0.77 -0.04 113.70 104.96 2j55 s SER 335 Ca -0.16 -0.25 0.05 0.00 1.31 0.00 0.00 55.95 56.90 2j55 s SER 335 Cb 0.07 0.00 -0.03 0.00 0.21 0.00 0.00 66.02 66.27 2j55 s SER 335 CO 0.77 -0.08 -0.13 0.27 0.41 0.00 0.00 173.24 174.48 2j55 s ILE 336 N -0.62 1.09 0.33 1.44 -4.36 -0.71 -0.28 121.20 118.10 2j55 s ILE 336 Ca -0.04 -1.40 -0.11 0.00 -0.26 0.00 0.00 60.65 58.84 2j55 s ILE 336 Cb -0.05 -1.15 0.02 0.00 1.25 0.00 0.00 42.46 42.53 2j55 s ILE 336 CO -0.00 -0.31 0.61 0.21 0.24 0.00 0.00 174.94 175.69 2j55 s ASN 337 N -1.93 0.28 0.08 4.36 3.84 -0.97 -4.62 114.94 115.98 2j55 s ASN 337 Ca 0.00 -1.17 0.05 0.00 0.21 0.00 0.00 52.86 51.95 2j55 s ASN 337 Cb -0.08 0.72 -0.03 0.00 -0.55 0.00 0.00 41.25 41.31 2j55 s ASN 337 CO 0.02 -1.41 -0.14 0.68 -2.79 0.00 0.00 177.10 173.46 2j55 s VAL 338 N -3.06 1.11 0.67 -5.21 -7.23 -1.26 -0.47 120.40 104.95 2j55 s VAL 338 Ca 0.22 -1.38 -0.13 0.00 -1.81 0.00 0.00 61.98 58.87 2j55 s VAL 338 Cb -0.03 -1.14 0.00 0.00 0.56 0.00 0.00 36.38 35.78 2j55 s VAL 338 CO 0.14 -0.28 1.08 -0.94 -0.31 0.00 0.00 175.10 174.79 2j55 s SER 339 N -1.89 5.20 -0.09 4.85 1.04 -0.81 -4.85 113.70 117.16 2j55 s SER 339 Ca -0.00 1.83 0.17 0.00 0.48 0.00 0.00 55.95 58.43 2j55 s SER 339 Cb -0.09 -2.53 0.60 0.00 0.10 0.00 0.00 66.02 64.10 2j55 s SER 339 CO 0.02 -1.56 1.51 0.00 0.98 0.00 0.00 173.24 174.19 2j55 n GLN 340 N -2.71 3.37 -2.46 4.02 1.13 -1.26 -4.58 117.38 114.89 2j55 n GLN 340 Ca 0.09 -2.69 -0.25 0.00 -1.94 0.00 0.00 57.00 52.21 2j55 n GLN 340 Cb 0.53 -1.73 0.14 0.00 0.11 0.00 0.00 30.24 29.28 2j55 n GLN 340 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2j55 s ASP 341 N -1.11 3.91 0.14 1.08 -4.77 -1.26 -4.75 116.67 109.90 2j55 s ASP 341 Ca 0.43 -0.34 -0.24 0.00 -3.30 0.00 0.00 52.55 49.11 2j55 s ASP 341 Cb 0.28 0.12 -0.01 0.00 -1.09 0.00 0.00 42.92 42.22 2j55 s ASP 341 CO 0.20 -2.17 1.63 -0.33 0.70 0.00 0.00 175.17 175.20 2j55 h GLU 342 N -0.85 -0.32 -2.74 2.11 5.08 -2.02 -3.22 114.58 112.62 2j55 h GLU 342 Ca -0.37 0.02 -0.68 0.00 -1.00 0.00 0.00 59.36 57.33 2j55 h GLU 342 Cb 1.25 0.07 -0.37 0.00 0.50 0.00 0.00 28.75 30.21 2j55 h GLU 342 CO 0.36 -0.21 -0.12 1.63 -1.00 0.00 0.00 179.01 179.67 2j55 n LYS 343 N -5.38 2.98 -1.03 2.33 5.02 -1.26 -5.01 118.16 115.81 2j55 n LYS 343 Ca -0.03 -4.58 -0.34 0.00 -2.02 0.00 0.00 58.31 51.34 2j55 n LYS 343 Cb 0.30 -2.36 0.12 0.00 -0.02 0.00 0.00 35.03 33.06 2j55 n LYS 343 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2j55 n PRO 344 N 1.44 0.06 -3.34 1.97 -0.04 -1.22 -4.85 135.00 129.02 2j55 n PRO 344 Ca 0.26 0.09 -0.35 0.00 -0.04 0.00 0.00 63.50 63.46 2j55 n PRO 344 Cb 0.37 -2.24 -0.06 0.00 -0.04 0.00 0.00 33.50 31.53 2j55 n PRO 344 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2j55 s LEU 345 N -4.18 4.33 -0.25 1.53 1.43 -1.26 -2.15 118.68 118.13 2j55 s LEU 345 Ca 0.69 1.10 -0.04 0.00 -1.03 0.00 0.00 54.13 54.85 2j55 s LEU 345 Cb -0.28 -3.32 0.00 0.00 0.03 0.00 0.00 46.19 42.63 2j55 s LEU 345 CO 0.55 0.09 -0.01 -0.22 0.23 0.00 0.00 176.35 176.99 2j55 s LEU 346 N -2.00 3.28 -0.06 1.79 2.96 0.68 -1.92 118.68 123.41 2j55 s LEU 346 Ca 0.39 -0.60 -0.16 0.00 -0.22 0.00 0.00 54.13 53.54 2j55 s LEU 346 Cb -0.15 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 2j55 s LEU 346 CO 0.19 -0.10 0.42 -0.31 -1.32 0.00 0.00 176.35 175.23 2j55 s TYR 347 N 1.45 3.62 -0.20 5.38 2.02 0.38 -0.32 117.35 129.69 2j55 s TYR 347 Ca 0.03 0.91 -0.05 0.00 -0.37 0.00 0.00 57.07 57.60 2j55 s TYR 347 Cb -0.16 -2.39 0.07 0.00 -0.40 0.00 0.00 41.96 39.09 2j55 s TYR 347 CO -0.02 0.43 0.09 0.00 -1.57 0.00 0.00 175.55 174.49 2j55 s ALA 348 N -0.32 0.54 -0.19 3.71 0.00 -0.02 -2.28 121.76 123.19 2j55 s ALA 348 Ca 0.24 -0.51 -0.07 0.00 0.00 0.00 0.00 51.96 51.62 2j55 s ALA 348 Cb -0.16 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 2j55 s ALA 348 CO 0.11 -1.27 0.06 -1.17 0.00 0.00 0.00 175.76 173.49 2j55 s LEU 349 N 2.09 3.71 -0.36 0.00 2.96 0.62 -0.61 118.68 127.09 2j55 s LEU 349 Ca 0.03 0.02 -0.13 0.00 -0.22 0.00 0.00 54.13 53.83 2j55 s LEU 349 Cb -0.16 -1.94 0.00 0.00 0.50 0.00 0.00 46.19 44.59 2j55 s LEU 349 CO -0.14 0.14 0.24 -0.55 -1.32 0.00 0.00 176.35 174.72 2j55 s SER 350 N 0.58 5.97 0.20 3.68 0.15 -0.22 -1.43 113.70 122.63 2j55 s SER 350 Ca 0.03 -0.64 -0.10 0.00 0.70 0.00 0.00 55.95 55.94 2j55 s SER 350 Cb -0.13 -2.11 0.21 0.00 -1.71 0.00 0.00 66.02 62.28 2j55 s SER 350 CO 0.01 -0.31 1.81 0.74 1.20 0.00 0.00 173.24 176.69 2j55 h THR 351 N 5.60 0.99 -0.19 6.45 2.02 -1.81 -1.20 112.91 124.76 2j55 h THR 351 Ca -0.29 -0.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.54 2j55 h THR 351 Cb 1.14 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2j55 h THR 351 CO 0.66 0.13 -0.35 1.23 0.37 0.00 0.00 175.52 177.56 2j55 h GLY 352 N 0.69 0.43 1.09 2.16 0.00 -1.89 -2.83 103.07 102.73 2j55 h GLY 352 Ca 0.28 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2j55 h GLY 352 CO -0.16 0.36 -0.32 1.22 0.00 0.00 0.00 176.54 177.63 2j55 n ASP 353 N -4.06 0.46 -4.09 0.19 8.00 -1.17 -4.95 116.55 110.93 2j55 n ASP 353 Ca -0.01 -0.22 -0.28 0.00 0.71 0.00 0.00 54.79 54.99 2j55 n ASP 353 Cb 0.46 0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.56 2j55 n ASP 353 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2j55 n LYS 354 N -1.33 -2.64 -3.78 -1.24 4.01 -0.48 -4.59 118.16 108.11 2j55 n LYS 354 Ca 0.08 0.32 -0.14 0.00 -0.51 0.00 0.00 58.31 58.05 2j55 n LYS 354 Cb 0.33 -4.36 -0.15 0.00 -0.51 0.00 0.00 35.03 30.34 2j55 n LYS 354 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2j55 s THR 355 N -3.98 -0.04 -0.32 -0.18 2.01 -1.06 -1.43 115.64 110.65 2j55 s THR 355 Ca 0.10 0.15 -0.17 0.00 0.31 0.00 0.00 61.69 62.09 2j55 s THR 355 Cb -0.06 -0.13 -0.02 0.00 0.01 0.00 0.00 72.50 72.31 2j55 s THR 355 CO 0.92 0.06 0.47 -0.22 -0.69 0.00 0.00 174.62 175.17 2j55 s LEU 356 N 0.85 4.24 -0.16 4.42 2.96 -0.24 -1.05 118.68 129.69 2j55 s LEU 356 Ca -0.07 0.12 -0.16 0.00 -0.22 0.00 0.00 54.13 53.80 2j55 s LEU 356 Cb -0.09 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.01 2j55 s LEU 356 CO -0.03 -0.37 0.38 -0.31 -1.32 0.00 0.00 176.35 174.70 2j55 s TYR 357 N 2.27 3.45 -0.18 5.38 2.02 0.22 -0.55 117.35 129.96 2j55 s TYR 357 Ca 0.18 0.70 -0.02 0.00 -0.37 0.00 0.00 57.07 57.55 2j55 s TYR 357 Cb -0.16 -2.46 -0.01 0.00 -0.40 0.00 0.00 41.96 38.93 2j55 s TYR 357 CO 0.12 0.14 -0.08 0.42 -1.57 0.00 0.00 175.55 174.58 2j55 s ILE 358 N 0.76 3.19 0.07 2.71 1.01 -0.22 -0.84 121.20 127.87 2j55 s ILE 358 Ca 0.20 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.36 2j55 s ILE 358 Cb -0.14 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 2j55 s ILE 358 CO 0.07 0.47 -0.22 -1.00 0.00 0.00 0.00 174.94 174.26 2j55 s HIS 359 N 1.00 1.95 -0.13 3.97 3.76 0.57 0.22 115.29 126.63 2j55 s HIS 359 Ca -0.01 -0.39 -0.29 0.00 -0.15 0.00 0.00 55.06 54.22 2j55 s HIS 359 Cb -0.15 -1.13 -0.05 0.00 1.11 0.00 0.00 32.58 32.36 2j55 s HIS 359 CO -0.01 0.15 1.82 0.34 -0.85 0.00 0.00 174.74 176.19 2j55 s ASP 360 N -1.44 6.28 0.30 1.40 -1.08 0.13 -0.23 116.67 122.04 2j55 s ASP 360 Ca 0.09 2.04 0.03 0.00 -0.52 0.00 0.00 52.55 54.18 2j55 s ASP 360 Cb -0.09 -2.53 0.48 0.00 -1.46 0.00 0.00 42.92 39.32 2j55 s ASP 360 CO 0.03 -1.27 1.79 0.00 0.52 0.00 0.00 175.17 176.24 2j55 h ALA 361 N 11.25 1.22 0.12 3.66 0.00 -1.72 0.20 119.26 133.98 2j55 h ALA 361 Ca -0.40 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.23 2j55 h ALA 361 Cb 1.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2j55 h ALA 361 CO 0.97 0.51 -0.06 1.49 0.00 0.00 0.00 179.25 182.16 2j55 h GLU 362 N 0.50 -0.15 0.00 0.00 4.57 -1.93 -3.34 114.58 114.23 2j55 h GLU 362 Ca 0.09 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2j55 h GLU 362 Cb 0.49 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 2j55 h GLU 362 CO 0.03 0.08 -1.53 -1.13 -1.18 0.00 0.00 179.01 175.27 2j55 n SER 363 N -5.06 0.38 0.00 1.04 3.41 -1.22 -4.98 113.62 107.18 2j55 n SER 363 Ca -0.08 -0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 2j55 n SER 363 Cb 0.17 1.42 0.00 0.00 -0.26 0.00 0.00 64.21 65.54 2j55 n SER 363 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j55 n GLY 364 N 1.31 0.59 3.74 5.00 0.00 0.70 -5.00 105.19 111.52 2j55 n GLY 364 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2j55 n GLY 364 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j55 s GLU 365 N -0.38 4.42 0.01 1.61 0.41 -1.24 -4.73 118.70 118.81 2j55 s GLU 365 Ca 0.00 2.00 -0.30 0.00 -0.41 0.00 0.00 54.97 56.26 2j55 s GLU 365 Cb 0.00 -3.21 -0.07 0.00 -1.78 0.00 0.00 34.13 29.08 2j55 s GLU 365 CO 0.00 -0.20 1.61 -2.00 -0.49 0.00 0.00 175.26 174.18 2j55 s GLU 366 N -0.21 4.21 -0.25 1.61 2.12 -1.26 -0.70 118.70 124.22 2j55 s GLU 366 Ca 0.55 2.21 -0.00 0.00 0.36 0.00 0.00 54.97 58.09 2j55 s GLU 366 Cb -0.35 -3.74 -0.17 0.00 0.26 0.00 0.00 34.13 30.13 2j55 s GLU 366 CO 0.38 -0.75 -0.20 1.28 -0.54 0.00 0.00 175.26 175.44 2j55 n LEU 367 N 6.13 2.85 0.00 2.70 4.77 0.13 -4.93 117.00 128.66 2j55 n LEU 367 Ca 0.16 -0.07 -0.04 0.00 -0.03 0.00 0.00 56.01 56.03 2j55 n LEU 367 Cb 0.42 -0.92 0.02 0.00 -2.33 0.00 0.00 43.42 40.61 2j55 n LEU 367 CO 0.62 0.90 0.72 -2.11 -1.33 0.00 0.00 177.39 176.18 2j55 n ARG 368 N -3.38 0.71 -3.90 3.23 1.85 -1.07 -5.00 116.66 109.11 2j55 n ARG 368 Ca -0.46 -1.55 -0.09 0.00 -1.00 0.00 0.00 57.85 54.75 2j55 n ARG 368 Cb 0.98 2.06 -0.05 0.00 -1.05 0.00 0.00 32.46 34.40 2j55 n ARG 368 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2j55 s SER 369 N -3.25 -0.10 -0.09 2.89 1.04 -1.26 -1.06 113.70 111.87 2j55 s SER 369 Ca 0.20 -0.77 -0.03 0.00 0.48 0.00 0.00 55.95 55.84 2j55 s SER 369 Cb -0.03 0.54 0.04 0.00 0.10 0.00 0.00 66.02 66.66 2j55 s SER 369 CO 0.06 -1.03 0.05 -0.69 0.98 0.00 0.00 173.24 172.61 2j55 s VAL 370 N -3.96 0.07 0.07 5.02 1.01 0.29 -4.82 120.40 118.08 2j55 s VAL 370 Ca 0.16 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.27 2j55 s VAL 370 Cb 0.00 -0.43 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2j55 s VAL 370 CO 0.02 0.05 0.09 -0.46 0.00 0.00 0.00 175.10 174.80 2j55 n ASN 371 N 5.23 0.31 -3.76 3.32 6.94 -1.26 -1.08 115.26 124.97 2j55 n ASN 371 Ca -0.06 -1.18 -0.27 0.00 -0.02 0.00 0.00 54.58 53.06 2j55 n ASN 371 Cb 0.49 -0.04 0.05 0.00 -2.36 0.00 0.00 39.78 37.92 2j55 n ASN 371 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2j55 n GLN 372 N -1.11 -6.70 -1.96 -3.83 6.02 -0.96 -4.88 117.38 103.96 2j55 n GLN 372 Ca 0.02 0.71 -0.38 0.00 -0.01 0.00 0.00 57.00 57.34 2j55 n GLN 372 Cb 0.07 -5.68 -0.01 0.00 1.02 0.00 0.00 30.24 25.64 2j55 n GLN 372 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2j55 n LEU 373 N -4.83 7.69 0.00 1.08 4.77 -0.51 -5.00 117.00 120.20 2j55 n LEU 373 Ca 0.02 -4.78 0.00 0.00 -0.03 0.00 0.00 56.01 51.22 2j55 n LEU 373 Cb 0.55 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 2j55 n LEU 373 CO 0.70 1.99 0.00 0.61 -1.33 0.00 0.00 177.39 179.37 2j55 n GLY 374 N 1.35 -0.03 0.08 -0.72 0.00 -1.26 -3.99 105.19 100.62 2j55 n GLY 374 Ca 0.58 -1.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.52 2j55 n GLY 374 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2j55 n HIS 375 N 2.15 0.00 -2.74 1.61 8.25 -1.26 -4.80 115.22 118.42 2j55 n HIS 375 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 2j55 n HIS 375 Cb 0.00 -0.78 0.07 0.00 1.12 0.00 0.00 29.99 30.40 2j55 n HIS 375 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j55 n GLY 376 N 2.05 0.36 3.74 -1.41 0.00 -1.26 -4.85 105.19 103.81 2j55 n GLY 376 Ca -0.26 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2j55 n GLY 376 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j55 s PRO 377 N 0.45 4.22 0.00 1.61 0.04 -1.26 -4.00 135.00 136.06 2j55 s PRO 377 Ca 0.26 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.69 2j55 s PRO 377 Cb 0.27 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.71 2j55 s PRO 377 CO -0.13 -0.52 0.00 1.04 0.04 0.00 0.00 177.00 177.42 2j55 n GLN 378 N 2.72 2.49 -5.03 4.56 6.02 -0.45 -3.71 117.38 123.98 2j55 n GLN 378 Ca 0.09 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.79 2j55 n GLN 378 Cb 0.39 -0.78 -0.17 0.00 1.02 0.00 0.00 30.24 30.70 2j55 n GLN 378 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2j55 s VAL 379 N -1.28 1.76 -0.06 5.09 1.01 -1.03 -4.54 120.40 121.35 2j55 s VAL 379 Ca 0.00 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.17 2j55 s VAL 379 Cb 0.00 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 2j55 s VAL 379 CO 0.00 0.49 -0.23 -0.63 0.00 0.00 0.00 175.10 174.74 2j55 s ILE 380 N 0.28 2.29 0.00 2.22 1.01 -1.26 -0.26 121.20 125.48 2j55 s ILE 380 Ca -0.13 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.54 2j55 s ILE 380 Cb -0.16 -1.85 -0.00 0.00 0.01 0.00 0.00 42.46 40.46 2j55 s ILE 380 CO 0.06 0.57 -0.04 -0.89 0.00 0.00 0.00 174.94 174.64 2j55 s THR 381 N -0.24 0.27 0.14 2.92 2.01 -0.32 -4.90 115.64 115.52 2j55 s THR 381 Ca -0.01 -0.22 0.05 0.00 0.31 0.00 0.00 61.69 61.82 2j55 s THR 381 Cb -0.13 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.09 2j55 s THR 381 CO 0.03 0.03 -0.11 0.42 -0.69 0.00 0.00 174.62 174.30 2j55 s THR 382 N -0.20 1.21 0.02 -0.82 -4.23 -1.26 -0.96 115.64 109.40 2j55 s THR 382 Ca 0.00 -1.94 -0.13 0.00 -1.18 0.00 0.00 61.69 58.44 2j55 s THR 382 Cb -0.02 -1.73 -0.06 0.00 1.34 0.00 0.00 72.50 72.04 2j55 s THR 382 CO -0.00 -0.64 0.40 0.00 -0.54 0.00 0.00 174.62 173.83 2j55 s ALA 383 N -2.93 3.71 -0.67 3.99 0.00 -1.26 -4.92 121.76 119.68 2j55 s ALA 383 Ca 0.14 -0.27 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 2j55 s ALA 383 Cb -0.00 -2.34 0.17 0.00 0.00 0.00 0.00 23.12 20.95 2j55 s ALA 383 CO 0.01 0.51 0.58 0.34 0.00 0.00 0.00 175.76 177.21 2j55 s ASP 384 N -1.25 6.22 0.19 0.00 -1.08 -1.24 -4.60 116.67 114.91 2j55 s ASP 384 Ca 0.26 -2.38 0.23 0.00 -0.52 0.00 0.00 52.55 50.14 2j55 s ASP 384 Cb -0.16 -2.12 0.07 0.00 -1.46 0.00 0.00 42.92 39.25 2j55 s ASP 384 CO 0.14 -0.63 1.11 0.24 0.52 0.00 0.00 175.17 176.55 2j55 h MET 385 N 8.03 0.00 -0.00 4.34 2.86 -1.88 -3.41 114.93 124.87 2j55 h MET 385 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2j55 h MET 385 Cb 1.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.71 2j55 h MET 385 CO 0.83 0.00 0.00 0.41 1.06 0.00 0.00 176.91 179.21