#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jj4 n GLY 9 N 0.00 -0.89 1.50 0.00 0.00 -1.26 -5.14 105.19 99.40 2jj4 n GLY 9 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2jj4 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj4 n ALA 10 N -0.74 2.81 -3.07 4.61 0.00 -1.26 -4.83 120.51 118.04 2jj4 n ALA 10 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.99 2jj4 n ALA 10 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2jj4 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jj4 s ALA 11 N -2.00 3.42 -0.31 0.00 0.00 -1.26 -4.90 121.76 116.71 2jj4 s ALA 11 Ca 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 51.96 49.64 2jj4 s ALA 11 Cb 0.00 -3.65 0.30 0.00 0.00 0.00 0.00 23.12 19.78 2jj4 s ALA 11 CO 0.00 -2.49 1.77 -3.47 0.00 0.00 0.00 175.76 171.57 2jj4 n ASP 12 N 6.38 5.07 0.00 0.00 2.03 -1.26 -4.50 116.55 124.27 2jj4 n ASP 12 Ca -0.03 -3.02 0.00 0.00 0.52 0.00 0.00 54.79 52.26 2jj4 n ASP 12 Cb 0.44 -0.87 0.00 0.00 -0.72 0.00 0.00 41.12 39.97 2jj4 n ASP 12 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2jj4 n ARG 13 N -0.09 0.00 -0.00 -0.67 1.85 -1.26 -1.71 116.66 114.77 2jj4 n ARG 13 Ca 0.33 0.37 -0.12 0.00 -1.00 0.00 0.00 57.85 57.43 2jj4 n ARG 13 Cb 0.85 -1.59 -0.08 0.00 -1.05 0.00 0.00 32.46 30.59 2jj4 n ARG 13 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2jj4 h VAL 14 N 0.00 1.25 -0.99 8.89 2.07 -1.99 -1.95 116.25 123.52 2jj4 h VAL 14 Ca 0.00 -0.74 0.11 0.00 0.82 0.00 0.00 66.70 66.88 2jj4 h VAL 14 Cb 0.19 1.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.57 2jj4 h VAL 14 CO 0.00 0.20 0.62 0.03 0.02 0.00 0.00 177.57 178.44 2jj4 h ARG 15 N -0.25 0.98 0.00 1.57 -0.00 -1.73 0.18 114.38 115.13 2jj4 h ARG 15 Ca 0.01 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.98 59.41 2jj4 h ARG 15 Cb 0.32 -0.22 -0.00 0.00 0.00 0.00 0.00 29.97 30.06 2jj4 h ARG 15 CO 0.00 0.65 -0.11 -0.84 0.00 0.00 0.00 179.97 179.67 2jj4 h ILE 16 N 1.01 0.22 0.11 2.04 3.07 -1.68 -3.04 117.51 119.24 2jj4 h ILE 16 Ca 0.48 -1.04 -0.28 0.00 1.55 0.00 0.00 64.86 65.57 2jj4 h ILE 16 Cb 0.42 1.87 0.03 0.00 -0.27 0.00 0.00 36.82 38.87 2jj4 h ILE 16 CO -0.25 0.11 -1.15 0.17 -1.05 0.00 0.00 178.15 175.98 2jj4 h LEU 17 N 0.00 0.82 -2.27 0.16 -0.00 0.06 -3.15 115.31 110.93 2jj4 h LEU 17 Ca -0.00 -0.83 -0.01 0.00 -0.00 0.00 0.00 57.88 57.04 2jj4 h LEU 17 Cb 0.86 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 41.26 2jj4 h LEU 17 CO 0.01 1.56 -0.05 -1.28 -0.00 0.00 0.00 178.44 178.69 2jj4 h SER 18 N 0.19 0.00 1.21 0.17 0.87 -0.99 -2.17 113.55 112.84 2jj4 h SER 18 Ca -0.17 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 2jj4 h SER 18 Cb 1.84 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.80 2jj4 h SER 18 CO 0.22 0.05 0.00 -0.62 -0.53 0.00 0.00 176.83 175.95 2jj4 n GLU 19 N -3.63 0.14 0.13 2.24 1.02 -1.15 -2.99 120.64 116.40 2jj4 n GLU 19 Ca -0.02 0.14 0.12 0.00 -0.02 0.00 0.00 57.16 57.37 2jj4 n GLU 19 Cb 0.15 -1.67 0.22 0.00 -0.02 0.00 0.00 31.44 30.12 2jj4 n GLU 19 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jj4 h ALA 20 N 2.71 0.82 -0.73 0.62 0.00 -1.47 -3.39 119.26 117.83 2jj4 h ALA 20 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.07 2jj4 h ALA 20 Cb 0.61 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.28 2jj4 h ALA 20 CO 0.00 0.00 0.11 1.25 0.00 0.00 0.00 179.25 180.61 2jj4 h LEU 21 N 0.00 -0.13 -1.01 0.00 7.12 -1.64 0.07 115.31 119.72 2jj4 h LEU 21 Ca 0.00 0.16 -0.01 0.00 0.13 0.00 0.00 57.88 58.17 2jj4 h LEU 21 Cb 0.85 0.25 -0.04 0.00 -0.53 0.00 0.00 40.66 41.19 2jj4 h LEU 21 CO 0.00 -0.10 0.53 -0.65 -0.13 0.00 0.00 178.44 178.10 2jj4 h PRO 22 N 0.19 1.22 -0.24 5.25 0.11 -1.83 -0.06 132.00 136.65 2jj4 h PRO 22 Ca 0.41 -0.11 -0.15 0.00 0.11 0.00 0.00 66.00 66.25 2jj4 h PRO 22 Cb 0.71 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 31.56 2jj4 h PRO 22 CO -0.56 0.86 -0.45 1.88 -0.21 0.00 0.00 178.00 179.52 2jj4 h TYR 23 N 1.24 0.91 -0.96 0.65 -1.99 -1.52 -1.00 116.97 114.30 2jj4 h TYR 23 Ca 0.32 -0.33 0.08 0.00 2.00 0.00 0.00 58.73 60.80 2jj4 h TYR 23 Cb -0.04 -0.17 -0.07 0.00 2.00 0.00 0.00 36.73 38.45 2jj4 h TYR 23 CO 0.01 1.11 0.61 -0.07 -0.00 0.00 0.00 178.16 179.81 2jj4 h LEU 24 N 0.45 0.94 -0.52 3.88 3.38 -0.67 -0.88 115.31 121.90 2jj4 h LEU 24 Ca 0.01 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 2jj4 h LEU 24 Cb 1.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2jj4 h LEU 24 CO 0.10 0.58 -0.51 1.56 0.09 0.00 0.00 178.44 180.26 2jj4 h GLN 25 N 1.07 0.62 -0.60 1.13 4.20 -0.92 -2.82 115.11 117.78 2jj4 h GLN 25 Ca 0.43 -0.37 -0.05 0.00 0.06 0.00 0.00 58.65 58.72 2jj4 h GLN 25 Cb 0.25 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 2jj4 h GLN 25 CO -0.20 0.98 0.17 0.37 -0.67 0.00 0.00 178.83 179.48 2jj4 h GLN 26 N 0.48 0.92 -0.17 1.46 4.15 0.23 -2.86 115.11 119.33 2jj4 h GLN 26 Ca 0.02 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.25 2jj4 h GLN 26 Cb 1.05 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.60 2jj4 h GLN 26 CO 0.10 0.81 0.00 1.19 -1.93 0.00 0.00 178.83 179.00 2jj4 n PHE 27 N -4.27 0.56 -1.68 3.99 3.01 -0.97 -5.01 117.46 113.09 2jj4 n PHE 27 Ca 0.05 -0.86 -0.48 0.00 1.01 0.00 0.00 57.45 57.17 2jj4 n PHE 27 Cb 0.22 -0.22 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 2jj4 n PHE 27 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jj4 n ALA 28 N -0.70 1.02 -0.98 4.37 0.00 -1.06 -0.62 120.51 122.54 2jj4 n ALA 28 Ca 0.18 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.94 2jj4 n ALA 28 Cb 0.74 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2jj4 n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jj4 n GLY 29 N 4.18 0.90 3.88 0.00 0.00 -1.17 -5.00 105.19 107.97 2jj4 n GLY 29 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2jj4 n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj4 s ARG 30 N -0.06 3.62 -0.13 1.61 1.81 0.21 -4.66 118.95 121.35 2jj4 s ARG 30 Ca 0.00 0.64 -0.07 0.00 -1.72 0.00 0.00 55.73 54.58 2jj4 s ARG 30 Cb 0.00 -2.16 -0.04 0.00 -0.45 0.00 0.00 34.95 32.30 2jj4 s ARG 30 CO 0.00 -0.45 0.12 0.99 -0.68 0.00 0.00 175.30 175.28 2jj4 s THR 31 N -3.01 5.30 -0.12 0.02 2.01 -1.26 -0.48 115.64 118.09 2jj4 s THR 31 Ca 0.54 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.66 2jj4 s THR 31 Cb -0.11 -3.32 0.04 0.00 0.01 0.00 0.00 72.50 69.11 2jj4 s THR 31 CO 0.49 0.58 -0.02 -0.69 -0.69 0.00 0.00 174.62 174.29 2jj4 s VAL 32 N -0.67 0.72 -0.31 3.82 1.01 0.59 -1.78 120.40 123.78 2jj4 s VAL 32 Ca 0.13 -0.26 -0.12 0.00 0.00 0.00 0.00 61.98 61.72 2jj4 s VAL 32 Cb -0.12 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 2jj4 s VAL 32 CO 0.02 0.18 0.24 -0.69 0.00 0.00 0.00 175.10 174.85 2jj4 s VAL 33 N 1.81 5.28 -0.12 2.92 1.01 -0.37 -0.29 120.40 130.64 2jj4 s VAL 33 Ca 0.03 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.00 2jj4 s VAL 33 Cb -0.14 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 2jj4 s VAL 33 CO -0.07 0.10 -0.06 -0.69 0.00 0.00 0.00 175.10 174.38 2jj4 s VAL 34 N 1.78 3.75 -0.57 2.92 1.01 0.11 -0.50 120.40 128.90 2jj4 s VAL 34 Ca 0.07 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.44 2jj4 s VAL 34 Cb -0.17 -2.60 0.10 0.00 0.00 0.00 0.00 36.38 33.72 2jj4 s VAL 34 CO 0.11 0.54 0.66 -1.59 0.00 0.00 0.00 175.10 174.82 2jj4 s LYS 35 N -0.07 3.04 -0.40 2.72 0.00 0.86 -1.02 119.74 124.87 2jj4 s LYS 35 Ca 0.01 -1.32 -0.26 0.00 0.00 0.00 0.00 55.97 54.40 2jj4 s LYS 35 Cb -0.13 -4.25 0.02 0.00 0.00 0.00 0.00 37.83 33.47 2jj4 s LYS 35 CO 0.03 -1.47 0.96 -0.47 0.00 0.00 0.00 175.35 174.40 2jj4 s TYR 36 N 2.53 3.01 -0.01 1.78 5.04 -0.67 -2.10 117.35 126.92 2jj4 s TYR 36 Ca 0.11 0.69 -0.28 0.00 -2.44 0.00 0.00 57.07 55.14 2jj4 s TYR 36 Cb -0.24 -3.82 0.09 0.00 0.35 0.00 0.00 41.96 38.34 2jj4 s TYR 36 CO 0.06 -0.94 0.76 0.20 -1.34 0.00 0.00 175.55 174.30 2jj4 s GLY 37 N 2.03 -0.51 0.00 8.97 0.00 -1.26 -4.12 107.32 112.43 2jj4 s GLY 37 Ca 0.39 1.19 0.00 0.00 0.00 0.00 0.00 44.72 46.31 2jj4 s GLY 37 CO 0.22 0.65 0.00 0.61 0.00 0.00 0.00 173.10 174.58 2jj4 n GLY 38 N 0.33 1.02 0.20 0.20 0.00 -1.26 -3.49 105.19 102.19 2jj4 n GLY 38 Ca -0.15 0.39 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 2jj4 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj4 h ALA 39 N -0.81 -0.37 0.00 4.61 0.00 -1.91 -0.67 119.26 120.11 2jj4 h ALA 39 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2jj4 h ALA 39 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jj4 h ALA 39 CO 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 179.25 178.53 2jj4 n ALA 40 N -2.35 2.33 -0.10 0.00 0.00 -1.23 -3.16 120.51 116.00 2jj4 n ALA 40 Ca -0.09 -0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.08 2jj4 n ALA 40 Cb 0.20 -1.38 -0.12 0.00 0.00 0.00 0.00 19.45 18.15 2jj4 n ALA 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2jj4 n MET 41 N -1.08 0.76 -0.06 0.00 1.56 -0.64 -2.34 117.12 115.31 2jj4 n MET 41 Ca 0.16 0.08 -0.11 0.00 -0.27 0.00 0.00 57.70 57.56 2jj4 n MET 41 Cb 0.11 -1.46 -0.10 0.00 2.15 0.00 0.00 33.22 33.92 2jj4 n MET 41 CO 0.00 0.00 0.00 0.87 -0.73 0.00 0.00 175.97 176.11 2jj4 h LYS 42 N 0.00 -0.01 -6.34 2.12 6.56 -1.16 -3.45 116.57 114.29 2jj4 h LYS 42 Ca -0.50 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 58.52 2jj4 h LYS 42 Cb 1.90 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 33.51 2jj4 h LYS 42 CO -0.04 0.77 0.91 -1.14 -2.06 0.00 0.00 179.45 177.88 2jj4 s GLN 43 N -2.24 4.00 0.18 3.15 -0.44 -1.19 -4.93 119.66 118.19 2jj4 s GLN 43 Ca -0.15 1.16 -0.20 0.00 -2.50 0.00 0.00 55.36 53.67 2jj4 s GLN 43 Cb -0.02 -3.81 0.12 0.00 -1.64 0.00 0.00 33.01 27.66 2jj4 s GLN 43 CO 0.56 -1.01 1.60 1.49 0.50 0.00 0.00 175.29 178.43 2jj4 h GLU 44 N 8.66 -0.16 -0.99 1.67 4.57 -1.92 0.13 114.58 126.55 2jj4 h GLU 44 Ca -0.23 0.01 0.22 0.00 -1.18 0.00 0.00 59.36 58.18 2jj4 h GLU 44 Cb 1.08 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.61 2jj4 h GLU 44 CO 1.03 -0.10 0.63 0.93 -1.18 0.00 0.00 179.01 180.32 2jj4 h GLU 45 N -0.16 0.50 0.12 1.92 4.39 -1.97 0.22 114.58 119.60 2jj4 h GLU 45 Ca 0.22 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 59.72 2jj4 h GLU 45 Cb 0.52 -0.11 0.02 0.00 -0.10 0.00 0.00 28.75 29.07 2jj4 h GLU 45 CO -0.60 0.33 -0.73 -0.07 -1.16 0.00 0.00 179.01 176.78 2jj4 h LEU 46 N 0.52 0.44 -0.28 1.33 3.38 -1.38 -3.07 115.31 116.25 2jj4 h LEU 46 Ca 0.55 -0.94 0.02 0.00 0.09 0.00 0.00 57.88 57.61 2jj4 h LEU 46 Cb 1.21 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 2jj4 h LEU 46 CO -0.29 1.35 0.12 0.50 0.09 0.00 0.00 178.44 180.20 2jj4 h LYS 47 N -0.39 0.25 -0.13 1.13 3.64 0.61 -1.11 116.57 120.57 2jj4 h LYS 47 Ca -0.13 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.17 2jj4 h LYS 47 Cb 1.56 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.32 2jj4 h LYS 47 CO 0.14 0.16 -0.26 1.49 -2.27 0.00 0.00 179.45 178.72 2jj4 h GLU 48 N 0.26 0.23 -0.34 1.90 4.22 -0.78 -2.86 114.58 117.20 2jj4 h GLU 48 Ca 0.12 -0.07 -0.09 0.00 0.08 0.00 0.00 59.36 59.40 2jj4 h GLU 48 Cb 0.06 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2jj4 h GLU 48 CO -0.10 0.48 -0.12 0.00 -2.18 0.00 0.00 179.01 177.08 2jj4 h ALA 49 N 1.53 0.48 0.09 2.92 0.00 -1.29 -3.08 119.26 119.92 2jj4 h ALA 49 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2jj4 h ALA 49 Cb 0.57 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2jj4 h ALA 49 CO 0.04 0.36 -0.09 0.28 0.00 0.00 0.00 179.25 179.84 2jj4 h VAL 50 N 0.47 0.79 -0.62 0.00 2.07 -1.01 -1.34 116.25 116.60 2jj4 h VAL 50 Ca 0.08 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.72 2jj4 h VAL 50 Cb 0.64 0.79 -0.09 0.00 -1.52 0.00 0.00 31.29 31.11 2jj4 h VAL 50 CO 0.04 0.00 0.11 0.24 0.02 0.00 0.00 177.57 177.99 2jj4 h MET 51 N -0.21 0.23 -0.62 1.57 2.07 -1.58 0.22 114.93 116.62 2jj4 h MET 51 Ca 0.01 -0.01 -0.04 0.00 -2.07 0.00 0.00 59.70 57.58 2jj4 h MET 51 Cb 0.20 -0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 29.85 2jj4 h MET 51 CO -0.03 0.15 0.23 0.00 1.07 0.00 0.00 176.91 178.33 2jj4 h ARG 52 N 0.24 0.91 -0.09 1.72 3.08 -1.38 -0.03 114.38 118.82 2jj4 h ARG 52 Ca 0.33 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 2jj4 h ARG 52 Cb 0.51 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 2jj4 h ARG 52 CO -0.44 0.76 0.03 -0.44 -1.07 0.00 0.00 179.97 178.80 2jj4 h ASP 53 N 0.89 0.13 -0.10 7.04 3.32 -0.00 -1.02 116.42 126.67 2jj4 h ASP 53 Ca 0.21 -0.20 0.02 0.00 0.02 0.00 0.00 57.03 57.08 2jj4 h ASP 53 Cb 0.20 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 2jj4 h ASP 53 CO -0.02 0.30 -0.05 0.40 -1.72 0.00 0.00 179.24 178.16 2jj4 h ILE 54 N -0.04 0.85 -0.37 0.35 1.08 -0.21 0.12 117.51 119.28 2jj4 h ILE 54 Ca 0.03 0.00 -0.08 0.00 -0.39 0.00 0.00 64.86 64.42 2jj4 h ILE 54 Cb 0.21 0.85 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 2jj4 h ILE 54 CO -0.00 0.00 -0.12 0.58 -0.69 0.00 0.00 178.15 177.92 2jj4 h VAL 55 N -0.03 1.25 -0.08 1.67 2.07 -1.04 -1.42 116.25 118.66 2jj4 h VAL 55 Ca 0.06 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.47 2jj4 h VAL 55 Cb 0.12 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2jj4 h VAL 55 CO -0.13 0.37 0.05 0.15 0.02 0.00 0.00 177.57 178.03 2jj4 h PHE 56 N 0.59 0.10 -0.13 1.57 3.57 -0.65 0.15 116.94 122.14 2jj4 h PHE 56 Ca 0.10 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.65 2jj4 h PHE 56 Cb 0.55 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.21 2jj4 h PHE 56 CO 0.02 0.09 -0.17 -0.07 -2.23 0.00 0.00 178.31 175.95 2jj4 h LEU 57 N 0.08 -0.54 -0.60 0.59 3.38 -0.70 -0.91 115.31 116.62 2jj4 h LEU 57 Ca 0.03 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.16 2jj4 h LEU 57 Cb 0.02 0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 2jj4 h LEU 57 CO -0.01 -0.22 0.29 0.00 0.09 0.00 0.00 178.44 178.59 2jj4 h ALA 58 N 0.82 0.79 -0.58 1.53 0.00 -1.13 -2.47 119.26 118.21 2jj4 h ALA 58 Ca 0.10 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2jj4 h ALA 58 Cb 0.36 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2jj4 h ALA 58 CO -0.26 -0.08 0.37 0.00 0.00 0.00 0.00 179.25 179.28 2jj4 h VAL 60 N 0.79 1.16 0.00 0.00 2.07 -0.94 -3.46 116.25 115.87 2jj4 h VAL 60 Ca 0.21 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2jj4 h VAL 60 Cb -0.07 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2jj4 h VAL 60 CO -0.04 0.22 0.00 0.61 0.02 0.00 0.00 177.57 178.37 2jj4 n GLY 61 N -1.00 0.58 3.92 2.17 0.00 -1.05 -4.93 105.19 104.88 2jj4 n GLY 61 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2jj4 n GLY 61 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jj4 s MET 62 N 0.00 2.52 -0.55 1.61 1.00 -0.95 -3.06 119.30 119.88 2jj4 s MET 62 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 55.69 55.67 2jj4 s MET 62 Cb 0.00 -2.16 0.14 0.00 0.00 0.00 0.00 34.83 32.81 2jj4 s MET 62 CO 0.00 -1.05 0.31 1.03 0.00 0.00 0.00 175.02 175.31 2jj4 s ARG 63 N -5.20 2.17 0.02 2.03 0.52 0.37 -4.07 118.95 114.78 2jj4 s ARG 63 Ca 0.58 -2.53 -0.19 0.00 -0.52 0.00 0.00 55.73 53.06 2jj4 s ARG 63 Cb -0.11 -3.47 -0.06 0.00 0.52 0.00 0.00 34.95 31.83 2jj4 s ARG 63 CO 0.46 -1.12 0.56 -1.25 0.02 0.00 0.00 175.30 173.97 2jj4 s PRO 64 N -0.11 4.24 -0.12 3.54 0.04 -1.26 -0.30 135.00 141.03 2jj4 s PRO 64 Ca 0.16 0.69 0.01 0.00 0.04 0.00 0.00 61.00 61.90 2jj4 s PRO 64 Cb -0.23 -3.29 0.02 0.00 0.04 0.00 0.00 34.50 31.03 2jj4 s PRO 64 CO -0.02 0.50 -0.12 0.08 0.04 0.00 0.00 177.00 177.48 2jj4 s VAL 65 N -0.61 1.30 -0.19 -0.36 1.01 0.60 -4.22 120.40 117.93 2jj4 s VAL 65 Ca 0.29 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 2jj4 s VAL 65 Cb -0.18 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 2jj4 s VAL 65 CO 0.17 0.41 0.45 -0.69 0.00 0.00 0.00 175.10 175.44 2jj4 s VAL 66 N 1.34 5.17 -0.08 2.92 1.01 -0.31 -0.71 120.40 129.73 2jj4 s VAL 66 Ca -0.00 0.82 0.03 0.00 0.00 0.00 0.00 61.98 62.83 2jj4 s VAL 66 Cb -0.14 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 2jj4 s VAL 66 CO -0.06 0.24 -0.19 -0.69 0.00 0.00 0.00 175.10 174.41 2jj4 s VAL 67 N 1.30 2.62 0.04 2.92 1.01 -0.19 0.15 120.40 128.25 2jj4 s VAL 67 Ca 0.22 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 2jj4 s VAL 67 Cb -0.15 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 2jj4 s VAL 67 CO 0.09 0.56 -0.00 -1.38 0.00 0.00 0.00 175.10 174.36 2jj4 s HIS 68 N -0.10 0.36 0.00 5.22 -3.43 -0.42 -1.67 115.29 115.25 2jj4 s HIS 68 Ca -0.04 -0.77 0.00 0.00 -0.80 0.00 0.00 55.06 53.46 2jj4 s HIS 68 Cb -0.14 -0.27 0.00 0.00 -1.43 0.00 0.00 32.58 30.74 2jj4 s HIS 68 CO 0.04 -0.31 0.00 0.41 -2.00 0.00 0.00 174.74 172.88 2jj4 n GLY 69 N 0.77 1.81 0.00 -1.38 0.00 -1.26 -2.49 105.19 102.64 2jj4 n GLY 69 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2jj4 n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jj4 n GLY 70 N 5.00 -0.20 0.41 -0.02 0.00 -1.26 -4.93 105.19 104.18 2jj4 n GLY 70 Ca 0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 2jj4 n GLY 70 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jj4 h GLY 71 N 0.00 -1.18 0.03 -0.02 0.00 -2.00 -0.18 103.07 99.72 2jj4 h GLY 71 Ca 0.00 0.63 0.22 0.00 0.00 0.00 0.00 47.33 48.18 2jj4 h GLY 71 CO 0.00 -0.30 0.62 -2.55 0.00 0.00 0.00 176.54 174.31 2jj4 h PRO 72 N -0.64 0.59 -0.68 4.80 0.11 -1.99 0.11 132.00 134.30 2jj4 h PRO 72 Ca -0.01 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.00 2jj4 h PRO 72 Cb 0.64 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.59 2jj4 h PRO 72 CO -0.24 0.39 0.15 0.93 -0.21 0.00 0.00 178.00 179.02 2jj4 h GLU 73 N 0.61 1.10 -0.09 1.05 4.39 -1.84 -2.96 114.58 116.84 2jj4 h GLU 73 Ca 0.59 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 60.00 2jj4 h GLU 73 Cb 1.13 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 29.64 2jj4 h GLU 73 CO -0.36 0.98 0.01 0.82 -1.16 0.00 0.00 179.01 179.30 2jj4 h ILE 74 N 1.02 1.24 -0.95 3.13 2.04 0.92 -3.20 117.51 121.72 2jj4 h ILE 74 Ca 0.21 -0.75 0.29 0.00 1.00 0.00 0.00 64.86 65.61 2jj4 h ILE 74 Cb 0.39 1.56 -0.16 0.00 -0.74 0.00 0.00 36.82 37.88 2jj4 h ILE 74 CO 0.01 0.21 0.30 0.78 0.00 0.00 0.00 178.15 179.45 2jj4 h ASN 75 N -0.11 0.03 0.27 1.72 2.35 -0.74 -1.53 115.58 117.58 2jj4 h ASN 75 Ca 0.03 0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2jj4 h ASN 75 Cb 0.33 0.30 -0.02 0.00 0.05 0.00 0.00 38.32 38.97 2jj4 h ASN 75 CO 0.00 -0.26 -0.39 0.00 -1.65 0.00 0.00 177.43 175.14 2jj4 h ALA 76 N 1.88 -0.99 -0.03 -0.83 0.00 -1.52 -2.83 119.26 114.94 2jj4 h ALA 76 Ca 0.65 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.37 2jj4 h ALA 76 Cb 1.45 0.68 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 2jj4 h ALA 76 CO -0.74 -1.05 -0.30 -1.49 0.00 0.00 0.00 179.25 175.68 2jj4 h TRP 77 N -0.69 0.06 -0.15 0.00 4.06 -1.41 -2.10 115.95 115.73 2jj4 h TRP 77 Ca -0.03 -0.01 0.02 0.00 2.06 0.00 0.00 58.89 60.93 2jj4 h TRP 77 Cb 0.63 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 28.75 2jj4 h TRP 77 CO -0.29 0.35 0.00 -0.07 -3.56 0.00 0.00 178.44 174.88 2jj4 h LEU 78 N 0.05 -0.05 -0.21 -4.49 3.38 -1.40 -0.76 115.31 111.83 2jj4 h LEU 78 Ca 0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2jj4 h LEU 78 Cb 0.56 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2jj4 h LEU 78 CO 0.04 -0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.18 2jj4 n GLY 79 N -1.16 -0.22 0.00 0.83 0.00 -0.79 -1.76 105.19 102.09 2jj4 n GLY 79 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2jj4 n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jj4 n ARG 80 N -0.34 0.03 -0.00 1.61 1.74 -0.31 -4.46 116.66 114.93 2jj4 n ARG 80 Ca 0.00 -0.63 0.00 0.00 -0.77 0.00 0.00 57.85 56.45 2jj4 n ARG 80 Cb 0.02 -0.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 2jj4 n ARG 80 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2jj4 n VAL 81 N -0.10 0.02 -1.97 1.55 0.31 -0.72 -5.03 118.33 112.38 2jj4 n VAL 81 Ca 0.00 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 2jj4 n VAL 81 Cb 0.12 0.99 0.00 0.00 -0.91 0.00 0.00 33.84 34.04 2jj4 n VAL 81 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jj4 n GLY 82 N -0.01 0.88 3.08 2.92 0.00 -0.98 -5.09 105.19 105.99 2jj4 n GLY 82 Ca 0.00 -0.53 -0.25 0.00 0.00 0.00 0.00 46.02 45.24 2jj4 n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj4 s ILE 83 N -2.79 1.27 0.11 -0.61 1.01 -0.86 -5.03 121.20 114.31 2jj4 s ILE 83 Ca 0.00 -0.60 -0.30 0.00 0.00 0.00 0.00 60.65 59.75 2jj4 s ILE 83 Cb 0.00 -1.12 -0.06 0.00 0.01 0.00 0.00 42.46 41.29 2jj4 s ILE 83 CO 0.00 0.38 0.96 -1.83 0.00 0.00 0.00 174.94 174.45 2jj4 s GLU 84 N 0.33 4.69 0.48 2.79 4.04 -1.26 -3.67 118.70 126.11 2jj4 s GLU 84 Ca -0.09 1.45 -0.24 0.00 0.04 0.00 0.00 54.97 56.13 2jj4 s GLU 84 Cb -0.13 -3.38 -0.07 0.00 0.02 0.00 0.00 34.13 30.57 2jj4 s GLU 84 CO 0.03 0.21 1.33 -2.14 -1.84 0.00 0.00 175.26 172.85 2jj4 s PRO 85 N 0.02 3.57 -0.20 -4.83 0.02 -1.26 -5.06 135.00 127.25 2jj4 s PRO 85 Ca 0.47 2.18 -0.16 0.00 0.02 0.00 0.00 61.00 63.51 2jj4 s PRO 85 Cb -0.23 -2.50 0.05 0.00 0.02 0.00 0.00 34.50 31.85 2jj4 s PRO 85 CO 0.30 -0.83 0.51 -1.14 -0.33 0.00 0.00 177.00 175.51 2jj4 s GLN 86 N -2.60 0.57 -0.08 5.54 0.74 -1.26 -5.15 119.66 117.41 2jj4 s GLN 86 Ca 0.64 0.77 0.05 0.00 0.05 0.00 0.00 55.36 56.87 2jj4 s GLN 86 Cb -0.39 0.22 -0.00 0.00 1.10 0.00 0.00 33.01 33.94 2jj4 s GLN 86 CO 0.48 -0.09 -0.24 -0.06 -0.55 0.00 0.00 175.29 174.82 2jj4 s PHE 87 N 0.58 2.46 -0.52 1.67 0.40 -1.26 -3.16 117.98 118.15 2jj4 s PHE 87 Ca -0.03 -0.87 -0.08 0.00 -0.60 0.00 0.00 56.93 55.35 2jj4 s PHE 87 Cb -0.05 -1.63 0.13 0.00 0.51 0.00 0.00 43.02 41.99 2jj4 s PHE 87 CO -0.03 -0.31 0.39 -1.58 0.70 0.00 0.00 175.22 174.38 2jj4 s HIS 88 N 0.10 3.47 -0.13 0.36 2.46 -0.91 -4.82 115.29 115.82 2jj4 s HIS 88 Ca -0.11 -2.09 -0.09 0.00 0.47 0.00 0.00 55.06 53.24 2jj4 s HIS 88 Cb -0.16 -3.45 0.01 0.00 -0.13 0.00 0.00 32.58 28.85 2jj4 s HIS 88 CO 0.06 -0.97 0.17 0.27 -2.47 0.00 0.00 174.74 171.81 2jj4 n ASN 89 N 4.55 -1.39 0.00 9.88 6.94 -1.26 -3.49 115.26 130.50 2jj4 n ASN 89 Ca -0.03 -0.08 0.00 0.00 -0.02 0.00 0.00 54.58 54.46 2jj4 n ASN 89 Cb 0.41 -0.41 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2jj4 n ASN 89 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jj4 n GLY 90 N -0.16 2.64 3.79 4.83 0.00 -1.26 -4.98 105.19 110.05 2jj4 n GLY 90 Ca -0.03 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 2jj4 n GLY 90 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jj4 s LEU 91 N 0.00 4.01 -0.29 0.99 1.43 -1.23 -5.03 118.68 118.56 2jj4 s LEU 91 Ca 0.00 1.93 -0.17 0.00 -1.03 0.00 0.00 54.13 54.87 2jj4 s LEU 91 Cb 0.00 -4.37 -0.02 0.00 0.03 0.00 0.00 46.19 41.82 2jj4 s LEU 91 CO 0.00 -0.56 0.45 -0.60 0.23 0.00 0.00 176.35 175.87 2jj4 s ARG 92 N -2.85 3.89 0.03 1.70 3.52 -1.26 -2.15 118.95 121.83 2jj4 s ARG 92 Ca 0.62 0.02 -0.30 0.00 -0.13 0.00 0.00 55.73 55.94 2jj4 s ARG 92 Cb -0.18 -3.71 -0.08 0.00 -1.56 0.00 0.00 34.95 29.42 2jj4 s ARG 92 CO 0.22 -0.41 1.86 0.14 -0.81 0.00 0.00 175.30 176.30 2jj4 s VAL 93 N 2.21 3.06 -0.21 7.11 -7.23 -1.19 -4.84 120.40 119.32 2jj4 s VAL 93 Ca 0.17 0.19 -0.02 0.00 -1.81 0.00 0.00 61.98 60.51 2jj4 s VAL 93 Cb -0.16 -3.13 0.06 0.00 0.56 0.00 0.00 36.38 33.72 2jj4 s VAL 93 CO 0.11 -0.01 0.04 0.42 -0.31 0.00 0.00 175.10 175.34 2jj4 s THR 94 N 4.00 0.61 0.75 5.32 -4.23 -0.99 -4.76 115.64 116.34 2jj4 s THR 94 Ca 0.83 -0.68 -0.13 0.00 -1.18 0.00 0.00 61.69 60.54 2jj4 s THR 94 Cb -0.41 -1.14 0.18 0.00 1.34 0.00 0.00 72.50 72.47 2jj4 s THR 94 CO 0.38 -0.25 0.97 -0.90 -0.54 0.00 0.00 174.62 174.27 2jj4 n ASP 95 N 5.01 -0.19 -0.10 3.99 3.85 -1.26 -0.16 116.55 127.69 2jj4 n ASP 95 Ca -0.09 -1.31 0.02 0.00 -0.71 0.00 0.00 54.79 52.71 2jj4 n ASP 95 Cb 0.46 -0.76 0.33 0.00 -1.35 0.00 0.00 41.12 39.80 2jj4 n ASP 95 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2jj4 h ALA 96 N -1.94 1.55 -0.07 2.12 0.00 -1.99 -0.14 119.26 118.79 2jj4 h ALA 96 Ca -0.32 -0.06 -0.22 0.00 0.00 0.00 0.00 54.91 54.31 2jj4 h ALA 96 Cb 0.89 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2jj4 h ALA 96 CO 0.22 0.40 -0.82 -0.44 0.00 0.00 0.00 179.25 178.60 2jj4 h ASP 97 N 0.76 0.84 0.70 0.00 3.32 -2.02 -3.20 116.42 116.83 2jj4 h ASP 97 Ca 0.20 -0.69 -0.15 0.00 0.02 0.00 0.00 57.03 56.41 2jj4 h ASP 97 Cb -0.04 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 2jj4 h ASP 97 CO -0.04 1.41 -0.72 0.71 -1.72 0.00 0.00 179.24 178.88 2jj4 h THR 98 N 0.35 1.51 -0.11 0.35 1.35 -1.87 -3.21 112.91 111.28 2jj4 h THR 98 Ca -0.08 -2.46 0.03 0.00 -0.55 0.00 0.00 66.41 63.35 2jj4 h THR 98 Cb 1.48 2.32 -0.04 0.00 -1.73 0.00 0.00 68.15 70.19 2jj4 h THR 98 CO 0.17 0.70 -0.10 -0.03 -0.25 0.00 0.00 175.52 176.01 2jj4 h MET 99 N 0.01 -0.11 -1.03 4.72 1.85 -1.09 -2.01 114.93 117.27 2jj4 h MET 99 Ca -0.01 0.01 0.26 0.00 -0.61 0.00 0.00 59.70 59.35 2jj4 h MET 99 Cb 1.27 0.03 -0.11 0.00 0.43 0.00 0.00 31.60 33.22 2jj4 h MET 99 CO 0.09 -0.07 0.64 1.49 -0.40 0.00 0.00 176.91 178.66 2jj4 h GLU 100 N -0.12 0.47 -0.04 0.39 4.81 -1.55 -0.04 114.58 118.50 2jj4 h GLU 100 Ca 0.08 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2jj4 h GLU 100 Cb 0.23 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2jj4 h GLU 100 CO -0.18 0.31 -0.10 0.28 -0.73 0.00 0.00 179.01 178.58 2jj4 h VAL 101 N 0.49 1.44 -0.39 0.32 2.07 -1.54 -2.46 116.25 116.17 2jj4 h VAL 101 Ca 0.62 -1.46 0.08 0.00 0.82 0.00 0.00 66.70 66.76 2jj4 h VAL 101 Cb 1.38 2.31 -0.09 0.00 -1.52 0.00 0.00 31.29 33.37 2jj4 h VAL 101 CO -0.38 0.40 -0.23 0.58 0.02 0.00 0.00 177.57 177.96 2jj4 h VAL 102 N -0.39 0.37 -0.62 2.57 2.07 -0.35 0.12 116.25 120.02 2jj4 h VAL 102 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2jj4 h VAL 102 Cb 0.70 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2jj4 h VAL 102 CO 0.02 0.00 0.37 -0.08 0.02 0.00 0.00 177.57 177.91 2jj4 h GLU 103 N -0.16 0.71 -0.59 1.57 4.81 -1.19 -0.29 114.58 119.43 2jj4 h GLU 103 Ca 0.19 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.29 2jj4 h GLU 103 Cb 0.46 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 2jj4 h GLU 103 CO -0.49 0.47 0.02 0.52 -0.73 0.00 0.00 179.01 178.80 2jj4 h MET 104 N 0.73 1.02 0.11 1.92 2.86 -0.78 -2.16 114.93 118.63 2jj4 h MET 104 Ca 0.25 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2jj4 h MET 104 Cb 0.05 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.61 2jj4 h MET 104 CO -0.12 0.98 -0.05 0.28 1.06 0.00 0.00 176.91 179.07 2jj4 h VAL 105 N 0.94 1.02 -0.07 -2.22 2.07 -0.50 -2.35 116.25 115.14 2jj4 h VAL 105 Ca 0.17 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 2jj4 h VAL 105 Cb 0.51 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2jj4 h VAL 105 CO 0.02 0.27 -0.08 -0.07 0.02 0.00 0.00 177.57 177.74 2jj4 h LEU 106 N -0.83 0.20 0.17 2.57 3.38 -1.12 0.22 115.31 119.90 2jj4 h LEU 106 Ca -0.02 -0.49 -0.26 0.00 0.09 0.00 0.00 57.88 57.20 2jj4 h LEU 106 Cb 0.56 -0.06 0.03 0.00 0.09 0.00 0.00 40.66 41.29 2jj4 h LEU 106 CO 0.03 0.65 -1.12 0.58 0.09 0.00 0.00 178.44 178.67 2jj4 h VAL 107 N -0.25 1.38 0.00 1.22 2.07 -1.57 -1.37 116.25 117.73 2jj4 h VAL 107 Ca 0.01 -2.55 -0.03 0.00 0.82 0.00 0.00 66.70 64.95 2jj4 h VAL 107 Cb 0.60 3.01 -0.00 0.00 -1.52 0.00 0.00 31.29 33.38 2jj4 h VAL 107 CO 0.02 0.75 -0.27 1.23 0.02 0.00 0.00 177.57 179.32 2jj4 h GLY 108 N -0.05 0.00 0.29 2.17 0.00 -1.49 -3.38 103.07 100.62 2jj4 h GLY 108 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 46.81 2jj4 h GLY 108 CO 0.21 0.00 -1.83 -2.13 0.00 0.00 0.00 176.54 172.79 2jj4 n ARG 109 N -4.65 0.67 -0.03 4.80 0.63 -0.29 -4.05 116.66 113.74 2jj4 n ARG 109 Ca -0.09 0.36 -0.09 0.00 -0.92 0.00 0.00 57.85 57.11 2jj4 n ARG 109 Cb 0.28 -1.69 -0.08 0.00 0.45 0.00 0.00 32.46 31.43 2jj4 n ARG 109 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2jj4 h VAL 110 N -0.39 1.02 -0.70 5.15 2.07 -0.75 -3.09 116.25 119.55 2jj4 h VAL 110 Ca -0.44 -1.61 0.13 0.00 0.82 0.00 0.00 66.70 65.60 2jj4 h VAL 110 Cb 1.74 1.86 -0.09 0.00 -1.52 0.00 0.00 31.29 33.28 2jj4 h VAL 110 CO -0.07 0.32 0.24 -1.13 0.02 0.00 0.00 177.57 176.95 2jj4 h ASN 111 N -0.95 0.20 0.64 0.57 -0.73 -1.42 -0.21 115.58 113.66 2jj4 h ASN 111 Ca -0.01 0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.27 2jj4 h ASN 111 Cb 0.58 0.10 0.00 0.00 0.27 0.00 0.00 38.32 39.27 2jj4 h ASN 111 CO 0.01 0.08 -0.14 0.29 -0.37 0.00 0.00 177.43 177.30 2jj4 n LYS 112 N -5.03 0.28 -0.02 6.67 4.76 -1.26 -1.60 118.16 121.96 2jj4 n LYS 112 Ca 0.12 -0.08 -0.16 0.00 -2.87 0.00 0.00 58.31 55.32 2jj4 n LYS 112 Cb 0.37 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.96 2jj4 n LYS 112 CO 0.00 0.00 0.00 0.22 -1.37 0.00 0.00 177.40 176.25 2jj4 h ASP 113 N 0.19 0.46 -0.21 4.39 3.58 -0.96 -2.17 116.42 121.70 2jj4 h ASP 113 Ca 0.00 -0.71 -0.02 0.00 0.42 0.00 0.00 57.03 56.72 2jj4 h ASP 113 Cb 0.43 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2jj4 h ASP 113 CO 0.00 1.10 0.05 0.40 -2.88 0.00 0.00 179.24 177.91 2jj4 h ILE 114 N -0.14 1.21 -0.25 2.25 2.04 -1.14 -1.09 117.51 120.39 2jj4 h ILE 114 Ca -0.04 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.14 2jj4 h ILE 114 Cb 1.13 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 2jj4 h ILE 114 CO 0.09 0.22 0.13 0.58 0.00 0.00 0.00 178.15 179.17 2jj4 h VAL 115 N 0.15 1.00 -0.49 1.67 2.07 -1.43 -2.06 116.25 117.16 2jj4 h VAL 115 Ca 0.06 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.56 2jj4 h VAL 115 Cb 0.28 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 2jj4 h VAL 115 CO 0.00 0.05 0.15 -1.28 0.02 0.00 0.00 177.57 176.52 2jj4 h SER 116 N 0.28 0.13 0.06 0.57 0.87 -1.20 -1.05 113.55 113.20 2jj4 h SER 116 Ca 0.10 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2jj4 h SER 116 Cb 0.02 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2jj4 h SER 116 CO -0.07 0.10 -0.03 0.03 -0.53 0.00 0.00 176.83 176.34 2jj4 h ARG 117 N 0.32 -0.07 -0.35 2.24 3.08 -1.06 -2.18 114.38 116.36 2jj4 h ARG 117 Ca 0.24 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.35 2jj4 h ARG 117 Cb 0.27 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 2jj4 h ARG 117 CO -0.26 0.15 0.02 0.82 -1.07 0.00 0.00 179.97 179.63 2jj4 h ILE 118 N -0.29 0.76 -0.67 2.04 2.04 -1.19 0.16 117.51 120.37 2jj4 h ILE 118 Ca -0.01 -0.04 0.08 0.00 1.00 0.00 0.00 64.86 65.89 2jj4 h ILE 118 Cb 0.25 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 36.90 2jj4 h ILE 118 CO 0.01 0.02 0.33 0.78 0.00 0.00 0.00 178.15 179.29 2jj4 h ASN 119 N 0.12 0.43 0.95 1.72 2.35 -1.14 -0.80 115.58 119.21 2jj4 h ASN 119 Ca 0.17 0.06 -0.09 0.00 -0.55 0.00 0.00 56.30 55.89 2jj4 h ASN 119 Cb 0.22 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2jj4 h ASN 119 CO -0.27 0.25 -0.42 0.71 -1.65 0.00 0.00 177.43 176.06 2jj4 h THR 120 N 0.57 0.92 0.00 2.81 1.35 -0.74 -2.56 112.91 115.26 2jj4 h THR 120 Ca 0.33 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.48 2jj4 h THR 120 Cb 0.33 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2jj4 h THR 120 CO -0.25 0.41 0.00 0.74 -0.25 0.00 0.00 175.52 176.17 2jj4 h THR 121 N 0.00 0.00 0.00 6.82 2.02 0.52 -3.47 112.91 118.80 2jj4 h THR 121 Ca -0.00 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.66 2jj4 h THR 121 Cb 1.01 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 2jj4 h THR 121 CO 0.05 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.55 2jj4 n GLY 122 N 0.58 1.09 3.98 2.16 0.00 -0.44 -5.07 105.19 107.49 2jj4 n GLY 122 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 2jj4 n GLY 122 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jj4 s GLY 123 N -1.16 1.76 -0.48 -0.02 0.00 -0.44 -4.99 107.32 101.99 2jj4 s GLY 123 Ca 0.00 -1.62 0.04 0.00 0.00 0.00 0.00 44.72 43.14 2jj4 s GLY 123 CO 0.00 -1.03 0.22 0.50 0.00 0.00 0.00 173.10 172.79 2jj4 s ARG 124 N -5.25 1.88 0.27 2.90 0.52 -1.26 -3.98 118.95 114.03 2jj4 s ARG 124 Ca 0.67 -2.45 -0.22 0.00 -0.52 0.00 0.00 55.73 53.21 2jj4 s ARG 124 Cb -0.05 -3.31 -0.09 0.00 0.52 0.00 0.00 34.95 32.02 2jj4 s ARG 124 CO 0.46 -1.07 0.82 0.00 0.02 0.00 0.00 175.30 175.52 2jj4 s ALA 125 N -0.01 3.32 -0.15 2.13 0.00 -1.26 -0.35 121.76 125.43 2jj4 s ALA 125 Ca 0.16 0.30 -0.01 0.00 0.00 0.00 0.00 51.96 52.41 2jj4 s ALA 125 Cb -0.24 -2.97 0.04 0.00 0.00 0.00 0.00 23.12 19.95 2jj4 s ALA 125 CO -0.02 0.26 -0.05 0.08 0.00 0.00 0.00 175.76 176.03 2jj4 s VAL 126 N -1.61 1.04 0.06 0.00 1.01 0.13 -4.84 120.40 116.20 2jj4 s VAL 126 Ca 0.47 -0.52 -0.23 0.00 0.00 0.00 0.00 61.98 61.70 2jj4 s VAL 126 Cb -0.17 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 34.96 2jj4 s VAL 126 CO 0.21 0.18 0.70 -0.83 0.00 0.00 0.00 175.10 175.36 2jj4 s GLY 127 N 1.67 2.76 0.18 4.51 0.00 -1.26 -1.26 107.32 113.92 2jj4 s GLY 127 Ca 0.02 0.20 0.02 0.00 0.00 0.00 0.00 44.72 44.96 2jj4 s GLY 127 CO -0.08 0.87 0.01 -1.36 0.00 0.00 0.00 173.10 172.54 2jj4 s PHE 128 N -0.48 1.26 0.22 1.90 0.08 0.36 -4.90 117.98 116.40 2jj4 s PHE 128 Ca 0.35 -1.03 0.03 0.00 0.12 0.00 0.00 56.93 56.40 2jj4 s PHE 128 Cb -0.20 -0.72 -0.05 0.00 -0.57 0.00 0.00 43.02 41.48 2jj4 s PHE 128 CO 0.22 -0.21 0.01 0.00 -0.10 0.00 0.00 175.22 175.13 2jj4 h GLY 130 N 2.53 1.57 1.93 0.00 0.00 -0.91 -0.35 103.07 107.85 2jj4 h GLY 130 Ca -0.38 0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2jj4 h GLY 130 CO 0.64 -0.57 0.00 -0.37 0.00 0.00 0.00 176.54 176.24 2jj4 n THR 131 N -5.37 0.44 -2.07 4.70 5.66 -1.25 -0.40 114.28 116.00 2jj4 n THR 131 Ca 0.27 0.11 -0.42 0.00 -3.05 0.00 0.00 64.05 60.97 2jj4 n THR 131 Cb 0.90 -0.73 -0.03 0.00 -1.55 0.00 0.00 70.33 68.92 2jj4 n THR 131 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2jj4 s ASP 132 N -2.93 5.78 -1.57 1.09 1.01 -0.14 -2.86 116.67 117.04 2jj4 s ASP 132 Ca 0.12 0.95 -0.01 0.00 0.71 0.00 0.00 52.55 54.32 2jj4 s ASP 132 Cb 0.15 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.55 2jj4 s ASP 132 CO 0.40 -1.86 0.13 0.61 0.21 0.00 0.00 175.17 174.66 2jj4 n GLY 133 N 5.45 -0.50 2.42 0.21 0.00 -1.26 -1.90 105.19 109.60 2jj4 n GLY 133 Ca 0.21 0.03 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 2jj4 n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jj4 n ARG 134 N -3.19 -1.69 -0.11 1.61 5.12 -1.14 -4.84 116.66 112.43 2jj4 n ARG 134 Ca -0.19 1.01 -0.07 0.00 -1.93 0.00 0.00 57.85 56.67 2jj4 n ARG 134 Cb 0.65 -5.66 -0.01 0.00 -1.16 0.00 0.00 32.46 26.28 2jj4 n ARG 134 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2jj4 h LEU 135 N 0.00 -0.99 -8.38 0.55 6.46 -0.21 -3.29 115.31 109.45 2jj4 h LEU 135 Ca -0.48 0.18 -0.65 0.00 -0.12 0.00 0.00 57.88 56.80 2jj4 h LEU 135 Cb 1.36 0.47 -0.32 0.00 -0.73 0.00 0.00 40.66 41.44 2jj4 h LEU 135 CO 0.58 -0.31 -0.87 -0.69 -0.62 0.00 0.00 178.44 176.53 2jj4 s VAL 136 N -6.03 1.89 -0.16 1.05 1.01 0.46 -0.12 120.40 118.50 2jj4 s VAL 136 Ca -0.15 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 2jj4 s VAL 136 Cb 0.13 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 2jj4 s VAL 136 CO 0.68 0.53 -0.12 -0.22 0.00 0.00 0.00 175.10 175.97 2jj4 s LEU 137 N 0.03 2.66 0.25 3.92 0.20 -0.12 -3.83 118.68 121.78 2jj4 s LEU 137 Ca -0.08 -0.40 -0.04 0.00 0.69 0.00 0.00 54.13 54.31 2jj4 s LEU 137 Cb -0.14 -1.62 -0.05 0.00 -0.43 0.00 0.00 46.19 43.95 2jj4 s LEU 137 CO 0.05 0.10 0.49 0.00 -0.29 0.00 0.00 176.35 176.69 2jj4 s ALA 138 N 0.76 3.69 0.19 5.97 0.00 -0.96 -0.30 121.76 131.12 2jj4 s ALA 138 Ca -0.05 -0.62 0.07 0.00 0.00 0.00 0.00 51.96 51.36 2jj4 s ALA 138 Cb -0.15 -2.20 -0.05 0.00 0.00 0.00 0.00 23.12 20.72 2jj4 s ALA 138 CO 0.01 0.35 -0.13 -0.98 0.00 0.00 0.00 175.76 175.01 2jj4 s ARG 139 N -3.36 1.27 0.21 0.00 1.70 -0.07 -4.19 118.95 114.50 2jj4 s ARG 139 Ca 0.42 -1.56 -0.31 0.00 -0.47 0.00 0.00 55.73 53.81 2jj4 s ARG 139 Cb -0.11 -1.00 -0.11 0.00 -0.57 0.00 0.00 34.95 33.16 2jj4 s ARG 139 CO 0.29 0.15 1.62 -2.14 -1.08 0.00 0.00 175.30 174.14 2jj4 s PRO 140 N -3.67 4.17 0.33 3.89 0.02 -1.26 -0.64 135.00 137.84 2jj4 s PRO 140 Ca 0.21 2.48 -0.29 0.00 0.02 0.00 0.00 61.00 63.43 2jj4 s PRO 140 Cb 0.00 -3.10 -0.11 0.00 0.02 0.00 0.00 34.50 31.31 2jj4 s PRO 140 CO 0.05 -0.65 1.53 -1.58 -0.33 0.00 0.00 177.00 176.02 2jj4 s HIS 141 N 0.92 2.70 0.35 6.54 2.46 0.10 -4.62 115.29 123.73 2jj4 s HIS 141 Ca 0.70 0.99 0.16 0.00 0.47 0.00 0.00 55.06 57.37 2jj4 s HIS 141 Cb -0.47 -4.03 1.17 0.00 -0.13 0.00 0.00 32.58 29.13 2jj4 s HIS 141 CO 0.35 -3.23 1.60 -0.44 -2.47 0.00 0.00 174.74 170.54 2jj4 h ASP 142 N 3.97 0.20 -1.93 9.88 3.32 -1.91 -3.40 116.42 126.55 2jj4 h ASP 142 Ca -0.49 0.25 -0.64 0.00 0.02 0.00 0.00 57.03 56.17 2jj4 h ASP 142 Cb 1.23 0.29 0.03 0.00 0.22 0.00 0.00 39.33 41.10 2jj4 h ASP 142 CO 0.72 -0.36 0.91 1.67 -1.72 0.00 0.00 179.24 180.46 2jj4 n GLN 143 N -5.27 1.81 -3.24 3.56 -0.06 -1.26 -4.94 117.38 107.99 2jj4 n GLN 143 Ca 0.34 0.66 -0.39 0.00 -2.00 0.00 0.00 57.00 55.61 2jj4 n GLN 143 Cb 1.12 -2.43 -0.06 0.00 -4.06 0.00 0.00 30.24 24.81 2jj4 n GLN 143 CO 0.00 0.00 0.00 -1.83 -0.20 0.00 0.00 177.06 175.03 2jj4 s GLU 144 N 2.87 4.33 0.00 3.69 -1.05 -1.26 -4.24 118.70 123.04 2jj4 s GLU 144 Ca 0.90 0.54 0.00 0.00 -0.15 0.00 0.00 54.97 56.26 2jj4 s GLU 144 Cb -0.81 -3.46 0.00 0.00 -0.44 0.00 0.00 34.13 29.42 2jj4 s GLU 144 CO 0.51 0.07 0.00 0.41 0.95 0.00 0.00 175.26 177.21 2jj4 n GLY 145 N 3.35 0.65 0.45 -3.83 0.00 -1.26 -4.95 105.19 99.60 2jj4 n GLY 145 Ca -0.05 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.00 2jj4 n GLY 145 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jj4 n ILE 146 N -2.03 0.34 -4.29 -0.61 2.08 -1.26 -4.99 119.36 108.60 2jj4 n ILE 146 Ca 0.00 -0.28 0.00 0.00 0.56 0.00 0.00 62.75 63.03 2jj4 n ILE 146 Cb 0.00 0.02 0.00 0.00 -0.75 0.00 0.00 39.64 38.91 2jj4 n ILE 146 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2jj4 n GLY 147 N 0.68 0.34 2.00 7.39 0.00 -1.26 -2.35 105.19 111.98 2jj4 n GLY 147 Ca 0.07 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 45.05 2jj4 n GLY 147 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jj4 n PHE 148 N 3.82 0.17 -3.11 1.61 3.01 0.78 -4.88 117.46 118.85 2jj4 n PHE 148 Ca 0.00 -1.50 -0.39 0.00 1.01 0.00 0.00 57.45 56.57 2jj4 n PHE 148 Cb 0.00 -1.47 -0.05 0.00 -0.01 0.00 0.00 39.48 37.95 2jj4 n PHE 148 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2jj4 s VAL 149 N 0.55 5.08 0.24 -4.37 1.01 -1.26 -1.44 120.40 120.22 2jj4 s VAL 149 Ca 0.59 1.32 0.07 0.00 0.00 0.00 0.00 61.98 63.96 2jj4 s VAL 149 Cb 0.29 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2jj4 s VAL 149 CO -0.02 0.26 0.18 -0.83 0.00 0.00 0.00 175.10 174.70 2jj4 s GLY 150 N 0.77 1.45 0.07 4.51 0.00 -0.09 -0.72 107.32 113.31 2jj4 s GLY 150 Ca 0.34 -1.41 0.07 0.00 0.00 0.00 0.00 44.72 43.73 2jj4 s GLY 150 CO 0.16 -1.44 -0.20 1.85 0.00 0.00 0.00 173.10 173.46 2jj4 s GLU 151 N -3.75 1.24 -0.24 2.90 2.56 0.19 -4.30 118.70 117.29 2jj4 s GLU 151 Ca 0.33 -1.02 -0.29 0.00 0.00 0.00 0.00 54.97 53.99 2jj4 s GLU 151 Cb -0.08 -1.41 -0.03 0.00 2.00 0.00 0.00 34.13 34.61 2jj4 s GLU 151 CO 0.25 0.34 1.76 0.08 -0.56 0.00 0.00 175.26 177.13 2jj4 s VAL 152 N -0.96 3.51 -0.06 3.70 1.01 -1.26 -0.90 120.40 125.44 2jj4 s VAL 152 Ca 0.06 0.55 -0.04 0.00 0.00 0.00 0.00 61.98 62.56 2jj4 s VAL 152 Cb -0.09 -3.58 -0.27 0.00 0.00 0.00 0.00 36.38 32.44 2jj4 s VAL 152 CO 0.03 -0.29 0.61 -1.13 0.00 0.00 0.00 175.10 174.31 2jj4 h ASN 153 N 11.89 0.40 -5.01 3.32 -0.00 -0.95 -3.47 115.58 121.77 2jj4 h ASN 153 Ca -0.35 -0.71 -0.06 0.00 -0.00 0.00 0.00 56.30 55.17 2jj4 h ASN 153 Cb 1.17 -0.13 -0.17 0.00 -0.00 0.00 0.00 38.32 39.19 2jj4 h ASN 153 CO 1.00 1.62 0.08 -0.94 -0.00 0.00 0.00 177.43 179.19 2jj4 s SER 154 N -6.95 -0.50 -0.14 1.15 1.04 -1.01 -5.00 113.70 102.29 2jj4 s SER 154 Ca -0.15 0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.61 2jj4 s SER 154 Cb 0.07 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.70 2jj4 s SER 154 CO 0.82 -0.69 -0.18 -0.69 0.98 0.00 0.00 173.24 173.49 2jj4 s VAL 155 N -2.09 1.75 -0.30 5.02 1.01 -1.26 -0.95 120.40 123.58 2jj4 s VAL 155 Ca -0.07 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2jj4 s VAL 155 Cb -0.01 -1.59 0.05 0.00 0.00 0.00 0.00 36.38 34.83 2jj4 s VAL 155 CO 0.01 0.49 -0.00 0.21 0.00 0.00 0.00 175.10 175.81 2jj4 s ASN 156 N 1.10 4.87 0.00 3.32 3.84 0.83 -4.97 114.94 123.92 2jj4 s ASN 156 Ca -0.02 -1.24 0.23 0.00 0.21 0.00 0.00 52.86 52.04 2jj4 s ASN 156 Cb -0.14 -1.71 0.63 0.00 -0.55 0.00 0.00 41.25 39.48 2jj4 s ASN 156 CO -0.05 -0.25 1.50 -1.54 -2.79 0.00 0.00 177.10 173.96 2jj4 n SER 157 N 4.63 2.32 0.20 -4.21 3.41 -1.26 -4.11 113.62 114.59 2jj4 n SER 157 Ca -0.13 -1.79 0.08 0.00 -0.26 0.00 0.00 58.87 56.77 2jj4 n SER 157 Cb 0.44 -0.10 0.44 0.00 -0.26 0.00 0.00 64.21 64.73 2jj4 n SER 157 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2jj4 h GLU 158 N 3.25 0.00 0.08 4.33 5.08 -1.94 -0.83 114.58 124.55 2jj4 h GLU 158 Ca 0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 2jj4 h GLU 158 Cb 0.70 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 2jj4 h GLU 158 CO 0.00 0.00 -1.65 0.28 -1.00 0.00 0.00 179.01 176.64 2jj4 h VAL 159 N 0.00 0.79 0.00 3.13 2.07 -1.89 -3.42 116.25 116.94 2jj4 h VAL 159 Ca 0.00 -2.30 -0.26 0.00 0.82 0.00 0.00 66.70 64.96 2jj4 h VAL 159 Cb 0.63 2.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.80 2jj4 h VAL 159 CO 0.00 0.67 -2.12 2.30 0.02 0.00 0.00 177.57 178.44 2jj4 n ILE 160 N -3.88 1.11 -0.18 4.57 -5.35 -0.42 -4.29 119.36 110.91 2jj4 n ILE 160 Ca -0.31 -0.76 -0.01 0.00 -0.27 0.00 0.00 62.75 61.41 2jj4 n ILE 160 Cb 0.90 -0.46 0.09 0.00 -1.74 0.00 0.00 39.64 38.43 2jj4 n ILE 160 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2jj4 h GLU 161 N 0.00 0.25 -0.35 6.28 4.57 -1.53 0.11 114.58 123.91 2jj4 h GLU 161 Ca -0.36 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 57.88 2jj4 h GLU 161 Cb 1.89 -0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 30.35 2jj4 h GLU 161 CO 0.03 0.16 -0.18 -1.35 -1.18 0.00 0.00 179.01 176.49 2jj4 h PRO 162 N 0.26 -0.13 -0.45 0.92 0.11 -1.80 -1.23 132.00 129.68 2jj4 h PRO 162 Ca 0.29 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.38 2jj4 h PRO 162 Cb 0.41 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.53 2jj4 h PRO 162 CO -0.37 -0.08 0.15 -0.07 -0.21 0.00 0.00 178.00 177.41 2jj4 h LEU 163 N -0.13 0.59 -0.82 2.35 3.38 -1.55 -2.69 115.31 116.44 2jj4 h LEU 163 Ca 0.17 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2jj4 h LEU 163 Cb 0.40 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2jj4 h LEU 163 CO -0.43 0.56 0.33 -0.07 0.09 0.00 0.00 178.44 178.93 2jj4 h LEU 164 N 0.64 1.10 -0.62 1.67 3.38 0.31 -1.70 115.31 120.10 2jj4 h LEU 164 Ca 0.15 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2jj4 h LEU 164 Cb 0.18 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2jj4 h LEU 164 CO -0.01 0.97 -0.27 -0.33 0.09 0.00 0.00 178.44 178.89 2jj4 h GLU 165 N 1.17 0.81 0.00 1.13 5.08 -1.04 -2.50 114.58 119.22 2jj4 h GLU 165 Ca 0.27 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2jj4 h GLU 165 Cb 0.20 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2jj4 h GLU 165 CO -0.02 0.98 0.00 0.54 -1.00 0.00 0.00 179.01 179.51 2jj4 n ARG 166 N -4.09 0.69 -1.05 2.33 1.74 -0.98 -4.83 116.66 110.46 2jj4 n ARG 166 Ca -0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 2jj4 n ARG 166 Cb 0.46 -1.01 -0.01 0.00 -1.02 0.00 0.00 32.46 30.89 2jj4 n ARG 166 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jj4 n GLY 167 N 0.19 0.54 3.88 -0.13 0.00 -0.94 -5.04 105.19 103.69 2jj4 n GLY 167 Ca 0.00 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 2jj4 n GLY 167 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jj4 s TYR 168 N -2.04 3.59 -0.41 1.61 1.51 -0.68 -4.69 117.35 116.24 2jj4 s TYR 168 Ca 0.00 1.09 -0.06 0.00 -1.01 0.00 0.00 57.07 57.10 2jj4 s TYR 168 Cb 0.00 -2.54 0.10 0.00 -0.11 0.00 0.00 41.96 39.40 2jj4 s TYR 168 CO 0.00 -0.50 0.22 0.42 -1.11 0.00 0.00 175.55 174.58 2jj4 s ILE 169 N -2.97 3.67 0.21 2.71 1.01 0.53 -4.54 121.20 121.83 2jj4 s ILE 169 Ca 0.52 -1.76 -0.30 0.00 0.00 0.00 0.00 60.65 59.11 2jj4 s ILE 169 Cb -0.11 -3.38 -0.09 0.00 0.01 0.00 0.00 42.46 38.90 2jj4 s ILE 169 CO 0.49 -0.59 1.29 -2.84 0.00 0.00 0.00 174.94 173.29 2jj4 s PRO 170 N 1.27 4.40 -0.23 2.79 0.02 -1.26 -0.69 135.00 141.31 2jj4 s PRO 170 Ca 0.05 2.05 0.01 0.00 0.02 0.00 0.00 61.00 63.13 2jj4 s PRO 170 Cb -0.23 -3.19 0.05 0.00 0.02 0.00 0.00 34.50 31.16 2jj4 s PRO 170 CO -0.02 -0.22 -0.08 0.08 -0.33 0.00 0.00 177.00 176.44 2jj4 s VAL 171 N -0.07 1.68 -0.19 3.83 1.01 -0.39 -1.17 120.40 125.10 2jj4 s VAL 171 Ca 0.55 -1.22 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 2jj4 s VAL 171 Cb -0.36 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 2jj4 s VAL 171 CO 0.40 0.01 -0.04 -0.63 0.00 0.00 0.00 175.10 174.83 2jj4 s ILE 172 N 1.35 3.54 0.52 2.22 1.01 0.12 0.13 121.20 130.09 2jj4 s ILE 172 Ca -0.05 -0.46 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 2jj4 s ILE 172 Cb -0.18 -2.58 -0.08 0.00 0.01 0.00 0.00 42.46 39.63 2jj4 s ILE 172 CO -0.07 0.45 0.99 -0.94 0.00 0.00 0.00 174.94 175.37 2jj4 s SER 173 N 1.03 6.61 -1.20 3.58 1.04 0.77 -1.31 113.70 124.23 2jj4 s SER 173 Ca 0.01 1.57 -0.05 0.00 0.48 0.00 0.00 55.95 57.96 2jj4 s SER 173 Cb -0.15 -2.51 0.21 0.00 0.10 0.00 0.00 66.02 63.68 2jj4 s SER 173 CO 0.00 -0.59 2.00 -1.54 0.98 0.00 0.00 173.24 174.09 2jj4 n SER 174 N -1.60 7.05 -3.70 7.02 3.41 -1.04 -3.69 113.62 121.08 2jj4 n SER 174 Ca 0.07 -3.32 -0.18 0.00 -0.26 0.00 0.00 58.87 55.17 2jj4 n SER 174 Cb 0.54 -1.32 -0.17 0.00 -0.26 0.00 0.00 64.21 63.00 2jj4 n SER 174 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2jj4 s VAL 175 N -1.97 -0.12 0.03 -3.33 1.01 -1.26 -2.72 120.40 112.04 2jj4 s VAL 175 Ca 0.44 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.80 2jj4 s VAL 175 Cb 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.35 2jj4 s VAL 175 CO -0.05 0.15 -0.07 0.00 0.00 0.00 0.00 175.10 175.12 2jj4 s ALA 176 N 1.89 0.56 0.18 5.51 0.00 -0.95 -0.57 121.76 128.37 2jj4 s ALA 176 Ca 0.01 -0.62 -0.11 0.00 0.00 0.00 0.00 51.96 51.24 2jj4 s ALA 176 Cb -0.12 -0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.92 2jj4 s ALA 176 CO -0.04 0.02 0.52 0.00 0.00 0.00 0.00 175.76 176.27 2jj4 s ALA 177 N -1.01 3.61 0.97 0.00 0.00 -1.26 -0.21 121.76 123.85 2jj4 s ALA 177 Ca -0.06 -0.26 -0.14 0.00 0.00 0.00 0.00 51.96 51.50 2jj4 s ALA 177 Cb -0.08 -2.42 0.20 0.00 0.00 0.00 0.00 23.12 20.83 2jj4 s ALA 177 CO 0.00 0.51 1.22 -0.40 0.00 0.00 0.00 175.76 177.10 2jj4 n ASP 178 N 0.31 0.24 0.17 0.00 3.85 -0.08 -2.25 116.55 118.79 2jj4 n ASP 178 Ca -0.03 -1.54 0.12 0.00 -0.71 0.00 0.00 54.79 52.64 2jj4 n ASP 178 Cb 0.52 -0.92 0.60 0.00 -1.35 0.00 0.00 41.12 39.97 2jj4 n ASP 178 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 2jj4 h GLU 179 N 0.00 0.00 0.00 0.11 4.81 -1.91 -2.49 114.58 115.10 2jj4 h GLU 179 Ca -0.40 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.52 2jj4 h GLU 179 Cb 1.13 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.45 2jj4 h GLU 179 CO 0.29 0.00 -1.93 0.09 -0.73 0.00 0.00 179.01 176.74 2jj4 n ASN 180 N -2.31 0.59 0.00 1.04 3.02 -1.26 -4.99 115.26 111.35 2jj4 n ASN 180 Ca -0.01 0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 2jj4 n ASN 180 Cb 0.08 0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.53 2jj4 n ASN 180 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jj4 n GLY 181 N 1.62 1.06 3.72 7.41 0.00 -0.94 -5.11 105.19 112.96 2jj4 n GLY 181 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2jj4 n GLY 181 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jj4 s GLN 182 N 0.00 4.46 0.37 1.61 2.00 -1.26 -4.77 119.66 122.07 2jj4 s GLN 182 Ca 0.00 1.84 -0.24 0.00 -2.00 0.00 0.00 55.36 54.96 2jj4 s GLN 182 Cb 0.00 -3.29 -0.10 0.00 0.80 0.00 0.00 33.01 30.42 2jj4 s GLN 182 CO 0.00 -0.18 0.96 -1.12 -0.50 0.00 0.00 175.29 174.44 2jj4 s SER 183 N 0.60 7.11 -0.04 6.67 0.01 -1.26 -0.90 113.70 125.89 2jj4 s SER 183 Ca 0.56 1.80 0.02 0.00 1.31 0.00 0.00 55.95 59.64 2jj4 s SER 183 Cb -0.31 -2.56 0.01 0.00 0.21 0.00 0.00 66.02 63.36 2jj4 s SER 183 CO 0.33 -0.23 -0.07 -0.36 0.41 0.00 0.00 173.24 173.31 2jj4 s PHE 184 N -1.84 0.92 -0.64 2.43 0.40 0.71 -4.93 117.98 115.02 2jj4 s PHE 184 Ca 0.56 -0.26 -0.28 0.00 -0.60 0.00 0.00 56.93 56.35 2jj4 s PHE 184 Cb -0.15 -0.72 0.03 0.00 0.51 0.00 0.00 43.02 42.69 2jj4 s PHE 184 CO 0.20 -0.16 1.27 1.21 0.70 0.00 0.00 175.22 178.44 2jj4 s ASN 185 N 0.58 6.26 -0.02 1.36 2.47 -0.52 -2.25 114.94 122.82 2jj4 s ASN 185 Ca -0.09 -0.09 -0.06 0.00 0.42 0.00 0.00 52.86 53.04 2jj4 s ASN 185 Cb -0.12 -2.55 -0.04 0.00 -1.45 0.00 0.00 41.25 37.08 2jj4 s ASN 185 CO 0.01 -1.68 0.22 -0.63 -3.72 0.00 0.00 177.10 171.30 2jj4 s ILE 186 N 5.52 5.37 0.27 -5.21 1.01 -1.10 -0.91 121.20 126.14 2jj4 s ILE 186 Ca 0.41 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.85 2jj4 s ILE 186 Cb -0.08 -3.53 -0.13 0.00 0.01 0.00 0.00 42.46 38.73 2jj4 s ILE 186 CO 0.21 0.40 1.39 -3.20 0.00 0.00 0.00 174.94 173.75 2jj4 n ASN 187 N 1.23 2.83 0.07 3.58 2.85 -1.26 -4.71 115.26 119.85 2jj4 n ASN 187 Ca -0.13 1.16 -0.13 0.00 -0.11 0.00 0.00 54.58 55.37 2jj4 n ASN 187 Cb 0.53 -1.45 -0.08 0.00 1.24 0.00 0.00 39.78 40.02 2jj4 n ASN 187 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jj4 h ALA 188 N 3.88 -0.09 -0.16 5.20 0.00 -1.90 -2.96 119.26 123.24 2jj4 h ALA 188 Ca -0.45 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.45 2jj4 h ALA 188 Cb 1.27 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.04 2jj4 h ALA 188 CO 0.73 -0.51 -0.22 -0.44 0.00 0.00 0.00 179.25 178.81 2jj4 h ASP 189 N -0.17 -0.69 -0.54 0.00 3.32 -1.96 -0.79 116.42 115.59 2jj4 h ASP 189 Ca -0.01 0.12 0.05 0.00 0.02 0.00 0.00 57.03 57.21 2jj4 h ASP 189 Cb 0.14 0.32 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 2jj4 h ASP 189 CO 0.02 -0.27 0.26 0.71 -1.72 0.00 0.00 179.24 178.24 2jj4 h THR 190 N -0.26 0.92 -0.32 0.35 1.35 -1.94 0.11 112.91 113.13 2jj4 h THR 190 Ca 0.11 -0.17 0.05 0.00 -0.55 0.00 0.00 66.41 65.85 2jj4 h THR 190 Cb 0.43 0.38 -0.05 0.00 -1.73 0.00 0.00 68.15 67.18 2jj4 h THR 190 CO -0.32 0.09 0.02 0.58 -0.25 0.00 0.00 175.52 175.64 2jj4 h VAL 191 N 0.50 0.79 -0.25 6.82 2.07 -1.22 0.21 116.25 125.17 2jj4 h VAL 191 Ca 0.24 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.79 2jj4 h VAL 191 Cb 0.18 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 2jj4 h VAL 191 CO -0.19 0.02 -0.16 0.00 0.02 0.00 0.00 177.57 177.26 2jj4 h ALA 192 N 1.26 0.02 -0.57 1.67 0.00 0.07 0.38 119.26 122.10 2jj4 h ALA 192 Ca 0.15 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.23 2jj4 h ALA 192 Cb 0.19 0.37 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2jj4 h ALA 192 CO -0.24 -0.57 0.23 0.78 0.00 0.00 0.00 179.25 179.45 2jj4 h GLY 193 N -0.14 0.79 1.60 0.00 0.00 0.21 0.12 103.07 105.65 2jj4 h GLY 193 Ca 0.14 -0.14 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 2jj4 h GLY 193 CO -0.34 0.03 -0.89 0.83 0.00 0.00 0.00 176.54 176.16 2jj4 h GLU 194 N 0.44 0.36 0.05 4.80 4.39 0.08 0.03 114.58 124.72 2jj4 h GLU 194 Ca 0.27 -0.38 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 2jj4 h GLU 194 Cb 0.29 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2jj4 h GLU 194 CO -0.25 1.05 -0.02 0.82 -1.16 0.00 0.00 179.01 179.45 2jj4 h ILE 195 N 0.21 1.01 -0.89 3.13 1.08 -0.03 -0.68 117.51 121.34 2jj4 h ILE 195 Ca -0.06 -0.17 0.11 0.00 -0.39 0.00 0.00 64.86 64.35 2jj4 h ILE 195 Cb 1.52 1.12 -0.08 0.00 -3.07 0.00 0.00 36.82 36.31 2jj4 h ILE 195 CO 0.15 0.04 0.52 0.00 -0.69 0.00 0.00 178.15 178.17 2jj4 h ALA 196 N 0.82 1.31 -0.38 1.87 0.00 -0.63 0.29 119.26 122.54 2jj4 h ALA 196 Ca -0.01 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2jj4 h ALA 196 Cb 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2jj4 h ALA 196 CO 0.01 0.11 0.03 0.00 0.00 0.00 0.00 179.25 179.40 2jj4 h ALA 197 N 1.50 0.51 -0.03 0.00 0.00 -0.81 0.94 119.26 121.37 2jj4 h ALA 197 Ca 0.44 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 2jj4 h ALA 197 Cb 0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2jj4 h ALA 197 CO -0.27 0.25 -0.38 0.00 0.00 0.00 0.00 179.25 178.85 2jj4 h ALA 198 N 0.90 1.32 -0.01 0.00 0.00 -0.39 -1.77 119.26 119.30 2jj4 h ALA 198 Ca 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jj4 h ALA 198 Cb 0.41 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2jj4 h ALA 198 CO 0.01 0.50 -0.07 1.28 0.00 0.00 0.00 179.25 180.97 2jj4 n LEU 199 N -4.08 1.25 -3.53 0.00 4.77 0.02 -4.93 117.00 110.51 2jj4 n LEU 199 Ca -0.02 -0.39 -0.26 0.00 -0.03 0.00 0.00 56.01 55.31 2jj4 n LEU 199 Cb 0.42 -0.04 0.03 0.00 -2.33 0.00 0.00 43.42 41.50 2jj4 n LEU 199 CO 0.39 0.21 0.07 -3.20 -1.33 0.00 0.00 177.39 173.54 2jj4 n ASN 200 N -0.14 -5.15 -4.70 -1.43 2.85 -0.67 -4.90 115.26 101.12 2jj4 n ASN 200 Ca 0.17 -0.54 -0.40 0.00 -0.11 0.00 0.00 54.58 53.71 2jj4 n ASN 200 Cb 0.34 -4.13 0.03 0.00 1.24 0.00 0.00 39.78 37.25 2jj4 n ASN 200 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jj4 n ALA 201 N -4.21 1.23 -0.06 5.20 0.00 0.26 -4.85 120.51 118.08 2jj4 n ALA 201 Ca -0.01 0.19 -0.09 0.00 0.00 0.00 0.00 53.44 53.52 2jj4 n ALA 201 Cb 0.56 -2.27 0.06 0.00 0.00 0.00 0.00 19.45 17.79 2jj4 n ALA 201 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2jj4 h GLU 202 N 1.68 0.74 -3.67 0.00 4.57 -1.69 -3.24 114.58 112.97 2jj4 h GLU 202 Ca -0.49 -0.36 -0.29 0.00 -1.18 0.00 0.00 59.36 57.04 2jj4 h GLU 202 Cb 1.31 -0.00 -0.32 0.00 -0.16 0.00 0.00 28.75 29.58 2jj4 h GLU 202 CO 0.58 0.98 -0.73 0.15 -1.18 0.00 0.00 179.01 178.81 2jj4 s LYS 203 N -4.38 0.07 -0.33 1.92 1.02 -1.17 -1.96 119.74 114.90 2jj4 s LYS 203 Ca -0.09 0.09 -0.06 0.00 0.02 0.00 0.00 55.97 55.93 2jj4 s LYS 203 Cb 0.12 -0.23 0.04 0.00 -0.52 0.00 0.00 37.83 37.24 2jj4 s LYS 203 CO 0.85 -0.09 0.08 -1.17 -0.92 0.00 0.00 175.35 174.10 2jj4 s LEU 204 N 0.67 4.22 -0.24 3.17 2.96 -0.24 -1.24 118.68 127.99 2jj4 s LEU 204 Ca -0.06 -1.15 -0.04 0.00 -0.22 0.00 0.00 54.13 52.66 2jj4 s LEU 204 Cb -0.09 -1.84 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 2jj4 s LEU 204 CO -0.02 -0.31 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.06 2jj4 s ILE 205 N 1.38 3.47 -0.37 6.68 1.01 0.35 -0.06 121.20 133.66 2jj4 s ILE 205 Ca -0.02 -0.59 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 2jj4 s ILE 205 Cb -0.19 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.62 2jj4 s ILE 205 CO 0.02 0.32 0.25 -0.76 0.00 0.00 0.00 174.94 174.77 2jj4 s LEU 206 N 1.47 4.71 0.15 2.97 1.43 0.11 -0.10 118.68 129.43 2jj4 s LEU 206 Ca 0.04 -0.66 -0.30 0.00 -1.03 0.00 0.00 54.13 52.18 2jj4 s LEU 206 Cb -0.15 -2.12 -0.07 0.00 0.03 0.00 0.00 46.19 43.88 2jj4 s LEU 206 CO -0.02 -0.32 1.15 -0.76 0.23 0.00 0.00 176.35 176.63 2jj4 s LEU 207 N 1.68 4.45 0.18 1.79 1.43 -0.89 -1.67 118.68 125.64 2jj4 s LEU 207 Ca 0.05 2.12 -0.15 0.00 -1.03 0.00 0.00 54.13 55.12 2jj4 s LEU 207 Cb -0.18 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.46 2jj4 s LEU 207 CO 0.09 -0.33 0.43 0.28 0.23 0.00 0.00 176.35 177.06 2jj4 s THR 208 N 0.12 0.04 -0.18 5.49 -1.32 -0.70 -4.59 115.64 114.50 2jj4 s THR 208 Ca 0.53 -0.95 0.01 0.00 -1.21 0.00 0.00 61.69 60.07 2jj4 s THR 208 Cb -0.30 -1.61 0.21 0.00 -1.51 0.00 0.00 72.50 69.28 2jj4 s THR 208 CO 0.34 -0.20 1.25 0.47 -2.21 0.00 0.00 174.62 174.27 2jj4 n ASP 209 N -0.29 3.18 -4.00 8.08 9.92 -1.26 -0.48 116.55 131.70 2jj4 n ASP 209 Ca -0.10 -2.48 -0.16 0.00 -0.53 0.00 0.00 54.79 51.52 2jj4 n ASP 209 Cb 0.63 -0.60 -0.14 0.00 -0.64 0.00 0.00 41.12 40.37 2jj4 n ASP 209 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2jj4 s THR 210 N -1.04 0.54 -1.62 -3.53 -4.23 -1.26 -5.00 115.64 99.50 2jj4 s THR 210 Ca 0.17 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 2jj4 s THR 210 Cb 0.14 -0.48 0.00 0.00 1.34 0.00 0.00 72.50 73.51 2jj4 s THR 210 CO 0.03 0.06 0.30 -2.11 -0.54 0.00 0.00 174.62 172.37 2jj4 n ARG 211 N 2.67 0.37 0.00 3.99 0.00 -1.26 -3.57 116.66 118.86 2jj4 n ARG 211 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.70 2jj4 n ARG 211 Cb 0.57 -1.07 0.00 0.00 -0.00 0.00 0.00 32.46 31.96 2jj4 n ARG 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jj4 n GLY 212 N 0.04 0.17 3.21 2.89 0.00 -1.26 -3.98 105.19 106.26 2jj4 n GLY 212 Ca 0.00 -1.89 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 2jj4 n GLY 212 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj4 s ILE 213 N 0.00 3.45 -0.05 -0.61 1.01 -1.26 -4.90 121.20 118.83 2jj4 s ILE 213 Ca 0.00 -1.39 -0.30 0.00 0.00 0.00 0.00 60.65 58.97 2jj4 s ILE 213 Cb 0.00 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 2jj4 s ILE 213 CO 0.00 -0.26 1.02 -0.76 0.00 0.00 0.00 174.94 174.95 2jj4 s LEU 214 N 1.31 4.30 0.16 2.97 1.43 -1.26 -1.50 118.68 126.09 2jj4 s LEU 214 Ca -0.01 1.63 -0.18 0.00 -1.03 0.00 0.00 54.13 54.54 2jj4 s LEU 214 Cb -0.20 -3.56 0.06 0.00 0.03 0.00 0.00 46.19 42.51 2jj4 s LEU 214 CO 0.00 -0.39 1.67 -0.08 0.23 0.00 0.00 176.35 177.79 2jj4 h GLU 215 N 7.00 -0.02 -3.86 1.70 4.57 -1.83 -3.39 114.58 118.74 2jj4 h GLU 215 Ca -0.36 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 57.32 2jj4 h GLU 215 Cb 1.18 0.00 -0.38 0.00 -0.16 0.00 0.00 28.75 29.39 2jj4 h GLU 215 CO 0.81 -0.01 -0.78 0.34 -1.18 0.00 0.00 179.01 178.19 2jj4 s ASP 216 N -5.20 2.31 0.00 1.04 -1.08 -1.26 -5.02 116.67 107.45 2jj4 s ASP 216 Ca -0.14 -0.44 0.11 0.00 -0.52 0.00 0.00 52.55 51.56 2jj4 s ASP 216 Cb 0.13 -0.66 0.65 0.00 -1.46 0.00 0.00 42.92 41.58 2jj4 s ASP 216 CO 0.70 -0.21 1.07 -2.65 0.52 0.00 0.00 175.17 174.61 2jj4 n PRO 217 N 5.02 0.45 0.17 4.34 -0.02 -1.26 -4.00 135.00 139.69 2jj4 n PRO 217 Ca -0.10 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.43 2jj4 n PRO 217 Cb 0.49 -1.38 0.19 0.00 -0.02 0.00 0.00 33.50 32.78 2jj4 n PRO 217 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2jj4 h LYS 218 N 0.00 0.00 0.00 -0.52 1.57 -1.96 -3.40 116.57 112.26 2jj4 h LYS 218 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jj4 h LYS 218 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2jj4 h LYS 218 CO 0.00 0.43 0.00 2.89 -0.57 0.00 0.00 179.45 182.20 2jj4 n ARG 219 N -3.35 0.00 -2.24 3.15 1.85 -1.26 -5.16 116.66 109.65 2jj4 n ARG 219 Ca 0.01 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.55 2jj4 n ARG 219 Cb 0.62 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 32.02 2jj4 n ARG 219 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2jj4 s PRO 220 N 0.00 3.70 -0.42 2.89 0.04 -1.26 -3.26 135.00 136.68 2jj4 s PRO 220 Ca 0.00 0.68 -0.16 0.00 0.04 0.00 0.00 61.00 61.56 2jj4 s PRO 220 Cb 0.00 -2.18 0.03 0.00 0.04 0.00 0.00 34.50 32.39 2jj4 s PRO 220 CO 0.00 -0.37 0.36 -1.21 0.04 0.00 0.00 177.00 175.82 2jj4 s GLU 221 N -4.68 3.01 -0.18 4.56 0.41 -1.26 -5.07 118.70 115.50 2jj4 s GLU 221 Ca 0.54 -0.97 0.16 0.00 -0.41 0.00 0.00 54.97 54.30 2jj4 s GLU 221 Cb -0.11 -3.99 0.58 0.00 -1.78 0.00 0.00 34.13 28.83 2jj4 s GLU 221 CO 0.44 -0.82 1.48 -1.13 -0.49 0.00 0.00 175.26 174.74 2jj4 n SER 222 N 5.33 4.20 -4.68 -0.19 3.41 -1.20 -5.04 113.62 115.44 2jj4 n SER 222 Ca -0.10 -2.93 -0.57 0.00 -0.26 0.00 0.00 58.87 55.02 2jj4 n SER 222 Cb 0.47 -0.55 -0.07 0.00 -0.26 0.00 0.00 64.21 63.79 2jj4 n SER 222 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jj4 n LEU 223 N -0.19 2.15 -4.71 1.04 4.77 -1.26 -2.60 117.00 116.20 2jj4 n LEU 223 Ca 0.22 1.09 -0.42 0.00 -0.03 0.00 0.00 56.01 56.87 2jj4 n LEU 223 Cb 0.92 -1.14 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 2jj4 n LEU 223 CO 0.18 -0.60 1.12 -0.63 -1.33 0.00 0.00 177.39 176.13 2jj4 s ILE 224 N 2.82 3.16 -0.06 -0.08 1.01 -0.56 -4.87 121.20 122.62 2jj4 s ILE 224 Ca 0.96 0.81 -0.26 0.00 0.00 0.00 0.00 60.65 62.15 2jj4 s ILE 224 Cb -1.06 -3.52 -0.22 0.00 0.01 0.00 0.00 42.46 37.67 2jj4 s ILE 224 CO 0.62 0.05 1.10 -0.65 0.00 0.00 0.00 174.94 176.06 2jj4 h PRO 225 N 6.95 -0.01 -4.61 2.79 0.11 -1.89 -3.36 132.00 131.97 2jj4 h PRO 225 Ca -0.42 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.35 2jj4 h PRO 225 Cb 1.21 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.06 2jj4 h PRO 225 CO 0.88 0.62 -0.76 -0.98 -0.21 0.00 0.00 178.00 177.55 2jj4 s ARG 226 N -3.62 0.58 0.08 1.05 1.04 -1.26 -0.68 118.95 116.14 2jj4 s ARG 226 Ca -0.17 -0.48 0.01 0.00 -1.04 0.00 0.00 55.73 54.05 2jj4 s ARG 226 Cb 0.00 -0.50 -0.04 0.00 -2.04 0.00 0.00 34.95 32.37 2jj4 s ARG 226 CO 0.67 0.12 -0.06 -0.51 -0.04 0.00 0.00 175.30 175.48 2jj4 s LEU 227 N -0.77 2.46 0.00 -1.89 1.43 -0.37 -4.94 118.68 114.60 2jj4 s LEU 227 Ca -0.02 -0.93 0.03 0.00 -1.03 0.00 0.00 54.13 52.18 2jj4 s LEU 227 Cb -0.06 0.00 0.03 0.00 0.03 0.00 0.00 46.19 46.19 2jj4 s LEU 227 CO 0.00 -0.47 0.24 -0.46 0.23 0.00 0.00 176.35 175.89 2jj4 n ASN 228 N 0.24 1.91 0.18 2.29 0.23 -1.26 -1.44 115.26 117.42 2jj4 n ASN 228 Ca -0.14 -2.03 -0.15 0.00 -0.53 0.00 0.00 54.58 51.74 2jj4 n ASN 228 Cb 0.60 -0.03 -0.08 0.00 -2.08 0.00 0.00 39.78 38.18 2jj4 n ASN 228 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 2jj4 h ILE 229 N 0.56 0.71 -0.57 1.53 2.04 -1.81 -1.39 117.51 118.58 2jj4 h ILE 229 Ca -0.19 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.60 2jj4 h ILE 229 Cb 0.70 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 2jj4 h ILE 229 CO 0.29 0.03 0.30 1.55 0.00 0.00 0.00 178.15 180.32 2jj4 h PRO 230 N -0.48 0.54 -0.76 2.37 0.13 -1.94 0.16 132.00 132.03 2jj4 h PRO 230 Ca -0.04 -0.03 0.07 0.00 -0.87 0.00 0.00 66.00 65.12 2jj4 h PRO 230 Cb 0.36 -0.12 -0.06 0.00 0.13 0.00 0.00 31.00 31.31 2jj4 h PRO 230 CO 0.07 0.36 0.44 1.96 -0.23 0.00 0.00 178.00 180.60 2jj4 h GLN 231 N 0.56 0.77 0.05 0.86 4.20 -1.95 -1.69 115.11 117.91 2jj4 h GLN 231 Ca 0.26 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.92 2jj4 h GLN 231 Cb 0.17 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.77 2jj4 h GLN 231 CO -0.18 0.51 -0.02 0.77 -0.67 0.00 0.00 178.83 179.24 2jj4 h SER 232 N 0.80 -0.06 -1.00 1.46 0.02 -0.34 -2.89 113.55 111.54 2jj4 h SER 232 Ca 0.34 -0.29 0.17 0.00 -0.84 0.00 0.00 61.79 61.17 2jj4 h SER 232 Cb 0.21 0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.66 2jj4 h SER 232 CO -0.19 0.26 0.61 0.03 -1.14 0.00 0.00 176.83 176.40 2jj4 h ARG 233 N -0.38 0.80 -0.51 3.45 2.47 -0.50 -1.78 114.38 117.93 2jj4 h ARG 233 Ca -0.01 -0.05 -0.12 0.00 -1.26 0.00 0.00 59.98 58.55 2jj4 h ARG 233 Cb 0.34 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.46 2jj4 h ARG 233 CO 0.01 0.53 -0.14 1.49 0.56 0.00 0.00 179.97 182.42 2jj4 h GLU 234 N 0.82 0.98 -0.14 0.04 4.57 -1.24 -3.08 114.58 116.54 2jj4 h GLU 234 Ca 0.55 -0.37 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 2jj4 h GLU 234 Cb 0.78 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 2jj4 h GLU 234 CO -0.35 1.05 -0.03 -0.07 -1.18 0.00 0.00 179.01 178.43 2jj4 h LEU 235 N 0.86 0.18 -0.37 1.64 3.38 -1.11 0.39 115.31 120.28 2jj4 h LEU 235 Ca 0.13 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2jj4 h LEU 235 Cb 0.70 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2jj4 h LEU 235 CO 0.05 0.24 0.15 0.40 0.09 0.00 0.00 178.44 179.38 2jj4 h ILE 236 N 0.20 1.19 -0.41 1.22 2.04 -1.43 -1.90 117.51 118.42 2jj4 h ILE 236 Ca 0.05 -0.59 -0.11 0.00 1.00 0.00 0.00 64.86 65.20 2jj4 h ILE 236 Cb 0.18 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2jj4 h ILE 236 CO 0.01 0.21 -0.19 0.00 0.00 0.00 0.00 178.15 178.18 2jj4 h ALA 237 N 0.99 0.90 0.00 1.87 0.00 -1.16 -2.48 119.26 119.38 2jj4 h ALA 237 Ca 0.12 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2jj4 h ALA 237 Cb 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jj4 h ALA 237 CO -0.01 0.62 0.00 1.04 0.00 0.00 0.00 179.25 180.90 2jj4 n GLN 238 N -4.13 0.52 0.00 0.00 6.02 -0.01 -4.91 117.38 114.87 2jj4 n GLN 238 Ca 0.00 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 2jj4 n GLN 238 Cb 0.41 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.17 2jj4 n GLN 238 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jj4 n GLY 239 N 1.06 2.87 0.16 1.08 0.00 -0.77 -4.88 105.19 104.71 2jj4 n GLY 239 Ca 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.12 2jj4 n GLY 239 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jj4 h ILE 240 N 0.00 0.73 -3.43 -0.61 2.04 -1.69 -3.31 117.51 111.24 2jj4 h ILE 240 Ca 0.00 -0.03 -0.58 0.00 1.00 0.00 0.00 64.86 65.24 2jj4 h ILE 240 Cb 0.00 0.62 -0.10 0.00 -0.74 0.00 0.00 36.82 36.61 2jj4 h ILE 240 CO 0.00 0.02 0.74 -0.69 0.00 0.00 0.00 178.15 178.21 2jj4 s VAL 241 N -6.18 4.29 0.21 1.67 1.01 -0.97 -4.97 120.40 115.45 2jj4 s VAL 241 Ca -0.13 0.74 0.03 0.00 0.00 0.00 0.00 61.98 62.62 2jj4 s VAL 241 Cb 0.13 -4.57 -0.01 0.00 0.00 0.00 0.00 36.38 31.93 2jj4 s VAL 241 CO 0.71 -1.07 0.11 0.61 0.00 0.00 0.00 175.10 175.45 2jj4 n GLY 242 N 5.00 3.56 7.00 4.51 0.00 -1.25 -4.49 105.19 119.52 2jj4 n GLY 242 Ca 0.07 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2jj4 n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jj4 n GLY 243 N 0.29 3.63 2.80 -0.02 0.00 -1.26 -3.44 105.19 107.19 2jj4 n GLY 243 Ca -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 46.02 45.94 2jj4 n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jj4 n GLY 244 N 0.00 1.77 0.00 -0.02 0.00 -1.26 -3.49 105.19 102.19 2jj4 n GLY 244 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 2jj4 n GLY 244 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2jj4 n MET 245 N -0.63 0.00 -0.06 1.61 0.00 -1.25 -3.99 117.12 112.81 2jj4 n MET 245 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 57.70 57.60 2jj4 n MET 245 Cb 0.81 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.93 2jj4 n MET 245 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 2jj4 h ILE 246 N 0.00 0.00 0.00 1.12 2.04 -1.59 0.31 117.51 119.39 2jj4 h ILE 246 Ca 0.00 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 2jj4 h ILE 246 Cb 0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.07 2jj4 h ILE 246 CO 0.00 0.00 -0.27 1.55 0.00 0.00 0.00 178.15 179.43 2jj4 h PRO 247 N -0.51 0.00 -0.30 2.37 0.13 -1.81 0.32 132.00 132.19 2jj4 h PRO 247 Ca 0.05 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.13 2jj4 h PRO 247 Cb 0.65 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 2jj4 h PRO 247 CO -0.50 0.27 0.01 0.87 -0.23 0.00 0.00 178.00 178.42 2jj4 h LYS 248 N 0.00 0.53 -0.48 0.86 1.57 -1.43 0.43 116.57 118.05 2jj4 h LYS 248 Ca -0.00 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.48 2jj4 h LYS 248 Cb 0.49 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 2jj4 h LYS 248 CO 0.03 0.66 -0.22 0.28 -0.57 0.00 0.00 179.45 179.63 2jj4 h VAL 249 N 0.33 1.27 -0.28 0.50 2.07 -0.20 -2.51 116.25 117.43 2jj4 h VAL 249 Ca 0.09 -1.39 0.06 0.00 0.82 0.00 0.00 66.70 66.28 2jj4 h VAL 249 Cb 0.41 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.25 2jj4 h VAL 249 CO 0.01 0.48 -0.15 0.44 0.02 0.00 0.00 177.57 178.38 2jj4 h ASP 250 N 0.86 -0.50 -0.12 0.57 3.32 -0.82 -1.92 116.42 117.83 2jj4 h ASP 250 Ca 0.11 0.11 0.04 0.00 0.02 0.00 0.00 57.03 57.31 2jj4 h ASP 250 Cb 0.81 0.27 -0.06 0.00 0.22 0.00 0.00 39.33 40.56 2jj4 h ASP 250 CO 0.07 -0.18 -0.44 0.00 -1.72 0.00 0.00 179.24 176.97 2jj4 h ILE 253 N -0.13 0.89 -0.94 0.00 2.04 -0.91 0.47 117.51 118.94 2jj4 h ILE 253 Ca 0.20 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 66.07 2jj4 h ILE 253 Cb 0.43 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.34 2jj4 h ILE 253 CO -0.49 0.00 0.62 -0.09 0.00 0.00 0.00 178.15 178.20 2jj4 h ARG 254 N 0.02 1.23 -0.08 2.37 2.43 -0.08 -0.16 114.38 120.11 2jj4 h ARG 254 Ca 0.06 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 2jj4 h ARG 254 Cb 0.08 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 2jj4 h ARG 254 CO -0.12 0.81 -0.28 1.03 -1.51 0.00 0.00 179.97 179.90 2jj4 h SER 255 N 1.26 0.38 -0.92 -3.80 0.87 -0.10 -3.23 113.55 108.02 2jj4 h SER 255 Ca 0.35 -0.62 -0.01 0.00 -1.23 0.00 0.00 61.79 60.28 2jj4 h SER 255 Cb -0.12 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 61.68 2jj4 h SER 255 CO -0.08 0.94 0.54 -0.07 -0.53 0.00 0.00 176.83 177.63 2jj4 h LEU 256 N -0.16 1.11 -1.48 2.23 3.38 0.21 -2.37 115.31 118.24 2jj4 h LEU 256 Ca -0.01 -0.08 0.10 0.00 0.09 0.00 0.00 57.88 57.98 2jj4 h LEU 256 Cb 0.91 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 2jj4 h LEU 256 CO 0.06 0.86 0.47 0.00 0.09 0.00 0.00 178.44 179.92 2jj4 h ALA 257 N 1.30 1.89 0.00 1.53 0.00 -1.09 -2.69 119.26 120.19 2jj4 h ALA 257 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2jj4 h ALA 257 Cb -0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2jj4 h ALA 257 CO -0.06 -0.05 0.00 1.04 0.00 0.00 0.00 179.25 180.19 2jj4 n GLN 258 N -4.49 0.18 0.00 0.00 6.02 -0.89 -4.86 117.38 113.33 2jj4 n GLN 258 Ca 0.12 0.24 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 2jj4 n GLN 258 Cb 0.36 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 29.87 2jj4 n GLN 258 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jj4 n GLY 259 N 0.84 1.21 3.64 1.08 0.00 -1.02 -5.02 105.19 105.93 2jj4 n GLY 259 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 2jj4 n GLY 259 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jj4 n VAL 260 N 0.00 1.32 0.03 1.61 0.31 -1.23 -4.92 118.33 115.45 2jj4 n VAL 260 Ca 0.00 -0.33 -0.08 0.00 -0.01 0.00 0.00 64.34 63.92 2jj4 n VAL 260 Cb 0.00 -1.29 -0.13 0.00 -0.91 0.00 0.00 33.84 31.52 2jj4 n VAL 260 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2jj4 h ARG 261 N 3.35 0.02 -2.88 5.55 2.43 -1.63 -3.42 114.38 117.80 2jj4 h ARG 261 Ca -0.44 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.56 2jj4 h ARG 261 Cb 1.30 0.01 -0.25 0.00 -0.42 0.00 0.00 29.97 30.61 2jj4 h ARG 261 CO 0.70 0.85 -0.32 0.00 -1.51 0.00 0.00 179.97 179.68 2jj4 s ALA 262 N -2.67 -0.86 -0.08 2.80 0.00 -0.83 -4.38 121.76 115.75 2jj4 s ALA 262 Ca -0.02 1.03 0.04 0.00 0.00 0.00 0.00 51.96 53.02 2jj4 s ALA 262 Cb 0.09 -0.61 -0.00 0.00 0.00 0.00 0.00 23.12 22.60 2jj4 s ALA 262 CO 0.82 -0.18 -0.21 0.00 0.00 0.00 0.00 175.76 176.20 2jj4 s ALA 263 N 0.36 1.93 -0.11 0.00 0.00 0.02 -1.08 121.76 122.88 2jj4 s ALA 263 Ca -0.01 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.11 2jj4 s ALA 263 Cb -0.03 -0.70 0.01 0.00 0.00 0.00 0.00 23.12 22.40 2jj4 s ALA 263 CO -0.01 0.29 -0.18 -1.01 0.00 0.00 0.00 175.76 174.84 2jj4 s HIS 264 N 0.24 2.23 -0.56 0.00 3.76 0.92 0.74 115.29 122.62 2jj4 s HIS 264 Ca -0.13 -1.03 -0.09 0.00 -0.15 0.00 0.00 55.06 53.66 2jj4 s HIS 264 Cb -0.16 -1.56 0.14 0.00 1.11 0.00 0.00 32.58 32.12 2jj4 s HIS 264 CO 0.06 -0.49 0.44 0.42 -0.85 0.00 0.00 174.74 174.32 2jj4 s ILE 265 N 0.79 4.40 0.25 0.60 1.01 -0.45 0.09 121.20 127.89 2jj4 s ILE 265 Ca -0.10 -2.09 0.11 0.00 0.00 0.00 0.00 60.65 58.57 2jj4 s ILE 265 Cb -0.16 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 2jj4 s ILE 265 CO 0.01 -0.84 -0.11 0.27 0.00 0.00 0.00 174.94 174.26 2jj4 s ILE 266 N 0.94 2.94 -1.15 2.92 -4.36 -0.67 -1.98 121.20 119.84 2jj4 s ILE 266 Ca 0.09 -2.09 -0.21 0.00 -0.26 0.00 0.00 60.65 58.19 2jj4 s ILE 266 Cb -0.23 -2.53 0.05 0.00 1.25 0.00 0.00 42.46 41.00 2jj4 s ILE 266 CO -0.02 -0.33 1.63 -0.62 0.24 0.00 0.00 174.94 175.84 2jj4 s ASP 267 N -3.41 6.50 0.00 4.36 2.15 0.22 -1.73 116.67 124.76 2jj4 s ASP 267 Ca 0.29 -1.87 0.03 0.00 0.43 0.00 0.00 52.55 51.43 2jj4 s ASP 267 Cb -0.06 -2.57 0.14 0.00 -0.30 0.00 0.00 42.92 40.12 2jj4 s ASP 267 CO 0.16 -1.51 0.88 0.61 -0.17 0.00 0.00 175.17 175.15 2jj4 n GLY 268 N 6.17 -0.35 0.20 2.66 0.00 0.36 -2.54 105.19 111.70 2jj4 n GLY 268 Ca 0.41 -0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.56 2jj4 n GLY 268 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jj4 h ARG 269 N 0.00 0.00 -5.92 1.61 3.08 -1.88 -3.28 114.38 108.00 2jj4 h ARG 269 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.37 2jj4 h ARG 269 Cb 0.02 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.92 2jj4 h ARG 269 CO 0.00 0.00 -0.62 0.96 -1.07 0.00 0.00 179.97 179.24 2jj4 s ILE 270 N -3.41 4.29 0.13 2.04 -4.36 -1.05 -4.97 121.20 113.87 2jj4 s ILE 270 Ca 0.04 -0.25 -0.35 0.00 -0.26 0.00 0.00 60.65 59.83 2jj4 s ILE 270 Cb 0.09 -2.81 -0.16 0.00 1.25 0.00 0.00 42.46 40.83 2jj4 s ILE 270 CO 0.53 0.59 1.30 -2.65 0.24 0.00 0.00 174.94 174.95 2jj4 n PRO 271 N 2.27 1.25 -3.67 0.37 -0.02 -1.26 -2.23 135.00 131.71 2jj4 n PRO 271 Ca -0.18 0.45 -0.25 0.00 -2.02 0.00 0.00 63.50 61.49 2jj4 n PRO 271 Cb 0.53 -2.05 0.07 0.00 -0.02 0.00 0.00 33.50 32.03 2jj4 n PRO 271 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2jj4 n HIS 272 N 2.21 -2.77 -0.28 6.00 8.25 -1.26 -4.89 115.22 122.48 2jj4 n HIS 272 Ca 0.17 1.00 0.14 0.00 -0.26 0.00 0.00 57.72 58.77 2jj4 n HIS 272 Cb 0.22 -4.82 0.41 0.00 1.12 0.00 0.00 29.99 26.92 2jj4 n HIS 272 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jj4 h ALA 273 N 1.01 1.92 0.58 -1.41 0.00 -1.76 -2.65 119.26 116.94 2jj4 h ALA 273 Ca -0.57 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2jj4 h ALA 273 Cb 1.37 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.08 2jj4 h ALA 273 CO 0.58 -0.20 -0.28 -0.07 0.00 0.00 0.00 179.25 179.29 2jj4 h LEU 274 N 0.62 -0.66 -1.41 0.00 3.38 -1.90 -2.73 115.31 112.62 2jj4 h LEU 274 Ca 0.48 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.42 2jj4 h LEU 274 Cb 0.90 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2jj4 h LEU 274 CO -0.23 -0.41 0.15 -0.07 0.09 0.00 0.00 178.44 177.97 2jj4 h LEU 275 N -0.86 0.50 -1.00 1.67 3.38 -1.88 -0.13 115.31 116.99 2jj4 h LEU 275 Ca -0.08 -0.05 0.15 0.00 0.09 0.00 0.00 57.88 57.99 2jj4 h LEU 275 Cb 0.63 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.16 2jj4 h LEU 275 CO 0.13 0.46 0.62 -0.07 0.09 0.00 0.00 178.44 179.67 2jj4 h LEU 276 N 0.55 0.87 0.02 1.67 4.07 -1.41 0.83 115.31 121.92 2jj4 h LEU 276 Ca 0.14 0.07 -0.08 0.00 0.08 0.00 0.00 57.88 58.08 2jj4 h LEU 276 Cb 0.12 -0.10 0.01 0.00 1.08 0.00 0.00 40.66 41.77 2jj4 h LEU 276 CO -0.01 0.41 -0.34 -0.08 -1.08 0.00 0.00 178.44 177.34 2jj4 h GLU 277 N 0.90 0.19 -0.02 1.13 4.57 -0.75 -3.03 114.58 117.58 2jj4 h GLU 277 Ca 0.53 -0.23 -0.03 0.00 -1.18 0.00 0.00 59.36 58.44 2jj4 h GLU 277 Cb 0.65 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2jj4 h GLU 277 CO -0.31 1.00 -0.11 0.82 -1.18 0.00 0.00 179.01 179.23 2jj4 h ILE 278 N -0.52 1.50 -0.10 2.32 1.08 -1.09 -3.37 117.51 117.33 2jj4 h ILE 278 Ca -0.05 -1.63 0.00 0.00 -0.39 0.00 0.00 64.86 62.80 2jj4 h ILE 278 Cb 1.14 2.51 0.00 0.00 -3.07 0.00 0.00 36.82 37.40 2jj4 h ILE 278 CO 0.06 0.44 0.00 0.49 -0.69 0.00 0.00 178.15 178.45 2jj4 n PHE 279 N -4.65 0.11 -4.35 1.37 3.01 0.27 -4.95 117.46 108.27 2jj4 n PHE 279 Ca -0.09 -0.10 -0.21 0.00 1.01 0.00 0.00 57.45 58.07 2jj4 n PHE 279 Cb 0.39 -0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 39.72 2jj4 n PHE 279 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2jj4 s THR 280 N -1.13 1.21 -1.28 4.37 2.01 -1.14 -4.95 115.64 114.72 2jj4 s THR 280 Ca 0.19 -1.10 0.28 0.00 0.31 0.00 0.00 61.69 61.37 2jj4 s THR 280 Cb 0.12 -1.10 0.40 0.00 0.01 0.00 0.00 72.50 71.94 2jj4 s THR 280 CO 0.18 -0.01 1.94 0.47 -0.69 0.00 0.00 174.62 176.51 2jj4 n ASP 281 N 1.75 0.00 -4.73 3.53 8.00 -1.26 -4.54 116.55 119.30 2jj4 n ASP 281 Ca -0.18 0.10 -0.42 0.00 0.71 0.00 0.00 54.79 55.00 2jj4 n ASP 281 Cb 0.54 -0.36 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 2jj4 n ASP 281 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jj4 s ALA 282 N -2.72 3.56 -0.23 2.24 0.00 -1.26 -4.96 121.76 118.38 2jj4 s ALA 282 Ca 0.22 1.14 -0.29 0.00 0.00 0.00 0.00 51.96 53.03 2jj4 s ALA 282 Cb 0.19 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.81 2jj4 s ALA 282 CO 0.45 -0.58 1.07 0.20 0.00 0.00 0.00 175.76 176.90 2jj4 s GLY 283 N 0.53 1.69 0.00 0.00 0.00 -1.26 -4.69 107.32 103.58 2jj4 s GLY 283 Ca 0.59 0.20 0.00 0.00 0.00 0.00 0.00 44.72 45.51 2jj4 s GLY 283 CO 0.37 2.23 0.20 0.29 0.00 0.00 0.00 173.10 176.18 2jj4 n ILE 284 N 5.36 0.00 -3.80 0.90 -0.00 -1.26 -5.06 119.36 115.50 2jj4 n ILE 284 Ca 0.12 -0.35 0.04 0.00 -0.00 0.00 0.00 62.75 62.56 2jj4 n ILE 284 Cb 0.46 1.17 0.00 0.00 -0.00 0.00 0.00 39.64 41.27 2jj4 n ILE 284 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 2jj4 s GLY 285 N -0.30 -0.35 -0.09 3.28 0.00 -1.26 0.72 107.32 109.32 2jj4 s GLY 285 Ca 0.00 0.53 -0.20 0.00 0.00 0.00 0.00 44.72 45.06 2jj4 s GLY 285 CO 0.00 3.50 0.54 -1.59 0.00 0.00 0.00 173.10 175.56 2jj4 s THR 286 N -2.04 5.12 -0.24 0.90 2.01 -0.84 -4.78 115.64 115.77 2jj4 s THR 286 Ca 0.24 1.10 -0.13 0.00 0.31 0.00 0.00 61.69 63.21 2jj4 s THR 286 Cb 0.04 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2jj4 s THR 286 CO -0.04 0.33 0.27 -0.32 -0.69 0.00 0.00 174.62 174.16 2jj4 s MET 287 N 0.51 4.08 -0.23 4.92 0.00 0.14 -1.35 119.30 127.38 2jj4 s MET 287 Ca 0.29 -0.08 -0.06 0.00 0.00 0.00 0.00 55.69 55.84 2jj4 s MET 287 Cb -0.16 -3.57 -0.02 0.00 0.00 0.00 0.00 34.83 31.08 2jj4 s MET 287 CO 0.13 -0.04 0.03 0.42 0.00 0.00 0.00 175.02 175.56 2jj4 s ILE 288 N 1.34 4.06 0.59 10.11 1.01 0.23 -1.24 121.20 137.29 2jj4 s ILE 288 Ca 0.12 -0.26 0.06 0.00 0.00 0.00 0.00 60.65 60.56 2jj4 s ILE 288 Cb -0.14 -2.87 0.08 0.00 0.01 0.00 0.00 42.46 39.53 2jj4 s ILE 288 CO 0.07 0.38 0.81 0.68 0.00 0.00 0.00 174.94 176.88 2jj4 s VAL 289 N 1.40 2.34 0.00 2.92 -7.23 -0.52 -0.80 120.40 118.51 2jj4 s VAL 289 Ca 0.05 -0.85 0.00 0.00 -1.81 0.00 0.00 61.98 59.37 2jj4 s VAL 289 Cb -0.15 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.30 2jj4 s VAL 289 CO 0.02 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.42 2jj4 n GLY 290 N -2.35 1.08 0.00 2.32 0.00 -1.26 -3.34 105.19 101.63 2jj4 n GLY 290 Ca 0.13 -0.94 0.04 0.00 0.00 0.00 0.00 46.02 45.25 2jj4 n GLY 290 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76