#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j41 s GLY 6 N 0.00 1.61 0.45 0.72 0.00 -0.54 -4.91 107.32 104.65 2j41 s GLY 6 Ca 0.00 -0.30 -0.20 0.00 0.00 0.00 0.00 44.72 44.21 2j41 s GLY 6 CO 0.00 0.16 0.97 1.08 0.00 0.00 0.00 173.10 175.31 2j41 s LEU 7 N -5.85 3.88 -0.29 0.66 1.43 -1.26 -4.80 118.68 112.45 2j41 s LEU 7 Ca 0.62 1.71 -0.12 0.00 -1.03 0.00 0.00 54.13 55.31 2j41 s LEU 7 Cb -0.14 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 2j41 s LEU 7 CO 0.54 -0.46 0.22 -0.22 0.23 0.00 0.00 176.35 176.66 2j41 s LEU 8 N -3.35 4.13 -0.19 1.79 2.96 -1.26 -0.78 118.68 121.97 2j41 s LEU 8 Ca 0.62 -0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 54.42 2j41 s LEU 8 Cb -0.10 -2.16 -0.02 0.00 0.50 0.00 0.00 46.19 44.41 2j41 s LEU 8 CO 0.16 -0.10 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.45 2j41 s ILE 9 N 1.79 3.85 -0.23 6.68 1.01 0.28 -0.82 121.20 133.76 2j41 s ILE 9 Ca 0.08 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.40 2j41 s ILE 9 Cb -0.16 -2.73 0.04 0.00 0.01 0.00 0.00 42.46 39.62 2j41 s ILE 9 CO 0.11 0.44 -0.14 -0.69 0.00 0.00 0.00 174.94 174.65 2j41 s VAL 10 N 0.95 2.15 -0.31 2.92 1.01 0.13 -0.57 120.40 126.68 2j41 s VAL 10 Ca 0.01 -1.34 -0.13 0.00 0.00 0.00 0.00 61.98 60.52 2j41 s VAL 10 Cb -0.14 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2j41 s VAL 10 CO 0.02 0.20 0.25 -0.22 0.00 0.00 0.00 175.10 175.35 2j41 s LEU 11 N 1.18 4.29 0.00 3.92 2.96 0.27 -0.51 118.68 130.79 2j41 s LEU 11 Ca -0.03 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.68 2j41 s LEU 11 Cb -0.17 -2.18 0.00 0.00 0.50 0.00 0.00 46.19 44.34 2j41 s LEU 11 CO -0.08 -0.18 0.00 -0.24 -1.32 0.00 0.00 176.35 174.53 2j41 n SER 12 N 5.14 0.38 0.00 3.68 2.88 -0.53 -2.23 113.62 122.94 2j41 n SER 12 Ca -0.12 -0.68 0.00 0.00 -1.33 0.00 0.00 58.87 56.74 2j41 n SER 12 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 2j41 n SER 12 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2j41 n GLY 13 N 0.95 2.09 3.70 0.46 0.00 -1.26 -0.26 105.19 110.87 2j41 n GLY 13 Ca 0.00 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 2j41 n GLY 13 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2j41 s PRO 14 N -1.57 1.41 0.33 1.61 0.02 -1.26 -4.40 135.00 131.14 2j41 s PRO 14 Ca 0.00 1.46 -0.29 0.00 0.02 0.00 0.00 61.00 62.19 2j41 s PRO 14 Cb 0.00 -1.78 -0.12 0.00 0.02 0.00 0.00 34.50 32.62 2j41 s PRO 14 CO 0.00 -2.33 1.50 0.43 -0.33 0.00 0.00 177.00 176.27 2j41 n SER 15 N -3.96 3.59 0.00 2.53 7.64 -1.26 -2.63 113.62 119.54 2j41 n SER 15 Ca 0.11 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.18 2j41 n SER 15 Cb 0.52 -1.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 2j41 n SER 15 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2j41 n GLY 16 N 1.34 0.52 0.19 0.23 0.00 -1.26 -4.89 105.19 101.32 2j41 n GLY 16 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.14 2j41 n GLY 16 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2j41 h VAL 17 N 0.00 0.82 0.00 1.61 3.04 -1.86 -3.47 116.25 116.39 2j41 h VAL 17 Ca 0.00 -1.52 0.00 0.00 -1.01 0.00 0.00 66.70 64.17 2j41 h VAL 17 Cb 0.14 1.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.37 2j41 h VAL 17 CO 0.00 0.35 0.00 0.61 -1.01 0.00 0.00 177.57 177.52 2j41 n GLY 18 N 0.32 1.83 0.19 3.17 0.00 -1.26 -4.89 105.19 104.55 2j41 n GLY 18 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2j41 n GLY 18 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j41 h LYS 19 N 0.00 0.27 -0.07 1.61 1.57 -1.91 -1.87 116.57 116.18 2j41 h LYS 19 Ca 0.00 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2j41 h LYS 19 Cb 0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2j41 h LYS 19 CO 0.00 0.18 -0.01 0.78 -0.57 0.00 0.00 179.45 179.83 2j41 h GLY 20 N 0.28 0.06 1.01 3.86 0.00 -1.97 0.12 103.07 106.43 2j41 h GLY 20 Ca 0.22 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2j41 h GLY 20 CO -0.26 -0.02 0.55 -0.84 0.00 0.00 0.00 176.54 175.98 2j41 h THR 21 N 0.01 1.23 -0.16 4.70 2.02 -1.94 0.14 112.91 118.92 2j41 h THR 21 Ca 0.03 -0.45 -0.09 0.00 0.77 0.00 0.00 66.41 66.66 2j41 h THR 21 Cb 0.04 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.43 2j41 h THR 21 CO -0.06 0.23 -0.26 0.58 0.37 0.00 0.00 175.52 176.38 2j41 h VAL 22 N 1.18 1.35 -0.40 3.16 2.07 -1.19 -1.60 116.25 120.81 2j41 h VAL 22 Ca 0.31 -1.50 0.06 0.00 0.82 0.00 0.00 66.70 66.40 2j41 h VAL 22 Cb -0.10 1.94 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 2j41 h VAL 22 CO -0.06 0.45 0.09 -0.09 0.02 0.00 0.00 177.57 177.98 2j41 h ARG 23 N 0.08 0.22 -0.27 1.57 1.12 -0.79 -0.52 114.38 115.80 2j41 h ARG 23 Ca 0.01 -0.01 0.06 0.00 -1.11 0.00 0.00 59.98 58.93 2j41 h ARG 23 Cb 0.84 -0.05 -0.07 0.00 -0.01 0.00 0.00 29.97 30.69 2j41 h ARG 23 CO 0.06 0.14 -0.17 -0.22 -3.11 0.00 0.00 179.97 176.67 2j41 h LYS 24 N 0.23 -0.14 -0.92 0.20 3.64 -0.63 -1.95 116.57 116.99 2j41 h LYS 24 Ca 0.19 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2j41 h LYS 24 Cb 0.22 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 2j41 h LYS 24 CO -0.24 -0.09 0.53 -0.09 -2.27 0.00 0.00 179.45 177.28 2j41 h ARG 25 N -0.15 1.27 -0.52 1.90 9.65 -0.92 -2.33 114.38 123.28 2j41 h ARG 25 Ca 0.15 -0.13 0.05 0.00 -1.10 0.00 0.00 59.98 58.94 2j41 h ARG 25 Cb 0.37 -0.26 -0.05 0.00 -1.39 0.00 0.00 29.97 28.65 2j41 h ARG 25 CO -0.36 0.91 0.26 0.82 2.80 0.00 0.00 179.97 184.40 2j41 h ILE 26 N 1.29 0.94 -0.01 1.20 2.04 -0.64 -2.48 117.51 119.84 2j41 h ILE 26 Ca 0.33 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 66.02 2j41 h ILE 26 Cb -0.01 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2j41 h ILE 26 CO -0.06 0.09 -0.00 0.49 0.00 0.00 0.00 178.15 178.67 2j41 n PHE 27 N -4.89 0.00 0.69 1.37 3.72 -0.77 -2.54 117.46 115.03 2j41 n PHE 27 Ca 0.05 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.56 2j41 n PHE 27 Cb 0.15 -0.01 0.04 0.00 -0.94 0.00 0.00 39.48 38.71 2j41 n PHE 27 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2j41 n GLU 28 N -0.51 0.21 -2.61 -1.08 1.02 -0.91 -4.85 120.64 111.89 2j41 n GLU 28 Ca 0.22 -0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.92 2j41 n GLU 28 Cb 0.22 -1.56 -0.02 0.00 -0.02 0.00 0.00 31.44 30.05 2j41 n GLU 28 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2j41 s ASP 29 N -3.66 7.07 0.38 1.62 -1.08 -1.05 -4.92 116.67 115.03 2j41 s ASP 29 Ca 0.05 1.45 0.28 0.00 -0.52 0.00 0.00 52.55 53.81 2j41 s ASP 29 Cb 0.15 -2.54 1.16 0.00 -1.46 0.00 0.00 42.92 40.24 2j41 s ASP 29 CO 0.80 -0.68 1.83 1.55 0.52 0.00 0.00 175.17 179.19 2j41 h PRO 30 N 7.58 0.00 0.00 4.34 0.13 -1.89 -2.07 132.00 140.10 2j41 h PRO 30 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2j41 h PRO 30 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2j41 h PRO 30 CO 0.97 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.61 2j41 n SER 31 N -2.59 0.00 -4.67 1.44 3.41 -1.26 -4.81 113.62 105.14 2j41 n SER 31 Ca 0.01 0.24 -0.42 0.00 -0.26 0.00 0.00 58.87 58.44 2j41 n SER 31 Cb 0.25 -0.41 -0.03 0.00 -0.26 0.00 0.00 64.21 63.76 2j41 n SER 31 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2j41 s THR 32 N -2.83 3.83 -0.64 6.66 2.01 -0.78 -4.90 115.64 119.00 2j41 s THR 32 Ca 0.20 1.10 0.23 0.00 0.31 0.00 0.00 61.69 63.53 2j41 s THR 32 Cb 0.20 -3.71 -0.13 0.00 0.01 0.00 0.00 72.50 68.86 2j41 s THR 32 CO 0.50 -0.06 1.01 -1.20 -0.69 0.00 0.00 174.62 174.18 2j41 n SER 33 N 6.24 0.62 -4.74 3.53 7.64 -1.26 -4.98 113.62 120.66 2j41 n SER 33 Ca 0.15 -0.29 -0.31 0.00 1.01 0.00 0.00 58.87 59.43 2j41 n SER 33 Cb 0.44 0.85 0.12 0.00 -1.01 0.00 0.00 64.21 64.60 2j41 n SER 33 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2j41 s TYR 34 N -3.18 2.29 -0.16 1.43 2.02 -1.26 -4.72 117.35 113.76 2j41 s TYR 34 Ca 0.04 1.62 -0.04 0.00 -0.37 0.00 0.00 57.07 58.32 2j41 s TYR 34 Cb 0.15 -3.14 -0.03 0.00 -0.40 0.00 0.00 41.96 38.54 2j41 s TYR 34 CO 0.81 -2.12 -0.04 0.15 -1.57 0.00 0.00 175.55 172.78 2j41 s LYS 35 N -4.83 3.64 -0.07 -0.62 -0.14 0.41 -4.99 119.74 113.15 2j41 s LYS 35 Ca 0.63 -0.54 -0.26 0.00 -1.36 0.00 0.00 55.97 54.44 2j41 s LYS 35 Cb -0.19 -2.91 -0.03 0.00 -1.68 0.00 0.00 37.83 33.02 2j41 s LYS 35 CO 0.57 0.20 0.83 -0.47 -0.76 0.00 0.00 175.35 175.72 2j41 s TYR 36 N 0.47 3.57 -0.42 3.18 5.04 -1.26 -0.95 117.35 126.98 2j41 s TYR 36 Ca -0.04 1.41 -0.29 0.00 -2.44 0.00 0.00 57.07 55.72 2j41 s TYR 36 Cb -0.14 -2.96 0.02 0.00 0.35 0.00 0.00 41.96 39.22 2j41 s TYR 36 CO 0.03 -0.02 1.30 0.45 -1.34 0.00 0.00 175.55 175.96 2j41 s SER 37 N 0.95 6.50 -0.17 4.32 0.15 -0.59 -4.91 113.70 119.95 2j41 s SER 37 Ca 0.43 0.77 -0.29 0.00 0.70 0.00 0.00 55.95 57.55 2j41 s SER 37 Cb -0.19 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.57 2j41 s SER 37 CO 0.20 -1.31 1.17 -0.63 1.20 0.00 0.00 173.24 173.88 2j41 s ILE 38 N 4.91 4.43 0.55 6.45 1.01 -1.26 -4.81 121.20 132.48 2j41 s ILE 38 Ca 0.56 1.73 -0.12 0.00 0.00 0.00 0.00 60.65 62.82 2j41 s ILE 38 Cb -0.12 -4.11 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 2j41 s ILE 38 CO 0.30 -0.12 0.96 -0.44 0.00 0.00 0.00 174.94 175.64 2j41 s SER 39 N 1.63 6.38 0.17 3.58 0.01 -1.26 -4.65 113.70 119.55 2j41 s SER 39 Ca 0.51 1.37 -0.15 0.00 1.31 0.00 0.00 55.95 58.99 2j41 s SER 39 Cb -0.20 -2.44 -0.07 0.00 0.21 0.00 0.00 66.02 63.52 2j41 s SER 39 CO 0.13 -0.70 0.58 -0.04 0.41 0.00 0.00 173.24 173.62 2j41 s MET 40 N -4.67 4.01 0.05 12.44 -1.94 -0.03 -0.40 119.30 128.76 2j41 s MET 40 Ca 0.55 0.54 -0.04 0.00 -1.71 0.00 0.00 55.69 55.02 2j41 s MET 40 Cb -0.11 -2.90 -0.02 0.00 2.01 0.00 0.00 34.83 33.82 2j41 s MET 40 CO 0.44 0.45 0.07 -0.08 -0.01 0.00 0.00 175.02 175.89 2j41 s THR 41 N -1.50 0.15 -1.78 2.05 -1.32 -0.63 -1.02 115.64 111.59 2j41 s THR 41 Ca 0.39 -1.26 0.21 0.00 -1.21 0.00 0.00 61.69 59.82 2j41 s THR 41 Cb -0.15 -1.06 -0.04 0.00 -1.51 0.00 0.00 72.50 69.74 2j41 s THR 41 CO 0.19 -0.70 1.01 0.35 -2.21 0.00 0.00 174.62 173.27 2j41 n THR 42 N 0.55 0.00 -1.64 5.08 -2.24 -0.62 -0.26 114.28 115.15 2j41 n THR 42 Ca -0.18 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.02 2j41 n THR 42 Cb 0.59 1.21 0.07 0.00 -2.10 0.00 0.00 70.33 70.10 2j41 n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j41 s ARG 43 N -2.43 2.49 0.46 -0.78 1.70 -1.26 -4.86 118.95 114.28 2j41 s ARG 43 Ca 0.16 1.66 -0.24 0.00 -0.47 0.00 0.00 55.73 56.84 2j41 s ARG 43 Cb 0.17 -1.89 -0.07 0.00 -0.57 0.00 0.00 34.95 32.59 2j41 s ARG 43 CO 0.58 -1.54 1.33 -0.65 -1.08 0.00 0.00 175.30 173.94 2j41 s GLN 44 N -3.85 3.64 0.34 3.89 -0.21 -1.26 -4.85 119.66 117.37 2j41 s GLN 44 Ca 0.73 2.20 -0.28 0.00 0.02 0.00 0.00 55.36 58.03 2j41 s GLN 44 Cb -0.27 -2.55 -0.10 0.00 1.00 0.00 0.00 33.01 31.09 2j41 s GLN 44 CO 0.42 -0.77 1.27 1.41 -2.12 0.00 0.00 175.29 175.49 2j41 s MET 45 N -2.53 4.30 0.21 2.91 -2.45 -1.26 -5.04 119.30 115.44 2j41 s MET 45 Ca 0.63 2.13 0.07 0.00 -1.25 0.00 0.00 55.69 57.26 2j41 s MET 45 Cb -0.39 -3.00 -0.04 0.00 1.25 0.00 0.00 34.83 32.66 2j41 s MET 45 CO 0.49 -0.20 0.13 1.03 1.05 0.00 0.00 175.02 177.51 2j41 s ARG 46 N -1.88 2.78 0.06 4.11 0.52 -1.26 -5.02 118.95 118.26 2j41 s ARG 46 Ca 0.50 -1.04 -0.37 0.00 -0.52 0.00 0.00 55.73 54.30 2j41 s ARG 46 Cb -0.38 -2.52 -0.18 0.00 0.52 0.00 0.00 34.95 32.39 2j41 s ARG 46 CO 0.50 0.43 1.10 -1.91 0.02 0.00 0.00 175.30 175.44 2j41 n GLU 47 N -0.72 0.45 0.00 3.54 2.13 -1.26 -0.67 120.64 124.10 2j41 n GLU 47 Ca -0.08 0.16 0.00 0.00 0.66 0.00 0.00 57.16 57.90 2j41 n GLU 47 Cb 0.57 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.62 2j41 n GLU 47 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2j41 n GLY 48 N 1.88 2.99 3.81 8.31 0.00 -1.26 -5.03 105.19 115.89 2j41 n GLY 48 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2j41 n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j41 s GLU 49 N -0.37 4.34 -0.12 1.61 2.02 0.15 -5.06 118.70 121.27 2j41 s GLU 49 Ca 0.00 1.06 0.02 0.00 0.02 0.00 0.00 54.97 56.08 2j41 s GLU 49 Cb 0.00 -2.66 0.01 0.00 0.10 0.00 0.00 34.13 31.58 2j41 s GLU 49 CO 0.00 0.24 -0.19 0.08 0.02 0.00 0.00 175.26 175.41 2j41 s VAL 50 N -1.74 1.83 0.15 2.63 1.01 -1.26 -4.83 120.40 118.19 2j41 s VAL 50 Ca 0.51 -0.85 -0.32 0.00 0.00 0.00 0.00 61.98 61.32 2j41 s VAL 50 Cb -0.15 -1.63 -0.12 0.00 0.00 0.00 0.00 36.38 34.48 2j41 s VAL 50 CO 0.20 0.51 1.74 -0.67 0.00 0.00 0.00 175.10 176.88 2j41 n ASP 51 N 4.05 3.78 0.00 3.32 2.03 -1.26 -1.52 116.55 126.95 2j41 n ASP 51 Ca -0.20 1.03 0.00 0.00 0.52 0.00 0.00 54.79 56.15 2j41 n ASP 51 Cb 0.52 -1.52 0.00 0.00 -0.72 0.00 0.00 41.12 39.40 2j41 n ASP 51 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2j41 n GLY 52 N 3.97 0.77 1.06 0.27 0.00 0.21 -4.85 105.19 106.61 2j41 n GLY 52 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2j41 n GLY 52 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j41 n VAL 53 N -2.16 1.01 -0.03 1.61 0.31 -0.58 -4.86 118.33 113.63 2j41 n VAL 53 Ca 0.00 0.33 -0.14 0.00 -0.01 0.00 0.00 64.34 64.52 2j41 n VAL 53 Cb 0.00 -1.47 -0.10 0.00 -0.91 0.00 0.00 33.84 31.36 2j41 n VAL 53 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2j41 h ASP 54 N 0.00 0.19 -5.14 4.52 3.32 -1.68 -3.48 116.42 114.14 2j41 h ASP 54 Ca 0.00 -0.67 -0.05 0.00 0.02 0.00 0.00 57.03 56.33 2j41 h ASP 54 Cb 0.00 -0.05 -0.11 0.00 0.22 0.00 0.00 39.33 39.39 2j41 h ASP 54 CO 0.00 0.83 -0.08 -0.31 -1.72 0.00 0.00 179.24 177.96 2j41 s TYR 55 N -3.52 0.06 -0.50 4.55 2.02 -1.26 -4.59 117.35 114.11 2j41 s TYR 55 Ca -0.16 -0.41 -0.21 0.00 -0.37 0.00 0.00 57.07 55.93 2j41 s TYR 55 Cb 0.02 0.25 0.04 0.00 -0.40 0.00 0.00 41.96 41.87 2j41 s TYR 55 CO 0.72 -0.87 0.70 -0.06 -1.57 0.00 0.00 175.55 174.48 2j41 s PHE 56 N -3.91 2.99 -0.08 2.71 0.08 0.46 0.64 117.98 120.88 2j41 s PHE 56 Ca 0.12 -0.27 -0.29 0.00 0.12 0.00 0.00 56.93 56.61 2j41 s PHE 56 Cb 0.00 -3.60 -0.02 0.00 -0.57 0.00 0.00 43.02 38.83 2j41 s PHE 56 CO -0.01 -1.06 0.97 -0.06 -0.10 0.00 0.00 175.22 174.96 2j41 s PHE 57 N 2.99 3.55 0.15 0.36 0.08 -1.26 -1.61 117.98 122.24 2j41 s PHE 57 Ca 0.21 1.59 0.06 0.00 0.12 0.00 0.00 56.93 58.91 2j41 s PHE 57 Cb -0.16 -3.14 -0.04 0.00 -0.57 0.00 0.00 43.02 39.11 2j41 s PHE 57 CO 0.16 -0.15 -0.14 0.15 -0.10 0.00 0.00 175.22 175.14 2j41 s LYS 58 N 1.68 1.13 0.68 0.44 -0.14 0.64 -4.94 119.74 119.23 2j41 s LYS 58 Ca 0.48 -1.38 -0.11 0.00 -1.36 0.00 0.00 55.97 53.60 2j41 s LYS 58 Cb -0.19 -0.96 -0.00 0.00 -1.68 0.00 0.00 37.83 35.00 2j41 s LYS 58 CO 0.21 0.17 1.07 0.95 -0.76 0.00 0.00 175.35 176.98 2j41 s THR 59 N -2.53 3.98 0.35 2.17 -4.23 -1.26 -4.07 115.64 110.05 2j41 s THR 59 Ca 0.14 0.64 0.04 0.00 -1.18 0.00 0.00 61.69 61.33 2j41 s THR 59 Cb -0.03 -3.59 0.21 0.00 1.34 0.00 0.00 72.50 70.43 2j41 s THR 59 CO 0.04 -0.84 1.94 0.03 -0.54 0.00 0.00 174.62 175.25 2j41 h ARG 60 N -0.56 0.64 0.08 3.99 3.08 -1.95 -1.47 114.38 118.17 2j41 h ARG 60 Ca -0.45 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.52 2j41 h ARG 60 Cb 1.23 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 31.15 2j41 h ARG 60 CO 0.62 0.53 -0.06 -0.44 -1.07 0.00 0.00 179.97 179.55 2j41 h ASP 61 N 0.64 -0.15 -0.33 7.04 3.32 -1.99 0.08 116.42 125.02 2j41 h ASP 61 Ca 0.16 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 2j41 h ASP 61 Cb 0.13 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2j41 h ASP 61 CO -0.02 -0.10 -0.08 0.00 -1.72 0.00 0.00 179.24 177.33 2j41 h ALA 62 N 0.78 0.46 -0.54 3.45 0.00 -1.91 -1.39 119.26 120.11 2j41 h ALA 62 Ca -0.00 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.64 2j41 h ALA 62 Cb 0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2j41 h ALA 62 CO -0.01 0.30 0.33 0.35 0.00 0.00 0.00 179.25 180.22 2j41 h PHE 63 N 0.43 0.62 -0.50 0.00 3.57 -1.20 -1.02 116.94 118.83 2j41 h PHE 63 Ca 0.08 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.50 2j41 h PHE 63 Cb 0.57 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 2j41 h PHE 63 CO 0.05 0.35 -0.09 0.93 -2.23 0.00 0.00 178.31 177.32 2j41 h GLU 64 N 0.65 0.91 -0.67 1.11 5.08 -0.82 -0.76 114.58 120.09 2j41 h GLU 64 Ca 0.22 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2j41 h GLU 64 Cb 0.01 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2j41 h GLU 64 CO -0.09 0.95 0.33 0.00 -1.00 0.00 0.00 179.01 179.21 2j41 h ALA 65 N 1.07 1.33 -0.42 3.43 0.00 -1.01 -0.78 119.26 122.88 2j41 h ALA 65 Ca 0.14 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2j41 h ALA 65 Cb 0.61 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2j41 h ALA 65 CO 0.04 0.53 -0.19 -0.07 0.00 0.00 0.00 179.25 179.56 2j41 h LEU 66 N 0.94 0.83 0.04 0.00 3.38 -0.59 -1.60 115.31 118.32 2j41 h LEU 66 Ca 0.23 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2j41 h LEU 66 Cb 0.07 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2j41 h LEU 66 CO -0.03 1.01 -0.07 0.40 0.09 0.00 0.00 178.44 179.84 2j41 h ILE 67 N 0.73 0.83 -0.49 1.22 2.04 -0.74 -1.31 117.51 119.78 2j41 h ILE 67 Ca 0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.03 2j41 h ILE 67 Cb 0.71 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 2j41 h ILE 67 CO 0.05 0.00 0.33 0.11 0.00 0.00 0.00 178.15 178.64 2j41 h LYS 68 N -0.14 0.41 -0.15 2.37 1.57 -0.94 0.27 116.57 119.96 2j41 h LYS 68 Ca 0.01 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2j41 h LYS 68 Cb 0.16 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2j41 h LYS 68 CO -0.04 0.27 0.00 -3.47 -0.57 0.00 0.00 179.45 175.64 2j41 n ASP 69 N -4.47 1.35 -2.35 0.86 2.03 -0.62 -4.93 116.55 108.41 2j41 n ASP 69 Ca 0.07 -1.68 -0.14 0.00 0.52 0.00 0.00 54.79 53.55 2j41 n ASP 69 Cb 0.25 -0.09 0.05 0.00 -0.72 0.00 0.00 41.12 40.60 2j41 n ASP 69 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2j41 n ASP 70 N 0.12 -4.42 -1.44 1.67 2.03 0.08 -4.92 116.55 109.67 2j41 n ASP 70 Ca 0.15 -0.33 0.10 0.00 0.52 0.00 0.00 54.79 55.24 2j41 n ASP 70 Cb 0.27 -3.21 0.33 0.00 -0.72 0.00 0.00 41.12 37.80 2j41 n ASP 70 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2j41 n GLN 71 N -3.16 3.12 -4.94 -0.67 1.13 -0.54 -4.88 117.38 107.43 2j41 n GLN 71 Ca -0.01 -2.68 -0.28 0.00 -1.94 0.00 0.00 57.00 52.09 2j41 n GLN 71 Cb 0.54 -1.71 -0.17 0.00 0.11 0.00 0.00 30.24 29.02 2j41 n GLN 71 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 2j41 s PHE 72 N -1.40 2.02 0.28 1.08 0.08 -1.26 -1.82 117.98 116.96 2j41 s PHE 72 Ca 0.49 -0.73 -0.03 0.00 0.12 0.00 0.00 56.93 56.78 2j41 s PHE 72 Cb 0.28 -1.38 0.38 0.00 -0.57 0.00 0.00 43.02 41.74 2j41 s PHE 72 CO 0.29 -0.30 1.92 0.82 -0.10 0.00 0.00 175.22 177.85 2j41 h ILE 73 N 5.63 1.23 -2.57 0.64 2.04 -1.36 -3.45 117.51 119.66 2j41 h ILE 73 Ca -0.27 -0.50 -0.08 0.00 1.00 0.00 0.00 64.86 65.01 2j41 h ILE 73 Cb 1.20 0.09 -0.18 0.00 -0.74 0.00 0.00 36.82 37.19 2j41 h ILE 73 CO 0.47 0.24 -0.00 -1.83 0.00 0.00 0.00 178.15 177.03 2j41 s GLU 74 N -5.81 0.93 0.09 2.37 4.04 -1.26 -4.56 118.70 114.49 2j41 s GLU 74 Ca -0.12 -0.05 -0.10 0.00 0.04 0.00 0.00 54.97 54.75 2j41 s GLU 74 Cb 0.17 0.43 0.00 0.00 0.02 0.00 0.00 34.13 34.76 2j41 s GLU 74 CO 0.80 -0.30 0.22 1.52 -1.84 0.00 0.00 175.26 175.67 2j41 s TYR 75 N -1.65 0.08 0.13 4.83 -0.85 -1.26 -1.71 117.35 116.92 2j41 s TYR 75 Ca -0.10 -0.48 -0.10 0.00 -0.52 0.00 0.00 57.07 55.88 2j41 s TYR 75 Cb -0.02 -0.01 0.00 0.00 0.38 0.00 0.00 41.96 42.32 2j41 s TYR 75 CO 0.04 -0.56 0.27 0.00 -1.52 0.00 0.00 175.55 173.79 2j41 s ALA 76 N -3.72 -0.23 -0.19 9.51 0.00 0.19 -4.66 121.76 122.67 2j41 s ALA 76 Ca 0.04 -0.67 -0.06 0.00 0.00 0.00 0.00 51.96 51.27 2j41 s ALA 76 Cb 0.04 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 2j41 s ALA 76 CO -0.10 -0.60 0.02 -2.00 0.00 0.00 0.00 175.76 173.07 2j41 s GLU 77 N -3.91 3.78 -0.07 0.00 2.12 -1.26 -1.30 118.70 118.06 2j41 s GLU 77 Ca 0.11 -0.45 -0.01 0.00 0.36 0.00 0.00 54.97 54.98 2j41 s GLU 77 Cb 0.03 -3.12 0.03 0.00 0.26 0.00 0.00 34.13 31.34 2j41 s GLU 77 CO -0.06 0.15 -0.01 -0.47 -0.54 0.00 0.00 175.26 174.34 2j41 s TYR 78 N 0.65 0.69 -1.44 5.30 5.04 0.69 -4.84 117.35 123.44 2j41 s TYR 78 Ca 0.01 -0.18 -0.08 0.00 -2.44 0.00 0.00 57.07 54.38 2j41 s TYR 78 Cb -0.14 -0.77 0.01 0.00 0.35 0.00 0.00 41.96 41.41 2j41 s TYR 78 CO 0.02 -0.30 0.24 0.28 -1.34 0.00 0.00 175.55 174.45 2j41 n VAL 79 N 4.91 -1.92 -1.01 3.14 0.31 -1.26 -2.14 118.33 120.37 2j41 n VAL 79 Ca -0.11 -0.54 -0.00 0.00 -0.01 0.00 0.00 64.34 63.67 2j41 n VAL 79 Cb 0.50 -1.69 -0.00 0.00 -0.91 0.00 0.00 33.84 31.74 2j41 n VAL 79 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j41 n GLY 80 N -2.35 0.45 3.16 2.92 0.00 -1.26 -5.02 105.19 103.09 2j41 n GLY 80 Ca -0.27 -0.14 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 2j41 n GLY 80 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j41 s ASN 81 N -2.14 1.54 0.31 1.61 0.01 -0.91 -5.00 114.94 110.37 2j41 s ASN 81 Ca 0.00 -0.64 -0.23 0.00 -0.71 0.00 0.00 52.86 51.28 2j41 s ASN 81 Cb 0.00 -0.03 -0.10 0.00 0.41 0.00 0.00 41.25 41.53 2j41 s ASN 81 CO 0.00 -0.12 0.87 -0.31 -1.51 0.00 0.00 177.10 176.03 2j41 s TYR 82 N -1.50 3.60 -0.01 2.20 2.02 -1.26 -0.22 117.35 122.18 2j41 s TYR 82 Ca -0.02 1.61 -0.01 0.00 -0.37 0.00 0.00 57.07 58.29 2j41 s TYR 82 Cb -0.09 -2.80 0.00 0.00 -0.40 0.00 0.00 41.96 38.67 2j41 s TYR 82 CO 0.02 0.19 0.03 0.71 -1.57 0.00 0.00 175.55 174.93 2j41 s TYR 83 N -1.70 -0.04 0.10 2.71 2.02 -0.42 -1.59 117.35 118.43 2j41 s TYR 83 Ca 0.50 0.10 -0.25 0.00 -0.37 0.00 0.00 57.07 57.05 2j41 s TYR 83 Cb -0.16 0.00 0.08 0.00 -0.40 0.00 0.00 41.96 41.48 2j41 s TYR 83 CO 0.21 -0.02 0.67 0.20 -1.57 0.00 0.00 175.55 175.04 2j41 s GLY 84 N 0.07 -0.58 -0.42 0.71 0.00 -0.19 -0.63 107.32 106.28 2j41 s GLY 84 Ca -0.00 0.71 -0.14 0.00 0.00 0.00 0.00 44.72 45.28 2j41 s GLY 84 CO -0.00 0.30 0.31 -1.59 0.00 0.00 0.00 173.10 172.12 2j41 s THR 85 N -3.28 5.14 0.30 0.90 2.01 -0.70 -0.85 115.64 119.16 2j41 s THR 85 Ca 0.00 -0.80 -0.30 0.00 0.31 0.00 0.00 61.69 60.91 2j41 s THR 85 Cb -0.01 -3.92 -0.12 0.00 0.01 0.00 0.00 72.50 68.47 2j41 s THR 85 CO -0.09 -0.37 1.55 -2.65 -0.69 0.00 0.00 174.62 172.37 2j41 n PRO 86 N 5.14 2.60 -0.06 4.92 -0.02 -1.26 -1.04 135.00 145.28 2j41 n PRO 86 Ca -0.11 0.92 -0.16 0.00 -2.02 0.00 0.00 63.50 62.13 2j41 n PRO 86 Cb 0.46 -2.67 -0.05 0.00 -0.02 0.00 0.00 33.50 31.21 2j41 n PRO 86 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2j41 h VAL 87 N 3.23 1.27 -0.34 -1.45 3.04 -1.69 -3.36 116.25 116.95 2j41 h VAL 87 Ca -0.47 -1.81 -0.11 0.00 -1.01 0.00 0.00 66.70 63.30 2j41 h VAL 87 Cb 1.24 1.75 -0.01 0.00 -2.01 0.00 0.00 31.29 32.25 2j41 h VAL 87 CO 0.76 0.59 -0.20 -0.61 -1.01 0.00 0.00 177.57 177.10 2j41 h GLN 88 N 0.63 0.74 -0.47 4.17 4.15 -1.91 -2.27 115.11 120.15 2j41 h GLN 88 Ca -0.01 -0.34 0.03 0.00 0.77 0.00 0.00 58.65 59.11 2j41 h GLN 88 Cb 1.24 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.88 2j41 h GLN 88 CO 0.14 0.95 0.25 -0.92 -1.93 0.00 0.00 178.83 177.32 2j41 h TYR 89 N 0.52 0.46 0.16 3.99 3.20 -1.99 0.01 116.97 123.31 2j41 h TYR 89 Ca 0.07 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2j41 h TYR 89 Cb 0.75 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.88 2j41 h TYR 89 CO 0.06 0.24 -0.08 0.28 -1.64 0.00 0.00 178.16 177.03 2j41 h VAL 90 N 0.50 0.92 0.01 1.81 2.07 -1.67 -0.74 116.25 119.15 2j41 h VAL 90 Ca 0.20 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2j41 h VAL 90 Cb 0.08 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2j41 h VAL 90 CO -0.12 0.08 -0.14 0.11 0.02 0.00 0.00 177.57 177.52 2j41 h LYS 91 N -0.37 -0.22 -0.53 1.57 1.57 -1.23 -1.41 116.57 115.95 2j41 h LYS 91 Ca -0.02 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2j41 h LYS 91 Cb 0.29 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 2j41 h LYS 91 CO 0.04 -0.15 0.30 -0.44 -0.57 0.00 0.00 179.45 178.63 2j41 h ASP 92 N -0.23 0.65 -0.31 0.86 3.32 -0.98 -1.95 116.42 117.77 2j41 h ASP 92 Ca 0.04 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 56.92 2j41 h ASP 92 Cb 0.29 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2j41 h ASP 92 CO -0.13 0.54 -0.18 0.74 -1.72 0.00 0.00 179.24 178.49 2j41 h THR 93 N 0.71 1.29 -0.95 0.35 2.02 -1.02 -1.59 112.91 113.72 2j41 h THR 93 Ca 0.19 -1.30 -0.00 0.00 0.77 0.00 0.00 66.41 66.06 2j41 h THR 93 Cb 0.02 1.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.85 2j41 h THR 93 CO -0.03 0.42 0.59 0.24 0.37 0.00 0.00 175.52 177.10 2j41 h MET 94 N 0.43 1.28 -0.34 6.66 2.86 -1.24 -2.51 114.93 122.07 2j41 h MET 94 Ca 0.07 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 2j41 h MET 94 Cb 0.72 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 2j41 h MET 94 CO 0.05 0.89 0.08 -0.44 1.06 0.00 0.00 176.91 178.55 2j41 h ASP 95 N 1.31 0.45 0.55 1.22 3.32 -1.03 -0.96 116.42 121.28 2j41 h ASP 95 Ca 0.34 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2j41 h ASP 95 Cb -0.08 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.36 2j41 h ASP 95 CO -0.07 0.46 0.00 -0.62 -1.72 0.00 0.00 179.24 177.30 2j41 n GLU 96 N -4.35 0.05 0.00 3.56 1.02 -0.63 -4.81 120.64 115.49 2j41 n GLU 96 Ca 0.02 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 2j41 n GLU 96 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 2j41 n GLU 96 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j41 n GLY 97 N 0.29 0.53 3.83 0.62 0.00 -0.48 -4.97 105.19 105.01 2j41 n GLY 97 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 2j41 n GLY 97 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2j41 s HIS 98 N -2.00 3.71 0.27 1.61 3.76 -0.97 -3.61 115.29 118.05 2j41 s HIS 98 Ca 0.00 1.12 -0.29 0.00 -0.15 0.00 0.00 55.06 55.73 2j41 s HIS 98 Cb 0.00 -2.39 -0.09 0.00 1.11 0.00 0.00 32.58 31.21 2j41 s HIS 98 CO 0.00 0.54 1.20 -0.51 -0.85 0.00 0.00 174.74 175.11 2j41 s ASP 99 N -1.36 7.06 -0.07 1.40 1.01 -1.26 -3.73 116.67 119.72 2j41 s ASP 99 Ca 0.31 2.39 0.03 0.00 0.71 0.00 0.00 52.55 55.99 2j41 s ASP 99 Cb -0.17 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.11 2j41 s ASP 99 CO 0.18 -0.33 -0.16 -0.69 0.21 0.00 0.00 175.17 174.38 2j41 s VAL 100 N -0.80 2.91 -0.16 -1.27 1.01 0.04 -0.44 120.40 121.69 2j41 s VAL 100 Ca 0.49 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2j41 s VAL 100 Cb -0.35 -2.15 -0.00 0.00 0.00 0.00 0.00 36.38 33.88 2j41 s VAL 100 CO 0.43 0.57 -0.15 0.12 0.00 0.00 0.00 175.10 176.07 2j41 s PHE 101 N -0.33 2.79 -0.09 5.22 5.36 -0.12 -0.55 117.98 130.26 2j41 s PHE 101 Ca 0.03 -1.08 -0.00 0.00 -0.96 0.00 0.00 56.93 54.91 2j41 s PHE 101 Cb -0.13 -1.91 -0.03 0.00 -0.34 0.00 0.00 43.02 40.62 2j41 s PHE 101 CO 0.02 -0.51 -0.06 -0.51 -1.46 0.00 0.00 175.22 172.71 2j41 s LEU 102 N 0.90 3.21 -0.27 6.12 1.43 0.27 -1.54 118.68 128.79 2j41 s LEU 102 Ca -0.04 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.04 2j41 s LEU 102 Cb -0.15 -1.72 0.07 0.00 0.03 0.00 0.00 46.19 44.43 2j41 s LEU 102 CO -0.01 0.32 -0.01 -0.70 0.23 0.00 0.00 176.35 176.17 2j41 s GLU 103 N -0.55 1.51 0.07 1.70 -6.30 -1.26 -0.57 118.70 113.29 2j41 s GLU 103 Ca 0.08 -1.22 -0.07 0.00 -2.50 0.00 0.00 54.97 51.26 2j41 s GLU 103 Cb -0.12 -2.66 -0.01 0.00 0.00 0.00 0.00 34.13 31.35 2j41 s GLU 103 CO 0.02 -0.73 0.14 0.96 0.02 0.00 0.00 175.26 175.68 2j41 s ILE 104 N 1.30 0.15 0.96 -3.70 -4.36 -0.95 -5.03 121.20 109.57 2j41 s ILE 104 Ca -0.00 -1.21 -0.16 0.00 -0.26 0.00 0.00 60.65 59.02 2j41 s ILE 104 Cb -0.19 -1.22 0.20 0.00 1.25 0.00 0.00 42.46 42.50 2j41 s ILE 104 CO -0.09 -0.67 1.32 -1.83 0.24 0.00 0.00 174.94 173.91 2j41 s GLU 105 N -3.43 0.68 0.29 0.37 4.04 -1.26 -4.23 118.70 115.16 2j41 s GLU 105 Ca 0.02 -0.38 0.10 0.00 0.04 0.00 0.00 54.97 54.74 2j41 s GLU 105 Cb 0.03 -1.85 0.41 0.00 0.02 0.00 0.00 34.13 32.74 2j41 s GLU 105 CO -0.09 -2.39 1.64 -0.39 -1.84 0.00 0.00 175.26 172.20 2j41 h VAL 106 N -1.63 1.40 -0.29 1.83 -1.51 -1.98 -2.72 116.25 111.36 2j41 h VAL 106 Ca -0.44 -1.94 -0.09 0.00 -1.23 0.00 0.00 66.70 63.00 2j41 h VAL 106 Cb 1.24 2.03 -0.01 0.00 -2.13 0.00 0.00 31.29 32.42 2j41 h VAL 106 CO 0.39 0.56 -0.17 -0.33 -1.23 0.00 0.00 177.57 176.79 2j41 h GLU 107 N 0.03 0.63 -0.84 5.19 4.39 -1.97 -2.68 114.58 119.33 2j41 h GLU 107 Ca -0.00 -0.29 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2j41 h GLU 107 Cb 1.01 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.61 2j41 h GLU 107 CO 0.08 0.88 0.53 0.78 -1.16 0.00 0.00 179.01 180.11 2j41 h GLY 108 N 0.37 1.20 1.16 -3.84 0.00 -1.80 -2.52 103.07 97.64 2j41 h GLY 108 Ca 0.06 -0.48 0.05 0.00 0.00 0.00 0.00 47.33 46.96 2j41 h GLY 108 CO 0.05 0.47 0.45 0.00 0.00 0.00 0.00 176.54 177.50 2j41 h ALA 109 N 1.29 1.67 -0.92 3.60 0.00 -1.36 -1.46 119.26 122.07 2j41 h ALA 109 Ca 0.30 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2j41 h ALA 109 Cb -0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 2j41 h ALA 109 CO -0.06 0.24 0.55 0.87 0.00 0.00 0.00 179.25 180.86 2j41 h LYS 110 N 0.77 1.24 -0.47 0.00 1.57 -1.11 -0.21 116.57 118.35 2j41 h LYS 110 Ca 0.28 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.83 2j41 h LYS 110 Cb 0.15 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2j41 h LYS 110 CO -0.08 0.87 -0.17 1.96 -0.57 0.00 0.00 179.45 181.46 2j41 h GLN 111 N 1.26 0.95 -0.38 3.15 4.20 -1.24 -2.70 115.11 120.36 2j41 h GLN 111 Ca 0.33 -0.39 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2j41 h GLN 111 Cb -0.06 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2j41 h GLN 111 CO -0.06 1.05 0.23 0.28 -0.67 0.00 0.00 178.83 179.66 2j41 h VAL 112 N 0.80 1.12 -0.93 -0.54 2.07 -0.83 -2.56 116.25 115.38 2j41 h VAL 112 Ca 0.11 -0.26 0.13 0.00 0.82 0.00 0.00 66.70 67.50 2j41 h VAL 112 Cb 0.73 0.62 -0.09 0.00 -1.52 0.00 0.00 31.29 31.03 2j41 h VAL 112 CO 0.06 0.12 0.55 -0.09 0.02 0.00 0.00 177.57 178.22 2j41 h ARG 113 N 0.50 0.80 -0.69 1.57 9.65 -0.96 0.30 114.38 125.55 2j41 h ARG 113 Ca 0.14 -0.05 -0.06 0.00 -1.10 0.00 0.00 59.98 58.91 2j41 h ARG 113 Cb -0.01 -0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 28.36 2j41 h ARG 113 CO -0.03 0.53 0.19 0.87 2.80 0.00 0.00 179.97 184.33 2j41 h LYS 114 N 0.83 1.08 0.03 0.20 1.57 -1.13 -2.59 116.57 116.56 2j41 h LYS 114 Ca 0.48 -0.24 -0.29 0.00 -1.87 0.00 0.00 60.65 58.74 2j41 h LYS 114 Cb 0.58 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 2j41 h LYS 114 CO -0.31 0.94 -1.59 0.87 -0.57 0.00 0.00 179.45 178.79 2j41 h LYS 115 N 1.04 0.06 -2.24 3.15 1.57 -1.11 -3.40 116.57 115.64 2j41 h LYS 115 Ca 0.22 -0.11 -0.59 0.00 -1.87 0.00 0.00 60.65 58.31 2j41 h LYS 115 Cb 0.33 0.04 -0.41 0.00 0.08 0.00 0.00 32.23 32.27 2j41 h LYS 115 CO -0.00 0.74 -0.78 1.19 -0.57 0.00 0.00 179.45 180.03 2j41 n PHE 116 N -3.20 2.04 0.30 -1.35 3.72 0.10 -4.96 117.46 114.11 2j41 n PHE 116 Ca -0.15 -3.93 0.16 0.00 -0.05 0.00 0.00 57.45 53.48 2j41 n PHE 116 Cb 1.03 -0.45 0.95 0.00 -0.94 0.00 0.00 39.48 40.07 2j41 n PHE 116 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2j41 h PRO 117 N 4.35 0.00 -0.15 -1.08 0.13 -1.67 -1.46 132.00 132.12 2j41 h PRO 117 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2j41 h PRO 117 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2j41 h PRO 117 CO 0.68 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.05 2j41 n ASP 118 N -3.74 1.75 -4.62 1.44 3.85 -1.26 -4.93 116.55 109.03 2j41 n ASP 118 Ca -0.03 -1.69 -0.30 0.00 -0.71 0.00 0.00 54.79 52.07 2j41 n ASP 118 Cb 0.10 -0.09 0.19 0.00 -1.35 0.00 0.00 41.12 39.97 2j41 n ASP 118 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2j41 s ALA 119 N -1.82 0.83 -0.41 2.12 0.00 -0.55 -4.94 121.76 116.99 2j41 s ALA 119 Ca 0.34 0.15 -0.17 0.00 0.00 0.00 0.00 51.96 52.28 2j41 s ALA 119 Cb 0.18 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 20.02 2j41 s ALA 119 CO 0.28 -3.00 0.40 -1.17 0.00 0.00 0.00 175.76 172.27 2j41 s LEU 120 N -6.69 4.87 -0.32 0.00 2.96 -0.00 -5.00 118.68 114.49 2j41 s LEU 120 Ca 0.66 -0.67 -0.09 0.00 -0.22 0.00 0.00 54.13 53.81 2j41 s LEU 120 Cb -0.22 -2.33 0.00 0.00 0.50 0.00 0.00 46.19 44.14 2j41 s LEU 120 CO 0.60 -0.52 0.15 -0.36 -1.32 0.00 0.00 176.35 174.90 2j41 s PHE 121 N 2.02 3.19 -0.19 5.38 0.08 -1.26 0.20 117.98 127.40 2j41 s PHE 121 Ca 0.10 -0.70 -0.03 0.00 0.12 0.00 0.00 56.93 56.43 2j41 s PHE 121 Cb -0.17 -2.36 -0.01 0.00 -0.57 0.00 0.00 43.02 39.91 2j41 s PHE 121 CO 0.13 -0.51 -0.07 0.42 -0.10 0.00 0.00 175.22 175.09 2j41 s ILE 122 N 1.59 3.24 -0.30 0.64 1.01 0.33 -0.28 121.20 127.43 2j41 s ILE 122 Ca 0.04 -0.55 -0.12 0.00 0.00 0.00 0.00 60.65 60.01 2j41 s ILE 122 Cb -0.17 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2j41 s ILE 122 CO 0.06 0.46 0.23 0.12 0.00 0.00 0.00 174.94 175.81 2j41 s PHE 123 N 1.14 3.22 -0.37 3.97 5.36 0.10 -1.45 117.98 129.95 2j41 s PHE 123 Ca 0.01 0.05 -0.22 0.00 -0.96 0.00 0.00 56.93 55.82 2j41 s PHE 123 Cb -0.14 -2.44 0.01 0.00 -0.34 0.00 0.00 43.02 40.10 2j41 s PHE 123 CO -0.02 -0.23 0.71 -1.17 -1.46 0.00 0.00 175.22 173.05 2j41 s LEU 124 N 1.79 4.21 0.08 6.12 2.96 0.64 -0.91 118.68 133.57 2j41 s LEU 124 Ca 0.08 0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 2j41 s LEU 124 Cb -0.16 -2.90 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 2j41 s LEU 124 CO 0.11 -0.69 0.20 0.00 -1.32 0.00 0.00 176.35 174.65 2j41 s ALA 125 N 2.93 3.93 0.55 5.97 0.00 0.64 -4.11 121.76 131.66 2j41 s ALA 125 Ca 0.28 -0.90 -0.18 0.00 0.00 0.00 0.00 51.96 51.16 2j41 s ALA 125 Cb -0.14 -1.76 -0.06 0.00 0.00 0.00 0.00 23.12 21.17 2j41 s ALA 125 CO 0.16 0.78 1.06 -1.25 0.00 0.00 0.00 175.76 176.51 2j41 s PRO 126 N -2.60 3.50 0.21 0.00 0.04 -1.26 -0.58 135.00 134.31 2j41 s PRO 126 Ca 0.34 1.32 0.12 0.00 0.04 0.00 0.00 61.00 62.82 2j41 s PRO 126 Cb -0.13 -2.05 0.65 0.00 0.04 0.00 0.00 34.50 33.01 2j41 s PRO 126 CO 0.27 -0.68 1.31 -2.30 0.04 0.00 0.00 177.00 175.64 2j41 n PRO 127 N -1.53 0.08 0.00 0.56 -0.02 -1.26 -4.78 135.00 128.05 2j41 n PRO 127 Ca 0.09 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2j41 n PRO 127 Cb 0.52 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2j41 n PRO 127 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2j41 n SER 128 N -1.91 0.00 0.00 2.55 7.64 -1.26 -5.09 113.62 115.55 2j41 n SER 128 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 2j41 n SER 128 Cb 0.13 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 2j41 n SER 128 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2j41 n GLU 157 N 0.00 0.00 -0.07 1.43 1.02 -1.26 -5.18 120.64 116.58 2j41 n GLU 157 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 2j41 n GLU 157 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 2j41 n GLU 157 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2j41 h VAL 158 N 0.00 1.30 -0.83 2.62 2.07 -2.07 -2.84 116.25 116.50 2j41 h VAL 158 Ca 0.00 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.50 2j41 h VAL 158 Cb 0.00 1.62 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 2j41 h VAL 158 CO 0.00 0.33 0.54 -0.08 0.02 0.00 0.00 177.57 178.38 2j41 h GLU 159 N 0.10 0.84 -0.24 1.57 4.57 -2.09 -2.84 114.58 116.48 2j41 h GLU 159 Ca 0.05 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.13 2j41 h GLU 159 Cb 0.55 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2j41 h GLU 159 CO 0.02 0.55 -0.04 1.98 -1.18 0.00 0.00 179.01 180.35 2j41 h MET 160 N 0.86 0.36 0.00 1.92 4.05 -2.03 -2.97 114.93 117.12 2j41 h MET 160 Ca 0.37 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.72 2j41 h MET 160 Cb 0.31 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 2j41 h MET 160 CO -0.14 0.42 0.00 -1.33 0.23 0.00 0.00 176.91 176.09 2j41 n MET 161 N -4.31 0.46 0.02 0.39 2.81 -1.07 -4.39 117.12 111.03 2j41 n MET 161 Ca 0.00 0.04 -0.10 0.00 -1.81 0.00 0.00 57.70 55.83 2j41 n MET 161 Cb 0.23 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.20 2j41 n MET 161 CO 0.00 0.00 0.00 -0.97 1.51 0.00 0.00 175.97 176.51 2j41 h ASN 162 N 0.00 -0.31 0.75 7.83 -0.73 -1.64 -2.18 115.58 119.30 2j41 h ASN 162 Ca 0.00 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.23 2j41 h ASN 162 Cb 0.18 0.14 0.00 0.00 0.27 0.00 0.00 38.32 38.92 2j41 h ASN 162 CO 0.00 -0.14 0.00 0.00 -0.37 0.00 0.00 177.43 176.92 2j41 n LEU 163 N -5.24 0.49 -4.87 0.34 -0.00 -1.26 -4.89 117.00 101.57 2j41 n LEU 163 Ca -0.04 0.61 -0.30 0.00 -0.00 0.00 0.00 56.01 56.27 2j41 n LEU 163 Cb 0.16 -0.53 -0.02 0.00 -0.00 0.00 0.00 43.42 43.03 2j41 n LEU 163 CO 0.26 -0.43 0.56 -0.31 -0.00 0.00 0.00 177.39 177.47 2j41 s TYR 164 N -3.20 3.52 -0.15 1.47 2.02 -0.82 -4.95 117.35 115.24 2j41 s TYR 164 Ca 0.06 1.15 -0.07 0.00 -0.37 0.00 0.00 57.07 57.84 2j41 s TYR 164 Cb 0.10 -2.56 -0.24 0.00 -0.40 0.00 0.00 41.96 38.86 2j41 s TYR 164 CO 0.38 -0.33 0.28 -0.25 -1.57 0.00 0.00 175.55 174.07 2j41 n ASP 165 N -1.86 2.09 -4.17 2.29 8.00 0.62 -4.98 116.55 118.52 2j41 n ASP 165 Ca 0.04 0.19 -0.15 0.00 0.71 0.00 0.00 54.79 55.59 2j41 n ASP 165 Cb 0.54 -0.83 -0.11 0.00 -0.02 0.00 0.00 41.12 40.71 2j41 n ASP 165 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2j41 s TYR 166 N -2.54 1.07 -0.12 1.24 2.02 -0.66 -5.04 117.35 113.33 2j41 s TYR 166 Ca -0.25 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 55.82 2j41 s TYR 166 Cb 0.07 -0.58 0.02 0.00 -0.40 0.00 0.00 41.96 41.06 2j41 s TYR 166 CO 0.73 0.00 -0.13 0.08 -1.57 0.00 0.00 175.55 174.66 2j41 s VAL 167 N -2.37 1.41 -0.15 0.71 1.01 -1.26 -0.72 120.40 119.03 2j41 s VAL 167 Ca 0.05 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.48 2j41 s VAL 167 Cb -0.03 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 35.03 2j41 s VAL 167 CO 0.00 0.43 -0.20 -0.69 0.00 0.00 0.00 175.10 174.64 2j41 s VAL 168 N 1.23 2.21 -0.05 2.92 1.01 -0.09 -4.97 120.40 122.66 2j41 s VAL 168 Ca -0.02 -0.92 -0.29 0.00 0.00 0.00 0.00 61.98 60.75 2j41 s VAL 168 Cb -0.14 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 2j41 s VAL 168 CO -0.05 0.54 0.96 -0.69 0.00 0.00 0.00 175.10 175.86 2j41 s VAL 169 N 0.93 4.86 -1.42 2.92 1.01 -1.26 -0.26 120.40 127.17 2j41 s VAL 169 Ca -0.04 1.98 -0.14 0.00 0.00 0.00 0.00 61.98 63.78 2j41 s VAL 169 Cb -0.15 -4.28 0.06 0.00 0.00 0.00 0.00 36.38 32.00 2j41 s VAL 169 CO -0.04 0.11 2.13 -3.20 0.00 0.00 0.00 175.10 174.10 2j41 n ASN 170 N 4.34 4.14 -0.01 3.32 5.15 0.25 -4.56 115.26 127.90 2j41 n ASN 170 Ca 0.06 -2.88 -0.17 0.00 -0.60 0.00 0.00 54.58 51.00 2j41 n ASN 170 Cb 0.50 -1.65 -0.12 0.00 -0.53 0.00 0.00 39.78 37.98 2j41 n ASN 170 CO 0.00 0.00 0.00 -2.24 1.40 0.00 0.00 177.26 176.42 2j41 h ASP 171 N 6.18 0.37 -4.88 1.20 3.04 -1.93 -3.38 116.42 117.02 2j41 h ASP 171 Ca 0.54 -0.80 -0.15 0.00 -3.24 0.00 0.00 57.03 53.37 2j41 h ASP 171 Cb 0.67 -0.11 -0.21 0.00 -1.04 0.00 0.00 39.33 38.63 2j41 h ASP 171 CO 1.80 1.13 -0.50 -1.61 -2.04 0.00 0.00 179.24 178.02 2j41 s GLU 172 N -3.03 0.45 0.13 4.15 2.02 -1.26 -5.02 118.70 116.14 2j41 s GLU 172 Ca -0.15 -0.36 -0.19 0.00 0.02 0.00 0.00 54.97 54.29 2j41 s GLU 172 Cb 0.02 0.19 -0.03 0.00 0.10 0.00 0.00 34.13 34.40 2j41 s GLU 172 CO 0.78 -0.10 1.74 0.28 0.02 0.00 0.00 175.26 177.98 2j41 h VAL 173 N 4.34 0.91 -0.87 2.63 2.07 -1.96 -0.78 116.25 122.59 2j41 h VAL 173 Ca -0.30 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.19 2j41 h VAL 173 Cb 1.19 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 2j41 h VAL 173 CO 0.41 0.02 0.58 -0.08 0.02 0.00 0.00 177.57 178.52 2j41 h GLU 174 N 0.13 1.13 -0.50 1.57 4.57 -1.98 -0.75 114.58 118.74 2j41 h GLU 174 Ca 0.09 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.17 2j41 h GLU 174 Cb 0.09 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 2j41 h GLU 174 CO -0.12 0.75 0.19 -0.07 -1.18 0.00 0.00 179.01 178.58 2j41 h LEU 175 N 1.16 0.71 -0.53 1.64 3.38 -1.84 -1.75 115.31 118.08 2j41 h LEU 175 Ca 0.33 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 2j41 h LEU 175 Cb -0.10 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2j41 h LEU 175 CO -0.08 0.70 0.18 0.00 0.09 0.00 0.00 178.44 179.32 2j41 h ALA 176 N 1.04 0.69 -0.47 1.53 0.00 -0.73 -2.11 119.26 119.21 2j41 h ALA 176 Ca 0.17 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2j41 h ALA 176 Cb 0.22 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2j41 h ALA 176 CO -0.01 0.34 0.24 -0.22 0.00 0.00 0.00 179.25 179.60 2j41 h LYS 177 N 0.72 0.47 -0.54 0.00 3.64 -0.98 -1.96 116.57 117.92 2j41 h LYS 177 Ca 0.17 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2j41 h LYS 177 Cb 0.26 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2j41 h LYS 177 CO -0.01 0.31 -0.04 -0.91 -2.27 0.00 0.00 179.45 176.53 2j41 h ASN 178 N 0.48 0.93 -0.21 4.20 2.35 -1.10 -0.86 115.58 121.37 2j41 h ASN 178 Ca 0.20 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 2j41 h ASN 178 Cb 0.09 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 2j41 h ASN 178 CO -0.13 1.01 0.10 0.03 -1.65 0.00 0.00 177.43 176.79 2j41 h ARG 179 N 0.87 0.31 -0.47 0.81 3.08 -1.23 -0.68 114.38 117.07 2j41 h ARG 179 Ca 0.15 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.19 2j41 h ARG 179 Cb 0.56 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.52 2j41 h ARG 179 CO 0.03 0.34 0.24 0.82 -1.07 0.00 0.00 179.97 180.33 2j41 h ILE 180 N 0.21 0.96 -0.57 2.04 2.04 -1.20 -0.73 117.51 120.26 2j41 h ILE 180 Ca 0.07 -0.16 0.03 0.00 1.00 0.00 0.00 64.86 65.80 2j41 h ILE 180 Cb 0.14 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 2j41 h ILE 180 CO -0.01 0.09 0.33 1.56 0.00 0.00 0.00 178.15 180.12 2j41 h GLN 181 N 0.47 0.63 -0.00 2.37 4.20 -0.89 -1.04 115.11 120.84 2j41 h GLN 181 Ca 0.21 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.75 2j41 h GLN 181 Cb 0.11 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 2j41 h GLN 181 CO -0.14 0.41 -0.62 0.00 -0.67 0.00 0.00 178.83 177.81 2j41 h ILE 183 N 0.01 1.16 -0.42 0.00 2.04 -0.67 -0.65 117.51 118.97 2j41 h ILE 183 Ca -0.01 -0.33 -0.11 0.00 1.00 0.00 0.00 64.86 65.41 2j41 h ILE 183 Cb 1.09 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 2j41 h ILE 183 CO 0.08 0.16 -0.17 0.58 0.00 0.00 0.00 178.15 178.80 2j41 h VAL 184 N 0.73 1.28 -0.39 1.67 2.07 -1.04 -2.01 116.25 118.55 2j41 h VAL 184 Ca 0.20 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.46 2j41 h VAL 184 Cb -0.04 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 2j41 h VAL 184 CO -0.04 0.44 0.15 -0.08 0.02 0.00 0.00 177.57 178.07 2j41 h GLU 185 N 0.68 0.32 -0.97 1.57 4.57 -1.12 -1.71 114.58 117.92 2j41 h GLU 185 Ca 0.10 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.28 2j41 h GLU 185 Cb 0.72 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 29.19 2j41 h GLU 185 CO 0.05 0.21 0.64 0.00 -1.18 0.00 0.00 179.01 178.74 2j41 h ALA 186 N 1.24 1.33 -0.64 2.92 0.00 -1.03 -1.98 119.26 121.10 2j41 h ALA 186 Ca 0.18 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2j41 h ALA 186 Cb 0.14 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2j41 h ALA 186 CO -0.16 0.60 0.17 0.93 0.00 0.00 0.00 179.25 180.78 2j41 h GLU 187 N 1.28 1.00 0.00 0.00 4.39 -0.96 -1.74 114.58 118.56 2j41 h GLU 187 Ca 0.37 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2j41 h GLU 187 Cb -0.09 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.42 2j41 h GLU 187 CO -0.09 0.88 0.00 0.45 -1.16 0.00 0.00 179.01 179.09 2j41 h HIS 188 N 0.96 0.00 -0.01 4.33 3.86 -0.70 -2.70 115.15 120.89 2j41 h HIS 188 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 2j41 h HIS 188 Cb 0.32 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.79 2j41 h HIS 188 CO 0.02 0.00 -0.19 1.28 0.86 0.00 0.00 177.93 179.90 2j41 n LEU 189 N -3.02 1.54 -4.68 2.43 4.77 -0.69 -4.69 117.00 112.67 2j41 n LEU 189 Ca -0.00 -0.49 -0.45 0.00 -0.03 0.00 0.00 56.01 55.04 2j41 n LEU 189 Cb 0.22 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2j41 n LEU 189 CO 0.24 0.27 1.13 0.29 -1.33 0.00 0.00 177.39 178.00 2j41 n LYS 190 N -0.09 2.22 -0.35 3.23 4.76 -1.01 -4.80 118.16 122.12 2j41 n LYS 190 Ca 0.14 0.79 0.03 0.00 -2.87 0.00 0.00 58.31 56.40 2j41 n LYS 190 Cb 0.40 -2.52 0.18 0.00 -1.84 0.00 0.00 35.03 31.24 2j41 n LYS 190 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 2j41 h ARG 191 N 5.06 1.02 -0.75 1.97 1.12 -1.92 -1.44 114.38 119.44 2j41 h ARG 191 Ca -0.45 -0.06 0.07 0.00 -1.11 0.00 0.00 59.98 58.43 2j41 h ARG 191 Cb 1.26 -0.23 -0.06 0.00 -0.01 0.00 0.00 29.97 30.92 2j41 h ARG 191 CO 0.82 0.68 0.43 0.93 -3.11 0.00 0.00 179.97 179.71 2j41 h GLU 192 N 1.05 0.74 -0.11 0.20 3.07 -1.98 0.62 114.58 118.17 2j41 h GLU 192 Ca 0.43 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 59.20 2j41 h GLU 192 Cb 0.25 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 27.99 2j41 h GLU 192 CO -0.20 0.49 -0.09 -0.09 -1.40 0.00 0.00 179.01 177.72 2j41 h ARG 193 N 0.76 0.25 -0.15 2.33 2.43 -1.78 -2.30 114.38 115.91 2j41 h ARG 193 Ca 0.34 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 2j41 h ARG 193 Cb 0.24 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2j41 h ARG 193 CO -0.20 0.65 0.01 0.28 -1.51 0.00 0.00 179.97 179.19 2j41 h VAL 194 N -0.14 1.24 -0.41 0.20 2.07 -0.70 -2.51 116.25 116.00 2j41 h VAL 194 Ca 0.02 -0.80 0.07 0.00 0.82 0.00 0.00 66.70 66.81 2j41 h VAL 194 Cb 0.59 1.48 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 2j41 h VAL 194 CO 0.02 0.24 0.05 -0.08 0.02 0.00 0.00 177.57 177.82 2j41 h GLU 195 N 0.02 0.16 -0.97 1.57 4.81 0.13 -1.39 114.58 118.92 2j41 h GLU 195 Ca 0.04 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 2j41 h GLU 195 Cb 0.35 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 2j41 h GLU 195 CO 0.01 0.11 0.63 0.00 -0.73 0.00 0.00 179.01 179.02 2j41 h ALA 196 N 1.33 1.43 0.22 2.92 0.00 -1.35 0.52 119.26 124.33 2j41 h ALA 196 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2j41 h ALA 196 Cb 0.26 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2j41 h ALA 196 CO -0.29 0.44 -0.11 0.87 0.00 0.00 0.00 179.25 180.15 2j41 h LYS 197 N 1.14 -0.30 -0.76 0.00 1.57 -0.91 -1.91 116.57 115.41 2j41 h LYS 197 Ca 0.41 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 59.16 2j41 h LYS 197 Cb 0.14 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2j41 h LYS 197 CO -0.15 -0.20 0.29 1.88 -0.57 0.00 0.00 179.45 180.70 2j41 h TYR 198 N -0.31 1.16 -0.18 -1.35 -1.99 -0.74 -1.97 116.97 111.59 2j41 h TYR 198 Ca -0.03 -0.09 -0.03 0.00 2.00 0.00 0.00 58.73 60.58 2j41 h TYR 198 Cb 0.24 -0.35 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 2j41 h TYR 198 CO -0.07 0.89 0.01 -0.09 -0.00 0.00 0.00 178.16 178.90 2j41 h ARG 199 N 1.11 0.31 -0.98 4.88 1.12 -0.85 -0.82 114.38 119.14 2j41 h ARG 199 Ca 0.25 -0.09 0.10 0.00 -1.11 0.00 0.00 59.98 59.13 2j41 h ARG 199 Cb 0.23 -0.03 -0.07 0.00 -0.01 0.00 0.00 29.97 30.09 2j41 h ARG 199 CO -0.02 0.51 0.63 0.87 -3.11 0.00 0.00 179.97 178.85 2j41 h LYS 200 N 0.07 0.99 -0.37 0.20 6.56 -1.18 -0.38 116.57 122.47 2j41 h LYS 200 Ca 0.05 -0.06 -0.12 0.00 -1.06 0.00 0.00 60.65 59.46 2j41 h LYS 200 Cb 0.37 -0.22 -0.01 0.00 -0.57 0.00 0.00 32.23 31.79 2j41 h LYS 200 CO 0.01 0.66 -0.26 0.52 -2.06 0.00 0.00 179.45 178.32 2j41 h MET 201 N 1.02 0.82 -0.42 3.15 2.86 -1.09 -1.09 114.93 120.18 2j41 h MET 201 Ca 0.46 -0.39 -0.13 0.00 -2.06 0.00 0.00 59.70 57.58 2j41 h MET 201 Cb 0.38 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 2j41 h MET 201 CO -0.22 1.03 -0.23 0.97 1.06 0.00 0.00 176.91 179.52 2j41 h ILE 202 N 0.62 1.28 -0.49 -1.22 -0.00 -0.74 -2.74 117.51 114.22 2j41 h ILE 202 Ca 0.07 -1.38 -0.12 0.00 -0.00 0.00 0.00 64.86 63.43 2j41 h ILE 202 Cb 0.83 1.25 -0.01 0.00 -0.00 0.00 0.00 36.82 38.88 2j41 h ILE 202 CO 0.07 0.47 -0.17 -0.07 -0.00 0.00 0.00 178.15 178.44 2j41 h LEU 203 N 0.73 1.00 -0.30 2.19 4.07 -1.07 -3.17 115.31 118.76 2j41 h LEU 203 Ca 0.09 -0.38 0.04 0.00 0.08 0.00 0.00 57.88 57.71 2j41 h LEU 203 Cb 0.80 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 42.23 2j41 h LEU 203 CO 0.07 1.15 0.09 -0.08 -1.08 0.00 0.00 178.44 178.59 2j41 h GLU 204 N 0.83 0.20 0.00 1.13 4.81 -1.18 -3.51 114.58 116.86 2j41 h GLU 204 Ca 0.12 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2j41 h GLU 204 Cb 0.75 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.08 2j41 h GLU 204 CO 0.06 0.14 0.00 0.00 -0.73 0.00 0.00 179.01 178.47