#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 1.65 0.47 0.72 0.00 -0.42 -4.89 107.32 104.85 2j41 s GLY 6 Ca 0.00 0.09 -0.20 0.00 0.00 0.00 0.00 44.72 44.61 2j41 s GLY 6 CO 0.00 0.50 0.99 1.08 0.00 0.00 0.00 173.10 175.67 2j41 s LEU 7 N -6.00 3.85 -0.33 0.66 1.43 -1.26 -4.81 118.68 112.23 2j41 s LEU 7 Ca 0.62 1.78 -0.12 0.00 -1.03 0.00 0.00 54.13 55.37 2j41 s LEU 7 Cb -0.17 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.48 2j41 s LEU 7 CO 0.56 -0.59 0.22 -0.22 0.23 0.00 0.00 176.35 176.55 2j41 s LEU 8 N -3.46 4.40 -0.23 1.79 2.96 -1.26 -0.53 118.68 122.35 2j41 s LEU 8 Ca 0.64 -0.36 -0.06 0.00 -0.22 0.00 0.00 54.13 54.13 2j41 s LEU 8 Cb -0.12 -2.12 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 2j41 s LEU 8 CO 0.19 -0.20 0.02 -0.63 -1.32 0.00 0.00 176.35 174.41 2j41 s ILE 9 N 1.72 3.99 -0.25 6.68 1.01 0.20 -0.84 121.20 133.72 2j41 s ILE 9 Ca 0.06 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.43 2j41 s ILE 9 Cb -0.17 -2.84 0.04 0.00 0.01 0.00 0.00 42.46 39.50 2j41 s ILE 9 CO 0.10 0.39 -0.09 -0.69 0.00 0.00 0.00 174.94 174.64 2j41 s VAL 10 N 1.38 2.48 -0.27 2.92 1.01 0.13 -0.19 120.40 127.86 2j41 s VAL 10 Ca 0.05 -1.30 -0.10 0.00 0.00 0.00 0.00 61.98 60.63 2j41 s VAL 10 Cb -0.15 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 2j41 s VAL 10 CO 0.01 0.13 0.16 -0.22 0.00 0.00 0.00 175.10 175.18 2j41 s LEU 11 N 1.22 3.87 0.00 3.92 2.96 0.60 -0.54 118.68 130.72 2j41 s LEU 11 Ca -0.03 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 2j41 s LEU 11 Cb -0.18 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.45 2j41 s LEU 11 CO -0.06 -0.06 0.00 -0.24 -1.32 0.00 0.00 176.35 174.68 2j41 n SER 12 N 5.02 0.50 0.00 3.68 2.88 -0.67 -2.07 113.62 122.96 2j41 n SER 12 Ca -0.15 -0.89 0.00 0.00 -1.33 0.00 0.00 58.87 56.51 2j41 n SER 12 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 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 1.25 1.48 3.71 0.46 0.00 -1.26 -0.61 105.19 110.21 2j41 n GLY 13 Ca 0.00 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.15 2j41 n GLY 13 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j41 s PRO 14 N -1.74 1.59 0.27 1.61 0.04 -1.26 -4.40 135.00 131.10 2j41 s PRO 14 Ca 0.00 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.29 2j41 s PRO 14 Cb 0.00 -1.79 -0.13 0.00 0.04 0.00 0.00 34.50 32.61 2j41 s PRO 14 CO 0.00 -2.21 1.27 0.43 0.04 0.00 0.00 177.00 176.53 2j41 n SER 15 N -3.63 2.31 -0.08 6.66 7.64 -1.26 -2.41 113.62 122.84 2j41 n SER 15 Ca 0.12 1.17 -0.01 0.00 1.01 0.00 0.00 58.87 61.15 2j41 n SER 15 Cb 0.52 -1.39 -0.00 0.00 -1.01 0.00 0.00 64.21 62.32 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 1.60 0.39 0.20 0.23 0.00 -1.26 -4.88 105.19 101.47 2j41 n GLY 16 Ca 0.10 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.12 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 0.44 0.00 1.61 3.04 -1.83 -3.47 116.25 116.04 2j41 h VAL 17 Ca -0.02 -1.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 2j41 h VAL 17 Cb 0.42 2.01 0.00 0.00 -2.01 0.00 0.00 31.29 31.72 2j41 h VAL 17 CO 0.03 0.22 0.00 0.61 -1.01 0.00 0.00 177.57 177.43 2j41 n GLY 18 N 0.74 1.95 0.17 3.17 0.00 -1.26 -4.86 105.19 105.09 2j41 n GLY 18 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 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 0.16 -0.41 1.61 1.57 -1.91 -1.42 116.57 116.16 2j41 h LYS 19 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2j41 h LYS 19 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2j41 h LYS 19 CO 0.00 0.10 0.27 0.78 -0.57 0.00 0.00 179.45 180.04 2j41 h GLY 20 N 0.16 0.58 0.99 3.86 0.00 -1.96 0.10 103.07 106.81 2j41 h GLY 20 Ca 0.19 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2j41 h GLY 20 CO -0.28 0.22 0.33 -0.84 0.00 0.00 0.00 176.54 175.97 2j41 h THR 21 N 0.56 1.19 -0.13 4.70 2.02 -1.91 0.25 112.91 119.59 2j41 h THR 21 Ca 0.15 -0.46 -0.05 0.00 0.77 0.00 0.00 66.41 66.82 2j41 h THR 21 Cb -0.06 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 66.76 2j41 h THR 21 CO -0.03 0.20 -0.11 0.58 0.37 0.00 0.00 175.52 176.53 2j41 h VAL 22 N 0.80 1.34 -0.52 3.16 2.07 -1.05 -1.73 116.25 120.33 2j41 h VAL 22 Ca 0.21 -1.23 0.04 0.00 0.82 0.00 0.00 66.70 66.54 2j41 h VAL 22 Cb 0.03 1.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 2j41 h VAL 22 CO -0.04 0.36 0.27 -0.09 0.02 0.00 0.00 177.57 178.09 2j41 h ARG 23 N -0.07 0.51 -0.75 1.57 1.12 -0.88 -0.19 114.38 115.69 2j41 h ARG 23 Ca 0.02 -0.03 0.05 0.00 -1.11 0.00 0.00 59.98 58.92 2j41 h ARG 23 Cb 0.62 -0.12 -0.06 0.00 -0.01 0.00 0.00 29.97 30.41 2j41 h ARG 23 CO 0.03 0.34 0.45 0.87 -3.11 0.00 0.00 179.97 178.55 2j41 h LYS 24 N 0.53 0.82 -0.49 0.20 1.79 -0.88 -1.49 116.57 117.04 2j41 h LYS 24 Ca 0.22 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.60 2j41 h LYS 24 Cb 0.12 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.56 2j41 h LYS 24 CO -0.15 0.54 0.15 -0.09 -1.08 0.00 0.00 179.45 178.82 2j41 h ARG 25 N 0.84 0.77 -0.52 3.15 9.65 -0.74 -1.88 114.38 125.65 2j41 h ARG 25 Ca 0.33 -0.17 0.09 0.00 -1.10 0.00 0.00 59.98 59.13 2j41 h ARG 25 Cb 0.14 -0.11 -0.07 0.00 -1.39 0.00 0.00 29.97 28.54 2j41 h ARG 25 CO -0.16 0.73 0.11 0.82 2.80 0.00 0.00 179.97 184.26 2j41 h ILE 26 N 0.67 0.70 -0.00 1.20 2.04 -0.56 -2.39 117.51 119.17 2j41 h ILE 26 Ca 0.16 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.93 2j41 h ILE 26 Cb 0.28 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 2j41 h ILE 26 CO -0.00 0.04 -0.10 0.49 0.00 0.00 0.00 178.15 178.58 2j41 n PHE 27 N -5.11 0.00 0.65 1.37 3.72 -0.61 -2.76 117.46 114.72 2j41 n PHE 27 Ca 0.06 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.59 2j41 n PHE 27 Cb 0.26 -0.34 0.37 0.00 -0.94 0.00 0.00 39.48 38.82 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 -1.33 0.25 -2.80 -1.08 1.02 -0.72 -4.78 120.64 111.20 2j41 n GLU 28 Ca 0.10 0.17 -0.42 0.00 -0.02 0.00 0.00 57.16 56.99 2j41 n GLU 28 Cb 0.30 -1.76 -0.04 0.00 -0.02 0.00 0.00 31.44 29.93 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 -4.34 6.76 0.04 1.62 -1.08 -1.11 -4.93 116.67 113.63 2j41 s ASP 29 Ca 0.10 0.77 0.12 0.00 -0.52 0.00 0.00 52.55 53.03 2j41 s ASP 29 Cb 0.13 -2.47 0.53 0.00 -1.46 0.00 0.00 42.92 39.65 2j41 s ASP 29 CO 0.62 -0.77 1.39 -0.81 0.52 0.00 0.00 175.17 176.12 2j41 n PRO 30 N 6.58 0.03 0.08 4.34 -0.04 -1.26 -1.48 135.00 143.24 2j41 n PRO 30 Ca 0.07 0.34 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 2j41 n PRO 30 Cb 0.48 -1.56 0.26 0.00 -0.04 0.00 0.00 33.50 32.64 2j41 n PRO 30 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2j41 n SER 31 N -1.61 0.74 -4.68 3.54 7.64 -1.26 -4.83 113.62 113.16 2j41 n SER 31 Ca 0.02 0.28 -0.42 0.00 1.01 0.00 0.00 58.87 59.76 2j41 n SER 31 Cb 0.13 -0.18 -0.03 0.00 -1.01 0.00 0.00 64.21 63.12 2j41 n SER 31 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2j41 s THR 32 N -3.14 2.73 -1.25 0.44 2.01 -0.55 -4.88 115.64 110.99 2j41 s THR 32 Ca 0.08 0.07 0.20 0.00 0.31 0.00 0.00 61.69 62.35 2j41 s THR 32 Cb 0.13 -3.04 -0.15 0.00 0.01 0.00 0.00 72.50 69.44 2j41 s THR 32 CO 0.68 -0.00 0.91 -1.54 -0.69 0.00 0.00 174.62 173.97 2j41 n SER 33 N 6.32 1.26 -4.75 3.53 3.41 -1.26 -4.99 113.62 117.13 2j41 n SER 33 Ca 0.18 -1.13 -0.31 0.00 -0.26 0.00 0.00 58.87 57.35 2j41 n SER 33 Cb 0.39 0.84 0.10 0.00 -0.26 0.00 0.00 64.21 65.28 2j41 n SER 33 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2j41 s TYR 34 N -2.73 2.47 -0.14 7.33 2.02 -1.26 -4.67 117.35 120.36 2j41 s TYR 34 Ca 0.11 1.54 -0.03 0.00 -0.37 0.00 0.00 57.07 58.32 2j41 s TYR 34 Cb 0.16 -3.08 -0.03 0.00 -0.40 0.00 0.00 41.96 38.61 2j41 s TYR 34 CO 0.74 -1.95 -0.03 0.15 -1.57 0.00 0.00 175.55 172.88 2j41 s LYS 35 N -4.88 3.52 -0.12 -0.62 -0.14 0.43 -4.97 119.74 112.96 2j41 s LYS 35 Ca 0.62 -0.50 -0.24 0.00 -1.36 0.00 0.00 55.97 54.49 2j41 s LYS 35 Cb -0.18 -2.89 -0.03 0.00 -1.68 0.00 0.00 37.83 33.06 2j41 s LYS 35 CO 0.56 0.34 0.76 -0.47 -0.76 0.00 0.00 175.35 175.78 2j41 s TYR 36 N 0.09 3.50 -0.47 3.18 5.04 -1.26 -0.72 117.35 126.71 2j41 s TYR 36 Ca -0.00 1.23 -0.28 0.00 -2.44 0.00 0.00 57.07 55.58 2j41 s TYR 36 Cb -0.13 -2.90 0.01 0.00 0.35 0.00 0.00 41.96 39.28 2j41 s TYR 36 CO 0.03 -0.07 1.47 0.45 -1.34 0.00 0.00 175.55 176.08 2j41 s SER 37 N 1.00 6.17 -0.17 4.32 0.15 -0.69 -4.92 113.70 119.55 2j41 s SER 37 Ca 0.37 0.66 -0.29 0.00 0.70 0.00 0.00 55.95 57.39 2j41 s SER 37 Cb -0.17 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.59 2j41 s SER 37 CO 0.16 -1.60 1.25 -0.63 1.20 0.00 0.00 173.24 173.61 2j41 s ILE 38 N 5.96 4.31 0.59 6.45 1.01 -1.26 -4.81 121.20 133.45 2j41 s ILE 38 Ca 0.60 1.58 -0.11 0.00 0.00 0.00 0.00 60.65 62.73 2j41 s ILE 38 Cb -0.13 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 2j41 s ILE 38 CO 0.30 -0.15 0.98 -0.44 0.00 0.00 0.00 174.94 175.63 2j41 s SER 39 N 1.94 6.28 0.17 3.58 0.01 -1.26 -4.67 113.70 119.73 2j41 s SER 39 Ca 0.54 1.35 -0.09 0.00 1.31 0.00 0.00 55.95 59.06 2j41 s SER 39 Cb -0.21 -2.44 -0.06 0.00 0.21 0.00 0.00 66.02 63.52 2j41 s SER 39 CO 0.14 -0.79 0.48 -0.04 0.41 0.00 0.00 173.24 173.44 2j41 s MET 40 N -4.99 3.78 0.04 12.44 -1.94 -0.07 -0.93 119.30 127.62 2j41 s MET 40 Ca 0.54 0.20 -0.08 0.00 -1.71 0.00 0.00 55.69 54.65 2j41 s MET 40 Cb -0.11 -2.81 -0.00 0.00 2.01 0.00 0.00 34.83 33.92 2j41 s MET 40 CO 0.50 0.43 0.15 -0.08 -0.01 0.00 0.00 175.02 176.01 2j41 s THR 41 N -1.64 0.12 -2.51 2.05 -1.32 -0.70 -1.20 115.64 110.44 2j41 s THR 41 Ca 0.41 -0.98 0.24 0.00 -1.21 0.00 0.00 61.69 60.15 2j41 s THR 41 Cb -0.13 -0.89 0.12 0.00 -1.51 0.00 0.00 72.50 70.09 2j41 s THR 41 CO 0.21 -0.54 1.21 0.35 -2.21 0.00 0.00 174.62 173.64 2j41 n THR 42 N 0.74 0.00 -1.45 5.08 -2.24 -0.61 -0.72 114.28 115.08 2j41 n THR 42 Ca -0.19 -0.37 -0.32 0.00 -2.27 0.00 0.00 64.05 60.90 2j41 n THR 42 Cb 0.59 1.31 0.08 0.00 -2.10 0.00 0.00 70.33 70.21 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 -2.23 2.36 0.31 -0.78 1.70 -1.26 -4.85 118.95 114.19 2j41 s ARG 43 Ca 0.24 1.40 -0.29 0.00 -0.47 0.00 0.00 55.73 56.61 2j41 s ARG 43 Cb 0.19 -1.89 -0.10 0.00 -0.57 0.00 0.00 34.95 32.58 2j41 s ARG 43 CO 0.43 -1.60 1.30 -0.65 -1.08 0.00 0.00 175.30 173.70 2j41 s GLN 44 N -4.36 4.38 0.40 3.89 -1.52 -1.26 -4.84 119.66 116.35 2j41 s GLN 44 Ca 0.66 2.18 -0.26 0.00 -1.95 0.00 0.00 55.36 55.98 2j41 s GLN 44 Cb -0.21 -3.09 -0.09 0.00 -0.22 0.00 0.00 33.01 29.40 2j41 s GLN 44 CO 0.48 -0.17 1.35 1.41 -0.25 0.00 0.00 175.29 178.11 2j41 s MET 45 N -1.56 3.98 0.42 2.91 -2.45 -1.26 -5.03 119.30 116.32 2j41 s MET 45 Ca 0.50 2.26 0.07 0.00 -1.25 0.00 0.00 55.69 57.28 2j41 s MET 45 Cb -0.39 -2.80 -0.03 0.00 1.25 0.00 0.00 34.83 32.85 2j41 s MET 45 CO 0.50 -0.52 0.29 1.03 1.05 0.00 0.00 175.02 177.37 2j41 s ARG 46 N -2.20 2.38 -0.08 4.11 0.52 -1.26 -5.04 118.95 117.38 2j41 s ARG 46 Ca 0.56 -1.70 -0.38 0.00 -0.52 0.00 0.00 55.73 53.69 2j41 s ARG 46 Cb -0.40 -2.18 -0.16 0.00 0.52 0.00 0.00 34.95 32.73 2j41 s ARG 46 CO 0.53 -0.18 1.56 -1.91 0.02 0.00 0.00 175.30 175.32 2j41 n GLU 47 N -1.42 1.26 0.00 3.54 2.13 -1.26 -1.78 120.64 123.11 2j41 n GLU 47 Ca 0.01 0.46 0.00 0.00 0.66 0.00 0.00 57.16 58.29 2j41 n GLU 47 Cb 0.63 -2.14 0.00 0.00 0.27 0.00 0.00 31.44 30.20 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 3.41 1.91 3.86 8.31 0.00 -1.26 -5.03 105.19 116.38 2j41 n GLY 48 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.40 3.87 -0.06 1.61 2.02 -0.73 -5.08 118.70 119.93 2j41 s GLU 49 Ca 0.00 0.74 0.01 0.00 0.02 0.00 0.00 54.97 55.74 2j41 s GLU 49 Cb 0.00 -2.25 0.02 0.00 0.10 0.00 0.00 34.13 32.00 2j41 s GLU 49 CO 0.00 -0.17 -0.07 0.08 0.02 0.00 0.00 175.26 175.12 2j41 s VAL 50 N -2.51 0.78 0.11 2.63 1.01 -1.26 -4.84 120.40 116.32 2j41 s VAL 50 Ca 0.55 -0.24 -0.31 0.00 0.00 0.00 0.00 61.98 61.98 2j41 s VAL 50 Cb -0.10 -0.77 -0.10 0.00 0.00 0.00 0.00 36.38 35.41 2j41 s VAL 50 CO 0.31 0.29 1.77 -0.62 0.00 0.00 0.00 175.10 176.85 2j41 s ASP 51 N 0.98 6.47 0.00 3.32 -1.08 -1.26 -1.50 116.67 123.60 2j41 s ASP 51 Ca -0.10 2.69 0.00 0.00 -0.52 0.00 0.00 52.55 54.63 2j41 s ASP 51 Cb -0.14 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 2j41 s ASP 51 CO 0.00 -0.97 0.00 0.61 0.52 0.00 0.00 175.17 175.33 2j41 n GLY 52 N 4.15 0.80 0.84 2.66 0.00 0.67 -4.89 105.19 109.43 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 -2.00 0.18 -0.04 1.61 0.31 -0.56 -4.89 118.33 112.95 2j41 n VAL 53 Ca 0.00 0.12 -0.13 0.00 -0.01 0.00 0.00 64.34 64.32 2j41 n VAL 53 Cb 0.00 -1.17 -0.08 0.00 -0.91 0.00 0.00 33.84 31.67 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 -0.02 0.25 -5.15 4.52 3.32 -1.76 -3.47 116.42 114.10 2j41 h ASP 54 Ca 0.00 -0.52 -0.07 0.00 0.02 0.00 0.00 57.03 56.46 2j41 h ASP 54 Cb 0.02 -0.07 -0.13 0.00 0.22 0.00 0.00 39.33 39.37 2j41 h ASP 54 CO 0.00 0.72 -0.24 -0.31 -1.72 0.00 0.00 179.24 177.69 2j41 s TYR 55 N -4.15 0.09 -0.46 4.55 2.02 -1.26 -4.58 117.35 113.56 2j41 s TYR 55 Ca -0.15 -0.46 -0.23 0.00 -0.37 0.00 0.00 57.07 55.86 2j41 s TYR 55 Cb 0.04 0.07 0.03 0.00 -0.40 0.00 0.00 41.96 41.70 2j41 s TYR 55 CO 0.73 -0.67 0.79 -0.06 -1.57 0.00 0.00 175.55 174.77 2j41 s PHE 56 N -3.87 2.98 -0.05 2.71 0.08 -0.11 -0.24 117.98 119.48 2j41 s PHE 56 Ca 0.08 0.12 -0.26 0.00 0.12 0.00 0.00 56.93 56.99 2j41 s PHE 56 Cb 0.03 -3.69 -0.03 0.00 -0.57 0.00 0.00 43.02 38.76 2j41 s PHE 56 CO -0.08 -1.02 0.81 -0.06 -0.10 0.00 0.00 175.22 174.78 2j41 s PHE 57 N 3.32 3.60 0.09 0.36 0.08 -1.26 -1.72 117.98 122.45 2j41 s PHE 57 Ca 0.29 1.42 0.07 0.00 0.12 0.00 0.00 56.93 58.83 2j41 s PHE 57 Cb -0.12 -2.94 -0.03 0.00 -0.57 0.00 0.00 43.02 39.36 2j41 s PHE 57 CO 0.22 0.04 -0.18 0.15 -0.10 0.00 0.00 175.22 175.35 2j41 s LYS 58 N 0.94 0.99 0.75 0.44 -0.14 0.10 -4.95 119.74 117.87 2j41 s LYS 58 Ca 0.43 -1.06 -0.12 0.00 -1.36 0.00 0.00 55.97 53.86 2j41 s LYS 58 Cb -0.19 -1.13 0.05 0.00 -1.68 0.00 0.00 37.83 34.88 2j41 s LYS 58 CO 0.22 0.26 1.11 0.95 -0.76 0.00 0.00 175.35 177.13 2j41 s THR 59 N -1.20 3.11 0.24 2.17 -4.23 -1.26 -4.20 115.64 110.26 2j41 s THR 59 Ca 0.03 0.42 -0.06 0.00 -1.18 0.00 0.00 61.69 60.89 2j41 s THR 59 Cb -0.10 -2.88 0.22 0.00 1.34 0.00 0.00 72.50 71.09 2j41 s THR 59 CO 0.03 -0.41 1.89 0.03 -0.54 0.00 0.00 174.62 175.62 2j41 h ARG 60 N -0.78 1.10 -0.46 3.99 2.47 -1.96 -1.33 114.38 117.42 2j41 h ARG 60 Ca -0.45 -0.07 0.02 0.00 -1.26 0.00 0.00 59.98 58.22 2j41 h ARG 60 Cb 1.24 -0.25 -0.03 0.00 -1.65 0.00 0.00 29.97 29.29 2j41 h ARG 60 CO 0.51 0.73 0.28 -0.44 0.56 0.00 0.00 179.97 181.61 2j41 h ASP 61 N 1.14 0.47 -0.44 7.04 3.32 -1.99 -0.24 116.42 125.73 2j41 h ASP 61 Ca 0.36 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.37 2j41 h ASP 61 Cb 0.00 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2j41 h ASP 61 CO -0.12 0.33 0.13 0.00 -1.72 0.00 0.00 179.24 177.87 2j41 h ALA 62 N 1.20 0.57 -0.46 3.45 0.00 -1.85 0.56 119.26 122.73 2j41 h ALA 62 Ca 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2j41 h ALA 62 Cb -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2j41 h ALA 62 CO -0.07 0.22 0.26 0.35 0.00 0.00 0.00 179.25 180.01 2j41 h PHE 63 N 0.56 0.62 -0.20 0.00 3.57 -1.06 -1.78 116.94 118.67 2j41 h PHE 63 Ca 0.14 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 2j41 h PHE 63 Cb 0.27 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2j41 h PHE 63 CO 0.01 0.46 -0.28 0.93 -2.23 0.00 0.00 178.31 177.20 2j41 h GLU 64 N 0.61 0.37 -0.44 1.11 5.08 -0.79 -0.72 114.58 119.81 2j41 h GLU 64 Ca 0.16 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2j41 h GLU 64 Cb 0.03 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2j41 h GLU 64 CO -0.03 0.62 0.07 0.00 -1.00 0.00 0.00 179.01 178.68 2j41 h ALA 65 N 1.38 1.30 -0.09 3.43 0.00 -0.62 -1.71 119.26 122.95 2j41 h ALA 65 Ca 0.05 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 2j41 h ALA 65 Cb 0.66 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2j41 h ALA 65 CO 0.05 0.49 -0.73 -0.07 0.00 0.00 0.00 179.25 178.99 2j41 h LEU 66 N 0.66 0.55 -0.24 0.00 3.38 -0.51 -1.10 115.31 118.04 2j41 h LEU 66 Ca 0.14 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2j41 h LEU 66 Cb 0.30 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2j41 h LEU 66 CO 0.00 1.10 0.14 0.40 0.09 0.00 0.00 178.44 180.18 2j41 h ILE 67 N 0.32 1.04 -0.52 1.22 2.04 -0.96 -0.87 117.51 119.78 2j41 h ILE 67 Ca -0.03 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 2j41 h ILE 67 Cb 1.31 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2j41 h ILE 67 CO 0.13 0.05 0.21 0.11 0.00 0.00 0.00 178.15 178.66 2j41 h LYS 68 N 0.30 0.75 -0.04 2.37 1.57 -1.19 -1.66 116.57 118.67 2j41 h LYS 68 Ca 0.09 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2j41 h LYS 68 Cb -0.01 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.16 2j41 h LYS 68 CO -0.04 0.62 0.00 -0.25 -0.57 0.00 0.00 179.45 179.21 2j41 n ASP 69 N -4.35 0.25 -3.66 0.86 8.00 -0.43 -4.91 116.55 112.31 2j41 n ASP 69 Ca 0.04 -1.76 -0.24 0.00 0.71 0.00 0.00 54.79 53.55 2j41 n ASP 69 Cb 0.15 -0.02 0.06 0.00 -0.02 0.00 0.00 41.12 41.29 2j41 n ASP 69 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2j41 n ASP 70 N -0.48 -4.42 -1.46 -2.24 2.03 -0.63 -4.91 116.55 104.45 2j41 n ASP 70 Ca 0.07 -0.65 0.10 0.00 0.52 0.00 0.00 54.79 54.83 2j41 n ASP 70 Cb 0.07 -4.64 0.34 0.00 -0.72 0.00 0.00 41.12 36.17 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 -4.66 3.43 -5.20 -0.67 1.13 -0.39 -4.88 117.38 106.14 2j41 n GLN 71 Ca -0.09 -2.79 -0.32 0.00 -1.94 0.00 0.00 57.00 51.86 2j41 n GLN 71 Cb 0.59 -1.78 -0.17 0.00 0.11 0.00 0.00 30.24 28.99 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 -1.63 2.56 0.34 1.08 0.08 -1.26 -1.64 117.98 117.52 2j41 s PHE 72 Ca 0.49 -1.06 0.05 0.00 0.12 0.00 0.00 56.93 56.53 2j41 s PHE 72 Cb 0.30 -1.71 0.62 0.00 -0.57 0.00 0.00 43.02 41.66 2j41 s PHE 72 CO 0.26 -0.43 1.87 0.82 -0.10 0.00 0.00 175.22 177.65 2j41 h ILE 73 N 5.71 1.20 -2.28 0.64 2.04 -1.37 -3.45 117.51 119.99 2j41 h ILE 73 Ca -0.20 -0.80 -0.05 0.00 1.00 0.00 0.00 64.86 64.81 2j41 h ILE 73 Cb 1.24 0.99 -0.23 0.00 -0.74 0.00 0.00 36.82 38.08 2j41 h ILE 73 CO 0.47 0.27 -0.07 -0.70 0.00 0.00 0.00 178.15 178.12 2j41 s GLU 74 N -4.92 0.63 0.03 2.37 -6.30 -1.25 -4.56 118.70 104.70 2j41 s GLU 74 Ca -0.07 0.95 -0.13 0.00 -2.50 0.00 0.00 54.97 53.21 2j41 s GLU 74 Cb 0.15 0.19 0.02 0.00 0.00 0.00 0.00 34.13 34.49 2j41 s GLU 74 CO 0.76 -0.12 0.29 1.52 0.02 0.00 0.00 175.26 177.73 2j41 s TYR 75 N 0.99 -0.10 0.19 5.30 -0.85 -1.26 -0.97 117.35 120.66 2j41 s TYR 75 Ca -0.05 -0.00 -0.11 0.00 -0.52 0.00 0.00 57.07 56.39 2j41 s TYR 75 Cb -0.05 0.08 -0.00 0.00 0.38 0.00 0.00 41.96 42.36 2j41 s TYR 75 CO -0.09 -0.47 0.36 0.00 -1.52 0.00 0.00 175.55 173.83 2j41 s ALA 76 N -2.29 -0.13 -0.10 9.51 0.00 -0.05 -4.73 121.76 123.97 2j41 s ALA 76 Ca -0.07 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.03 2j41 s ALA 76 Cb -0.02 0.95 -0.03 0.00 0.00 0.00 0.00 23.12 24.02 2j41 s ALA 76 CO -0.02 -0.72 -0.01 -1.21 0.00 0.00 0.00 175.76 173.81 2j41 s GLU 77 N -3.98 3.14 -0.06 0.00 2.02 -1.26 -0.95 118.70 117.60 2j41 s GLU 77 Ca 0.19 -0.43 -0.02 0.00 0.02 0.00 0.00 54.97 54.72 2j41 s GLU 77 Cb 0.02 -2.82 0.04 0.00 0.10 0.00 0.00 34.13 31.46 2j41 s GLU 77 CO 0.03 0.60 0.08 -0.47 0.02 0.00 0.00 175.26 175.52 2j41 s TYR 78 N -0.61 0.02 -1.50 1.61 5.04 0.45 -4.84 117.35 117.52 2j41 s TYR 78 Ca 0.10 0.28 -0.04 0.00 -2.44 0.00 0.00 57.07 54.97 2j41 s TYR 78 Cb -0.12 -0.46 0.00 0.00 0.35 0.00 0.00 41.96 41.74 2j41 s TYR 78 CO 0.02 -0.23 0.11 0.28 -1.34 0.00 0.00 175.55 174.39 2j41 n VAL 79 N 5.30 -1.40 -0.32 3.14 0.31 -1.26 -2.30 118.33 121.81 2j41 n VAL 79 Ca -0.04 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 2j41 n VAL 79 Cb 0.50 -1.31 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 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 -2.48 0.73 3.19 2.92 0.00 -1.26 -5.04 105.19 103.25 2j41 n GLY 80 Ca -0.31 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.97 1.71 0.32 1.61 0.01 -0.97 -5.02 114.94 109.63 2j41 s ASN 81 Ca 0.00 -0.70 -0.20 0.00 -0.71 0.00 0.00 52.86 51.24 2j41 s ASN 81 Cb 0.00 -0.04 -0.10 0.00 0.41 0.00 0.00 41.25 41.52 2j41 s ASN 81 CO 0.00 -0.13 0.84 -0.31 -1.51 0.00 0.00 177.10 175.99 2j41 s TYR 82 N -1.72 3.51 0.01 2.20 2.02 -1.26 -0.41 117.35 121.69 2j41 s TYR 82 Ca 0.02 1.50 0.00 0.00 -0.37 0.00 0.00 57.07 58.23 2j41 s TYR 82 Cb -0.07 -2.73 -0.01 0.00 -0.40 0.00 0.00 41.96 38.75 2j41 s TYR 82 CO 0.02 0.13 -0.02 0.71 -1.57 0.00 0.00 175.55 174.82 2j41 s TYR 83 N -1.82 0.19 -0.02 2.71 2.02 -0.13 -1.57 117.35 118.73 2j41 s TYR 83 Ca 0.52 -0.23 -0.29 0.00 -0.37 0.00 0.00 57.07 56.69 2j41 s TYR 83 Cb -0.14 -0.13 0.10 0.00 -0.40 0.00 0.00 41.96 41.40 2j41 s TYR 83 CO 0.19 -0.07 0.97 0.20 -1.57 0.00 0.00 175.55 175.27 2j41 s GLY 84 N -0.65 -0.40 -0.44 0.71 0.00 -0.34 -0.88 107.32 105.33 2j41 s GLY 84 Ca -0.06 0.97 -0.14 0.00 0.00 0.00 0.00 44.72 45.49 2j41 s GLY 84 CO -0.00 0.31 0.33 -1.59 0.00 0.00 0.00 173.10 172.15 2j41 s THR 85 N -2.99 5.07 0.35 0.90 2.01 -0.14 -0.89 115.64 119.95 2j41 s THR 85 Ca 0.07 -0.94 -0.29 0.00 0.31 0.00 0.00 61.69 60.84 2j41 s THR 85 Cb -0.01 -3.94 -0.11 0.00 0.01 0.00 0.00 72.50 68.45 2j41 s THR 85 CO -0.06 -0.45 1.53 -2.84 -0.69 0.00 0.00 174.62 172.11 2j41 s PRO 86 N 1.62 4.10 0.06 4.92 0.02 -1.26 -1.06 135.00 143.41 2j41 s PRO 86 Ca 0.04 2.59 -0.09 0.00 0.02 0.00 0.00 61.00 63.56 2j41 s PRO 86 Cb -0.22 -2.98 -0.29 0.00 0.02 0.00 0.00 34.50 31.03 2j41 s PRO 86 CO 0.07 -0.58 1.11 -0.24 -0.33 0.00 0.00 177.00 177.03 2j41 h VAL 87 N 3.10 1.40 -0.30 3.83 3.04 -1.65 -3.35 116.25 122.33 2j41 h VAL 87 Ca -0.50 -2.84 -0.03 0.00 -1.01 0.00 0.00 66.70 62.32 2j41 h VAL 87 Cb 1.23 2.91 -0.01 0.00 -2.01 0.00 0.00 31.29 33.41 2j41 h VAL 87 CO 0.69 0.84 0.06 -0.61 -1.01 0.00 0.00 177.57 177.54 2j41 h GLN 88 N 0.13 0.49 -0.58 4.17 4.15 -1.92 -1.00 115.11 120.54 2j41 h GLN 88 Ca -0.17 -0.12 0.07 0.00 0.77 0.00 0.00 58.65 59.19 2j41 h GLN 88 Cb 2.00 -0.06 -0.06 0.00 0.21 0.00 0.00 27.48 29.57 2j41 h GLN 88 CO 0.23 0.58 0.27 -0.92 -1.93 0.00 0.00 178.83 177.06 2j41 h TYR 89 N 0.32 0.49 0.17 3.99 3.20 -1.99 0.11 116.97 123.26 2j41 h TYR 89 Ca 0.09 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 2j41 h TYR 89 Cb 0.32 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.45 2j41 h TYR 89 CO 0.02 0.20 -0.08 0.28 -1.64 0.00 0.00 178.16 176.94 2j41 h VAL 90 N 0.51 0.94 -0.09 1.81 2.07 -1.56 -0.79 116.25 119.13 2j41 h VAL 90 Ca 0.27 -0.59 0.03 0.00 0.82 0.00 0.00 66.70 67.23 2j41 h VAL 90 Cb 0.24 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 2j41 h VAL 90 CO -0.22 0.14 -0.06 0.11 0.02 0.00 0.00 177.57 177.56 2j41 h LYS 91 N -0.52 -0.07 -0.54 1.57 1.57 -0.99 -1.40 116.57 116.20 2j41 h LYS 91 Ca -0.02 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2j41 h LYS 91 Cb 0.40 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 2j41 h LYS 91 CO 0.04 -0.04 0.18 -0.44 -0.57 0.00 0.00 179.45 178.62 2j41 h ASP 92 N -0.07 0.77 -0.45 0.86 3.32 -0.77 -1.29 116.42 118.78 2j41 h ASP 92 Ca 0.06 -0.19 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 2j41 h ASP 92 Cb 0.15 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2j41 h ASP 92 CO -0.14 0.76 -0.06 0.74 -1.72 0.00 0.00 179.24 178.82 2j41 h THR 93 N 0.74 1.27 -0.73 0.35 2.02 -1.04 -1.49 112.91 114.02 2j41 h THR 93 Ca 0.18 -1.15 -0.05 0.00 0.77 0.00 0.00 66.41 66.16 2j41 h THR 93 Cb 0.25 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 2j41 h THR 93 CO -0.01 0.40 0.28 0.24 0.37 0.00 0.00 175.52 176.80 2j41 h MET 94 N 0.67 1.11 0.00 6.66 2.86 -1.20 -2.17 114.93 122.86 2j41 h MET 94 Ca 0.12 -0.21 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 2j41 h MET 94 Cb 0.59 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 2j41 h MET 94 CO 0.04 0.92 -0.17 -0.44 1.06 0.00 0.00 176.91 178.31 2j41 h ASP 95 N 1.06 0.00 0.51 1.22 3.32 -1.01 -0.33 116.42 121.19 2j41 h ASP 95 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2j41 h ASP 95 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2j41 h ASP 95 CO -0.02 0.17 0.00 -0.62 -1.72 0.00 0.00 179.24 177.05 2j41 n GLU 96 N -4.14 0.38 -0.19 3.56 1.02 -0.58 -4.85 120.64 115.83 2j41 n GLU 96 Ca -0.02 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2j41 n GLU 96 Cb 0.24 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 1.00 0.77 3.86 0.62 0.00 -0.27 -4.97 105.19 106.21 2j41 n GLY 97 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.16 3.64 0.35 1.61 3.76 -0.85 -3.90 115.29 117.74 2j41 s HIS 98 Ca 0.00 0.74 -0.27 0.00 -0.15 0.00 0.00 55.06 55.38 2j41 s HIS 98 Cb 0.00 -2.11 -0.09 0.00 1.11 0.00 0.00 32.58 31.49 2j41 s HIS 98 CO 0.00 0.65 1.18 -0.51 -0.85 0.00 0.00 174.74 175.21 2j41 s ASP 99 N -1.27 6.82 -0.09 1.40 1.01 -1.26 -3.80 116.67 119.48 2j41 s ASP 99 Ca 0.23 2.40 0.02 0.00 0.71 0.00 0.00 52.55 55.92 2j41 s ASP 99 Cb -0.14 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.14 2j41 s ASP 99 CO 0.12 -0.47 -0.15 -0.69 0.21 0.00 0.00 175.17 174.18 2j41 s VAL 100 N -1.27 2.91 -0.19 -1.27 1.01 0.32 -0.43 120.40 121.48 2j41 s VAL 100 Ca 0.51 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 2j41 s VAL 100 Cb -0.33 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 2j41 s VAL 100 CO 0.43 0.56 -0.02 0.12 0.00 0.00 0.00 175.10 176.19 2j41 s PHE 101 N -0.17 3.02 -0.09 5.22 5.36 0.10 -0.62 117.98 130.80 2j41 s PHE 101 Ca -0.01 -0.46 0.00 0.00 -0.96 0.00 0.00 56.93 55.50 2j41 s PHE 101 Cb -0.13 -2.04 -0.03 0.00 -0.34 0.00 0.00 43.02 40.47 2j41 s PHE 101 CO 0.03 -0.21 -0.07 -0.51 -1.46 0.00 0.00 175.22 173.00 2j41 s LEU 102 N 0.85 3.13 -0.26 6.12 1.43 0.74 -1.71 118.68 128.98 2j41 s LEU 102 Ca 0.00 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 2j41 s LEU 102 Cb -0.14 -1.69 0.07 0.00 0.03 0.00 0.00 46.19 44.45 2j41 s LEU 102 CO 0.02 0.32 -0.05 -0.70 0.23 0.00 0.00 176.35 176.16 2j41 s GLU 103 N -0.54 1.75 0.10 1.70 -6.30 -1.26 -0.29 118.70 113.87 2j41 s GLU 103 Ca 0.08 -1.21 -0.08 0.00 -2.50 0.00 0.00 54.97 51.26 2j41 s GLU 103 Cb -0.12 -2.73 -0.01 0.00 0.00 0.00 0.00 34.13 31.28 2j41 s GLU 103 CO 0.02 -0.65 0.20 0.96 0.02 0.00 0.00 175.26 175.81 2j41 s ILE 104 N 1.25 0.13 0.90 -3.70 -4.36 -0.88 -5.02 121.20 109.53 2j41 s ILE 104 Ca -0.04 -1.28 -0.14 0.00 -0.26 0.00 0.00 60.65 58.93 2j41 s ILE 104 Cb -0.19 -1.48 0.15 0.00 1.25 0.00 0.00 42.46 42.19 2j41 s ILE 104 CO -0.07 -0.58 1.24 -1.83 0.24 0.00 0.00 174.94 173.94 2j41 s GLU 105 N -3.89 1.18 0.36 0.37 4.04 -1.26 -4.20 118.70 115.29 2j41 s GLU 105 Ca 0.08 -0.13 0.09 0.00 0.04 0.00 0.00 54.97 55.05 2j41 s GLU 105 Cb 0.05 -1.88 0.68 0.00 0.02 0.00 0.00 34.13 33.00 2j41 s GLU 105 CO -0.08 -2.10 1.84 -0.39 -1.84 0.00 0.00 175.26 172.69 2j41 h VAL 106 N -1.42 1.23 -0.21 1.83 -1.51 -1.97 -2.12 116.25 112.08 2j41 h VAL 106 Ca -0.45 -1.10 -0.13 0.00 -1.23 0.00 0.00 66.70 63.79 2j41 h VAL 106 Cb 1.28 1.45 0.00 0.00 -2.13 0.00 0.00 31.29 31.90 2j41 h VAL 106 CO 0.51 0.33 -0.37 -0.33 -1.23 0.00 0.00 177.57 176.48 2j41 h GLU 107 N 0.16 0.63 -0.89 5.19 4.39 -1.97 -2.87 114.58 119.22 2j41 h GLU 107 Ca 0.03 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 59.32 2j41 h GLU 107 Cb 0.56 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 2j41 h GLU 107 CO 0.04 1.01 0.52 0.78 -1.16 0.00 0.00 179.01 180.19 2j41 h GLY 108 N 0.32 1.31 0.44 -3.84 0.00 -1.80 -2.50 103.07 97.00 2j41 h GLY 108 Ca 0.01 -0.57 0.13 0.00 0.00 0.00 0.00 47.33 46.91 2j41 h GLY 108 CO 0.08 0.55 0.63 0.00 0.00 0.00 0.00 176.54 177.80 2j41 h ALA 109 N 1.28 1.54 -0.93 3.60 0.00 -1.29 -1.86 119.26 121.59 2j41 h ALA 109 Ca 0.32 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.28 2j41 h ALA 109 Cb -0.02 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 2j41 h ALA 109 CO -0.06 0.20 0.61 0.87 0.00 0.00 0.00 179.25 180.87 2j41 h LYS 110 N 0.98 1.16 -0.51 0.00 1.57 -1.22 -1.11 116.57 117.44 2j41 h LYS 110 Ca 0.51 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 59.15 2j41 h LYS 110 Cb 0.53 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 2j41 h LYS 110 CO -0.28 0.77 0.04 1.96 -0.57 0.00 0.00 179.45 181.38 2j41 h GLN 111 N 1.20 0.83 -0.43 3.15 4.20 -1.30 -2.82 115.11 119.93 2j41 h GLN 111 Ca 0.36 -0.21 -0.06 0.00 0.06 0.00 0.00 58.65 58.80 2j41 h GLN 111 Cb -0.04 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 2j41 h GLN 111 CO -0.11 0.80 0.02 0.28 -0.67 0.00 0.00 178.83 179.15 2j41 h VAL 112 N 0.78 1.26 -0.89 -0.54 2.07 -0.86 -2.72 116.25 115.34 2j41 h VAL 112 Ca 0.16 -1.00 0.06 0.00 0.82 0.00 0.00 66.70 66.74 2j41 h VAL 112 Cb 0.41 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 2j41 h VAL 112 CO 0.01 0.34 0.55 -0.09 0.02 0.00 0.00 177.57 178.41 2j41 h ARG 113 N 0.59 0.97 -0.84 1.57 9.65 -1.12 0.44 114.38 125.65 2j41 h ARG 113 Ca 0.12 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 2j41 h ARG 113 Cb 0.46 -0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 28.79 2j41 h ARG 113 CO 0.02 0.64 0.45 0.87 2.80 0.00 0.00 179.97 184.75 2j41 h LYS 114 N 1.00 1.18 0.07 0.20 1.57 -1.30 -2.10 116.57 117.19 2j41 h LYS 114 Ca 0.39 -0.14 -0.29 0.00 -1.87 0.00 0.00 60.65 58.73 2j41 h LYS 114 Cb 0.18 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2j41 h LYS 114 CO -0.18 0.87 -1.52 0.87 -0.57 0.00 0.00 179.45 178.93 2j41 h LYS 115 N 1.17 0.15 -2.47 3.15 1.57 -1.08 -3.40 116.57 115.66 2j41 h LYS 115 Ca 0.29 -0.25 -0.60 0.00 -1.87 0.00 0.00 60.65 58.22 2j41 h LYS 115 Cb 0.04 0.09 -0.41 0.00 0.08 0.00 0.00 32.23 32.04 2j41 h LYS 115 CO -0.05 0.95 -0.72 1.19 -0.57 0.00 0.00 179.45 180.25 2j41 n PHE 116 N -3.34 2.22 0.25 -1.35 3.72 0.15 -4.97 117.46 114.14 2j41 n PHE 116 Ca -0.15 -3.99 0.13 0.00 -0.05 0.00 0.00 57.45 53.39 2j41 n PHE 116 Cb 1.03 -0.43 0.65 0.00 -0.94 0.00 0.00 39.48 39.79 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 4.74 0.00 -0.24 -1.08 0.13 -1.60 -2.48 132.00 131.47 2j41 h PRO 117 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 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 0.67 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.19 2j41 n ASP 118 N -2.40 2.61 -4.49 1.44 8.00 -1.26 -5.00 116.55 115.44 2j41 n ASP 118 Ca -0.01 -1.82 -0.29 0.00 0.71 0.00 0.00 54.79 53.39 2j41 n ASP 118 Cb 0.11 -0.16 0.22 0.00 -0.02 0.00 0.00 41.12 41.27 2j41 n ASP 118 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j41 s ALA 119 N -0.98 0.28 -0.40 2.24 0.00 -0.94 -4.99 121.76 116.96 2j41 s ALA 119 Ca 0.20 -0.38 -0.16 0.00 0.00 0.00 0.00 51.96 51.62 2j41 s ALA 119 Cb 0.11 -3.13 0.01 0.00 0.00 0.00 0.00 23.12 20.12 2j41 s ALA 119 CO 0.16 -3.38 0.40 -1.17 0.00 0.00 0.00 175.76 171.77 2j41 s LEU 120 N -6.85 4.83 -0.27 0.00 2.96 -0.02 -5.02 118.68 114.32 2j41 s LEU 120 Ca 0.67 -0.63 -0.06 0.00 -0.22 0.00 0.00 54.13 53.89 2j41 s LEU 120 Cb -0.20 -2.34 -0.00 0.00 0.50 0.00 0.00 46.19 44.15 2j41 s LEU 120 CO 0.60 -0.51 0.04 -0.36 -1.32 0.00 0.00 176.35 174.80 2j41 s PHE 121 N 2.03 3.09 -0.18 5.38 0.08 -1.26 0.18 117.98 127.30 2j41 s PHE 121 Ca 0.11 -0.90 -0.02 0.00 0.12 0.00 0.00 56.93 56.24 2j41 s PHE 121 Cb -0.17 -2.21 -0.01 0.00 -0.57 0.00 0.00 43.02 40.06 2j41 s PHE 121 CO 0.13 -0.54 -0.10 0.42 -0.10 0.00 0.00 175.22 175.03 2j41 s ILE 122 N 1.51 3.04 -0.31 0.64 1.01 0.30 -0.89 121.20 126.50 2j41 s ILE 122 Ca 0.04 -0.63 -0.15 0.00 0.00 0.00 0.00 60.65 59.91 2j41 s ILE 122 Cb -0.16 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.95 2j41 s ILE 122 CO 0.01 0.48 0.38 0.12 0.00 0.00 0.00 174.94 175.93 2j41 s PHE 123 N 1.03 3.22 -0.31 3.97 5.36 0.34 -1.67 117.98 129.93 2j41 s PHE 123 Ca -0.01 0.20 -0.23 0.00 -0.96 0.00 0.00 56.93 55.94 2j41 s PHE 123 Cb -0.15 -2.65 -0.00 0.00 -0.34 0.00 0.00 43.02 39.88 2j41 s PHE 123 CO -0.02 -0.35 0.76 -1.17 -1.46 0.00 0.00 175.22 172.99 2j41 s LEU 124 N 2.08 4.10 0.09 6.12 2.96 0.22 -0.55 118.68 133.70 2j41 s LEU 124 Ca 0.14 0.61 0.03 0.00 -0.22 0.00 0.00 54.13 54.69 2j41 s LEU 124 Cb -0.16 -3.03 -0.04 0.00 0.50 0.00 0.00 46.19 43.46 2j41 s LEU 124 CO 0.11 -0.59 0.08 0.00 -1.32 0.00 0.00 176.35 174.62 2j41 s ALA 125 N 2.90 3.54 0.58 5.97 0.00 0.81 -4.09 121.76 131.46 2j41 s ALA 125 Ca 0.31 -1.03 -0.17 0.00 0.00 0.00 0.00 51.96 51.07 2j41 s ALA 125 Cb -0.14 -1.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 2j41 s ALA 125 CO 0.12 0.73 1.06 -1.25 0.00 0.00 0.00 175.76 176.43 2j41 s PRO 126 N -2.43 3.36 0.00 0.00 0.04 -1.26 -0.50 135.00 134.21 2j41 s PRO 126 Ca 0.29 1.28 0.14 0.00 0.04 0.00 0.00 61.00 62.75 2j41 s PRO 126 Cb -0.12 -2.03 0.66 0.00 0.04 0.00 0.00 34.50 33.05 2j41 s PRO 126 CO 0.22 -0.79 1.41 -0.35 0.04 0.00 0.00 177.00 177.53 2j41 n PRO 127 N -1.82 0.12 0.00 0.56 -0.04 -1.26 -4.76 135.00 127.80 2j41 n PRO 127 Ca 0.09 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 2j41 n PRO 127 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2j41 n PRO 127 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2j41 n SER 128 N -1.37 0.00 0.00 3.54 3.41 -1.26 -5.06 113.62 112.88 2j41 n SER 128 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 2j41 n SER 128 Cb 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2j41 n SER 128 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2j41 n GLU 153 N 0.00 0.00 -3.85 4.33 4.71 -1.26 -5.27 120.64 119.30 2j41 n GLU 153 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 57.16 56.91 2j41 n GLU 153 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 2j41 n GLU 153 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2j41 n ALA 154 N 0.00 -2.05 1.58 0.62 0.00 -1.26 -4.88 120.51 114.52 2j41 n ALA 154 Ca 0.00 -0.24 0.15 0.00 0.00 0.00 0.00 53.44 53.36 2j41 n ALA 154 Cb 0.00 -1.79 0.79 0.00 0.00 0.00 0.00 19.45 18.44 2j41 n ALA 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2j41 n ARG 155 N -4.34 0.63 0.23 0.00 3.00 -1.26 -3.57 116.66 111.34 2j41 n ARG 155 Ca -0.30 -0.05 0.06 0.00 -0.01 0.00 0.00 57.85 57.56 2j41 n ARG 155 Cb 0.68 -1.50 0.54 0.00 0.00 0.00 0.00 32.46 32.18 2j41 n ARG 155 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 2j41 h LYS 156 N 0.11 0.00 -0.02 5.56 1.79 -1.99 -1.52 116.57 120.51 2j41 h LYS 156 Ca 0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 2j41 h LYS 156 Cb 0.22 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.86 2j41 h LYS 156 CO 0.00 0.18 -0.43 0.93 -1.08 0.00 0.00 179.45 179.05 2j41 h GLU 157 N 0.00 0.04 0.06 3.15 5.08 -1.97 0.14 114.58 121.08 2j41 h GLU 157 Ca -0.00 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 58.10 2j41 h GLU 157 Cb 0.34 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2j41 h GLU 157 CO 0.02 0.46 -1.08 0.28 -1.00 0.00 0.00 179.01 177.69 2j41 h VAL 158 N 0.03 1.55 -0.16 3.13 2.07 -1.55 -2.81 116.25 118.52 2j41 h VAL 158 Ca -0.00 -3.03 -0.12 0.00 0.82 0.00 0.00 66.70 64.37 2j41 h VAL 158 Cb 0.78 2.79 -0.01 0.00 -1.52 0.00 0.00 31.29 33.33 2j41 h VAL 158 CO 0.06 0.88 -0.44 -0.08 0.02 0.00 0.00 177.57 178.01 2j41 h GLU 159 N 0.07 0.37 -0.48 1.57 4.57 -1.06 -2.97 114.58 116.65 2j41 h GLU 159 Ca -0.08 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 57.88 2j41 h GLU 159 Cb 1.80 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.37 2j41 h GLU 159 CO 0.17 0.74 0.17 1.98 -1.18 0.00 0.00 179.01 180.89 2j41 h MET 160 N 0.30 0.69 0.00 1.92 4.05 -0.71 -2.72 114.93 118.46 2j41 h MET 160 Ca 0.02 -0.11 -0.05 0.00 -0.28 0.00 0.00 59.70 59.28 2j41 h MET 160 Cb 0.89 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.56 2j41 h MET 160 CO 0.07 0.59 -0.26 0.52 0.23 0.00 0.00 176.91 178.06 2j41 h MET 161 N 0.68 0.00 -1.03 0.39 2.86 -1.35 -3.41 114.93 113.08 2j41 h MET 161 Ca 0.16 0.00 0.26 0.00 -2.06 0.00 0.00 59.70 58.06 2j41 h MET 161 Cb 0.17 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.73 2j41 h MET 161 CO -0.01 0.26 0.65 -0.97 1.06 0.00 0.00 176.91 177.90 2j41 h ASN 162 N 0.00 0.52 -0.45 1.22 -0.00 -1.36 0.50 115.58 116.01 2j41 h ASN 162 Ca -0.00 0.10 0.00 0.00 -0.00 0.00 0.00 56.30 56.40 2j41 h ASN 162 Cb 0.82 0.02 0.00 0.00 -0.00 0.00 0.00 38.32 39.15 2j41 h ASN 162 CO 0.03 0.09 0.00 0.18 -0.00 0.00 0.00 177.43 177.74 2j41 n LEU 163 N -4.70 3.49 -4.87 0.34 7.99 -1.26 -4.96 117.00 113.02 2j41 n LEU 163 Ca 0.26 -2.19 -0.30 0.00 -0.01 0.00 0.00 56.01 53.76 2j41 n LEU 163 Cb 0.84 -0.37 0.03 0.00 -0.11 0.00 0.00 43.42 43.81 2j41 n LEU 163 CO 0.23 0.78 0.74 -0.31 -1.51 0.00 0.00 177.39 177.32 2j41 s TYR 164 N -1.35 3.42 -0.13 -1.77 2.02 0.16 -5.00 117.35 114.70 2j41 s TYR 164 Ca 0.34 1.16 0.05 0.00 -0.37 0.00 0.00 57.07 58.25 2j41 s TYR 164 Cb 0.20 -2.93 -0.24 0.00 -0.40 0.00 0.00 41.96 38.60 2j41 s TYR 164 CO 0.19 -1.01 0.33 -0.25 -1.57 0.00 0.00 175.55 173.24 2j41 n ASP 165 N -2.92 1.36 -4.01 2.29 8.00 -0.07 -4.98 116.55 116.22 2j41 n ASP 165 Ca 0.07 0.19 -0.08 0.00 0.71 0.00 0.00 54.79 55.67 2j41 n ASP 165 Cb 0.56 -0.24 -0.11 0.00 -0.02 0.00 0.00 41.12 41.31 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 -2.56 0.33 -0.09 1.24 2.02 -0.88 -5.04 117.35 112.37 2j41 s TYR 166 Ca -0.17 -0.69 0.02 0.00 -0.37 0.00 0.00 57.07 55.86 2j41 s TYR 166 Cb 0.07 -0.25 0.01 0.00 -0.40 0.00 0.00 41.96 41.40 2j41 s TYR 166 CO 0.77 -0.27 -0.14 0.08 -1.57 0.00 0.00 175.55 174.42 2j41 s VAL 167 N -2.36 1.38 -0.14 0.71 1.01 -1.26 -0.50 120.40 119.24 2j41 s VAL 167 Ca -0.08 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2j41 s VAL 167 Cb -0.03 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2j41 s VAL 167 CO -0.04 0.42 -0.19 -0.69 0.00 0.00 0.00 175.10 174.59 2j41 s VAL 168 N 0.87 1.87 0.01 2.92 1.01 0.29 -4.96 120.40 122.42 2j41 s VAL 168 Ca -0.10 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 2j41 s VAL 168 Cb -0.15 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 2j41 s VAL 168 CO 0.01 0.51 0.96 -0.69 0.00 0.00 0.00 175.10 175.89 2j41 s VAL 169 N 1.03 4.83 -1.40 2.92 1.01 -1.26 -0.13 120.40 127.39 2j41 s VAL 169 Ca -0.03 2.03 -0.09 0.00 0.00 0.00 0.00 61.98 63.89 2j41 s VAL 169 Cb -0.15 -4.31 0.07 0.00 0.00 0.00 0.00 36.38 32.00 2j41 s VAL 169 CO -0.05 0.19 2.32 -3.20 0.00 0.00 0.00 175.10 174.35 2j41 n ASN 170 N 3.74 6.38 -0.01 3.32 5.15 0.35 -4.48 115.26 129.70 2j41 n ASN 170 Ca 0.05 -2.95 -0.13 0.00 -0.60 0.00 0.00 54.58 50.95 2j41 n ASN 170 Cb 0.51 -1.50 -0.10 0.00 -0.53 0.00 0.00 39.78 38.15 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 5.34 -0.02 -3.98 1.20 3.04 -1.93 -3.38 116.42 116.68 2j41 h ASP 171 Ca 0.62 -0.55 -0.27 0.00 -3.24 0.00 0.00 57.03 53.59 2j41 h ASP 171 Cb 0.47 0.01 -0.27 0.00 -1.04 0.00 0.00 39.33 38.50 2j41 h ASP 171 CO 1.68 0.55 -0.73 -1.61 -2.04 0.00 0.00 179.24 177.09 2j41 s GLU 172 N -3.87 0.24 0.20 4.15 2.02 -1.26 -5.02 118.70 115.16 2j41 s GLU 172 Ca -0.16 -0.18 -0.11 0.00 0.02 0.00 0.00 54.97 54.54 2j41 s GLU 172 Cb 0.01 -0.18 0.14 0.00 0.10 0.00 0.00 34.13 34.20 2j41 s GLU 172 CO 0.66 0.05 1.86 0.28 0.02 0.00 0.00 175.26 178.12 2j41 h VAL 173 N 5.01 1.14 -0.77 2.63 2.07 -1.96 -1.27 116.25 123.11 2j41 h VAL 173 Ca -0.27 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 66.90 2j41 h VAL 173 Cb 1.20 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2j41 h VAL 173 CO 0.49 0.16 0.30 -0.08 0.02 0.00 0.00 177.57 178.47 2j41 h GLU 174 N 0.89 1.15 -0.37 1.57 4.57 -1.99 -1.81 114.58 118.59 2j41 h GLU 174 Ca 0.26 -0.21 -0.09 0.00 -1.18 0.00 0.00 59.36 58.14 2j41 h GLU 174 Cb -0.06 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.33 2j41 h GLU 174 CO -0.07 0.93 -0.13 -0.07 -1.18 0.00 0.00 179.01 178.49 2j41 h LEU 175 N 1.12 0.75 -0.56 1.64 3.38 -1.81 -2.03 115.31 117.81 2j41 h LEU 175 Ca 0.26 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.86 2j41 h LEU 175 Cb 0.22 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2j41 h LEU 175 CO -0.02 0.96 0.35 0.00 0.09 0.00 0.00 178.44 179.82 2j41 h ALA 176 N 0.81 0.71 -0.23 1.53 0.00 -1.17 -1.90 119.26 119.02 2j41 h ALA 176 Ca 0.09 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2j41 h ALA 176 Cb 0.65 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2j41 h ALA 176 CO 0.04 0.09 0.10 -0.22 0.00 0.00 0.00 179.25 179.26 2j41 h LYS 177 N 0.70 0.21 -0.79 0.00 3.64 -1.25 -1.90 116.57 117.18 2j41 h LYS 177 Ca 0.22 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 2j41 h LYS 177 Cb -0.02 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 2j41 h LYS 177 CO -0.08 0.14 0.32 -0.91 -2.27 0.00 0.00 179.45 176.65 2j41 h ASN 178 N 0.22 1.09 -0.38 4.20 2.35 -1.20 -1.23 115.58 120.64 2j41 h ASN 178 Ca 0.10 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2j41 h ASN 178 Cb 0.04 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.11 2j41 h ASN 178 CO -0.08 0.96 0.24 0.03 -1.65 0.00 0.00 177.43 176.94 2j41 h ARG 179 N 1.15 0.50 -0.74 0.81 3.08 -1.18 -1.87 114.38 116.12 2j41 h ARG 179 Ca 0.26 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2j41 h ARG 179 Cb 0.21 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 2j41 h ARG 179 CO -0.02 0.34 0.47 0.82 -1.07 0.00 0.00 179.97 180.51 2j41 h ILE 180 N 0.51 1.20 -0.95 2.04 2.04 -1.02 -1.23 117.51 120.10 2j41 h ILE 180 Ca 0.14 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 2j41 h ILE 180 Cb -0.04 0.14 -0.05 0.00 -0.74 0.00 0.00 36.82 36.13 2j41 h ILE 180 CO -0.03 0.20 0.59 1.56 0.00 0.00 0.00 178.15 180.47 2j41 h GLN 181 N 1.01 1.28 -0.37 2.37 4.20 -1.00 -1.22 115.11 121.37 2j41 h GLN 181 Ca 0.27 -0.10 -0.14 0.00 0.06 0.00 0.00 58.65 58.74 2j41 h GLN 181 Cb -0.07 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.43 2j41 h GLN 181 CO -0.05 0.88 -0.32 0.00 -0.67 0.00 0.00 178.83 178.67 2j41 h ILE 183 N 0.69 1.07 -0.49 0.00 2.04 -0.85 0.43 117.51 120.41 2j41 h ILE 183 Ca 0.07 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 2j41 h ILE 183 Cb 0.86 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2j41 h ILE 183 CO 0.08 0.08 -0.13 0.58 0.00 0.00 0.00 178.15 178.75 2j41 h VAL 184 N 0.41 1.27 -0.55 1.67 2.07 -1.11 -1.25 116.25 118.76 2j41 h VAL 184 Ca 0.12 -1.28 0.02 0.00 0.82 0.00 0.00 66.70 66.38 2j41 h VAL 184 Cb -0.04 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 2j41 h VAL 184 CO -0.03 0.44 0.35 -0.08 0.02 0.00 0.00 177.57 178.27 2j41 h GLU 185 N 0.81 0.68 -0.67 1.57 4.57 -0.87 -2.09 114.58 118.57 2j41 h GLU 185 Ca 0.12 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.21 2j41 h GLU 185 Cb 0.70 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.10 2j41 h GLU 185 CO 0.05 0.45 0.20 0.00 -1.18 0.00 0.00 179.01 178.53 2j41 h ALA 186 N 1.23 1.09 -0.40 2.92 0.00 -0.69 -2.41 119.26 121.00 2j41 h ALA 186 Ca 0.21 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2j41 h ALA 186 Cb -0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2j41 h ALA 186 CO -0.08 0.62 0.13 0.93 0.00 0.00 0.00 179.25 180.85 2j41 h GLU 187 N 0.99 0.58 0.00 0.00 4.39 -0.80 -1.00 114.58 118.75 2j41 h GLU 187 Ca 0.22 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 2j41 h GLU 187 Cb 0.29 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2j41 h GLU 187 CO -0.01 0.51 -0.21 0.45 -1.16 0.00 0.00 179.01 178.59 2j41 h HIS 188 N 0.57 0.00 -0.01 4.33 3.86 -0.91 -3.02 115.15 119.97 2j41 h HIS 188 Ca 0.14 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 2j41 h HIS 188 Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 2j41 h HIS 188 CO 0.01 0.21 -0.16 1.28 0.86 0.00 0.00 177.93 180.12 2j41 n LEU 189 N -3.62 1.51 -4.71 2.43 4.77 -0.44 -4.64 117.00 112.30 2j41 n LEU 189 Ca -0.01 -0.48 -0.43 0.00 -0.03 0.00 0.00 56.01 55.06 2j41 n LEU 189 Cb 0.34 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.35 2j41 n LEU 189 CO 0.33 0.27 1.16 0.29 -1.33 0.00 0.00 177.39 178.10 2j41 n LYS 190 N -0.08 2.39 -0.30 3.23 5.02 -0.85 -4.81 118.16 122.76 2j41 n LYS 190 Ca 0.14 0.85 0.00 0.00 -2.02 0.00 0.00 58.31 57.29 2j41 n LYS 190 Cb 0.39 -2.59 0.13 0.00 -0.02 0.00 0.00 35.03 32.94 2j41 n LYS 190 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2j41 h ARG 191 N 4.85 0.93 -0.35 1.97 1.12 -1.92 -1.02 114.38 119.96 2j41 h ARG 191 Ca -0.46 -0.06 0.07 0.00 -1.11 0.00 0.00 59.98 58.43 2j41 h ARG 191 Cb 1.25 -0.21 -0.07 0.00 -0.01 0.00 0.00 29.97 30.92 2j41 h ARG 191 CO 0.80 0.61 -0.12 0.93 -3.11 0.00 0.00 179.97 179.08 2j41 h GLU 192 N 0.96 -0.05 -0.05 0.20 3.07 -1.98 0.72 114.58 117.45 2j41 h GLU 192 Ca 0.36 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.22 2j41 h GLU 192 Cb 0.16 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2j41 h GLU 192 CO -0.17 -0.03 0.02 -0.09 -1.40 0.00 0.00 179.01 177.34 2j41 h ARG 193 N -0.05 0.08 -0.32 2.33 2.43 -1.81 -2.35 114.38 114.69 2j41 h ARG 193 Ca 0.17 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.28 2j41 h ARG 193 Cb 0.31 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 2j41 h ARG 193 CO -0.39 0.25 0.01 0.28 -1.51 0.00 0.00 179.97 178.62 2j41 h VAL 194 N -0.11 1.25 -0.55 0.20 2.07 -0.75 -2.64 116.25 115.73 2j41 h VAL 194 Ca 0.02 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 66.68 2j41 h VAL 194 Cb 0.20 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 2j41 h VAL 194 CO -0.00 0.30 0.24 -0.08 0.02 0.00 0.00 177.57 178.05 2j41 h GLU 195 N 0.36 0.44 -0.70 1.57 4.81 0.40 -2.13 114.58 119.33 2j41 h GLU 195 Ca 0.09 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 2j41 h GLU 195 Cb 0.42 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.65 2j41 h GLU 195 CO 0.01 0.29 0.42 0.00 -0.73 0.00 0.00 179.01 179.00 2j41 h ALA 196 N 1.34 0.93 -0.29 2.92 0.00 -1.26 -1.40 119.26 121.50 2j41 h ALA 196 Ca 0.26 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.19 2j41 h ALA 196 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2j41 h ALA 196 CO -0.23 0.14 0.14 -0.22 0.00 0.00 0.00 179.25 179.08 2j41 h LYS 197 N 0.79 0.28 -0.11 0.00 3.64 -1.04 -0.70 116.57 119.43 2j41 h LYS 197 Ca 0.30 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.50 2j41 h LYS 197 Cb 0.11 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2j41 h LYS 197 CO -0.15 0.19 -0.62 1.88 -2.27 0.00 0.00 179.45 178.48 2j41 h TYR 198 N 0.29 0.50 -0.01 1.91 0.05 -1.16 -1.70 116.97 116.85 2j41 h TYR 198 Ca 0.12 -0.19 -0.19 0.00 0.05 0.00 0.00 58.73 58.52 2j41 h TYR 198 Cb 0.05 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.69 2j41 h TYR 198 CO -0.10 0.90 -0.82 0.07 -1.05 0.00 0.00 178.16 177.16 2j41 h ARG 199 N 0.29 0.20 -0.33 4.88 0.11 -1.15 -1.89 114.38 116.49 2j41 h ARG 199 Ca -0.01 -0.20 0.03 0.00 0.10 0.00 0.00 59.98 59.90 2j41 h ARG 199 Cb 1.15 0.05 -0.03 0.00 1.11 0.00 0.00 29.97 32.25 2j41 h ARG 199 CO 0.10 0.91 0.14 -0.22 0.10 0.00 0.00 179.97 181.01 2j41 h LYS 200 N 0.12 0.30 -0.41 0.08 3.64 -1.09 -2.31 116.57 116.90 2j41 h LYS 200 Ca -0.04 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 2j41 h LYS 200 Cb 1.42 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 33.13 2j41 h LYS 200 CO 0.12 0.20 0.14 1.98 -2.27 0.00 0.00 179.45 179.62 2j41 h MET 201 N 0.30 0.29 0.00 1.90 4.05 -1.09 -1.47 114.93 118.91 2j41 h MET 201 Ca 0.14 -0.02 -0.11 0.00 -0.28 0.00 0.00 59.70 59.44 2j41 h MET 201 Cb 0.08 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 2j41 h MET 201 CO -0.12 0.19 -0.53 -0.84 0.23 0.00 0.00 176.91 175.84 2j41 h ILE 202 N 0.30 1.22 0.00 1.77 -2.65 -1.29 -2.52 117.51 114.34 2j41 h ILE 202 Ca 0.19 -1.91 -0.12 0.00 1.03 0.00 0.00 64.86 64.05 2j41 h ILE 202 Cb 0.19 2.08 -0.02 0.00 -2.05 0.00 0.00 36.82 37.02 2j41 h ILE 202 CO -0.20 0.52 -0.58 -0.07 0.03 0.00 0.00 178.15 177.84 2j41 h LEU 203 N 0.00 0.00 -0.42 0.16 3.38 -1.12 -1.82 115.31 115.48 2j41 h LEU 203 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2j41 h LEU 203 Cb 1.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2j41 h LEU 203 CO 0.07 0.58 -0.41 -0.33 0.09 0.00 0.00 178.44 178.44 2j41 h GLU 204 N 0.00 0.00 -0.02 1.13 5.08 -1.09 -3.23 114.58 116.45 2j41 h GLU 204 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2j41 h GLU 204 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2j41 h GLU 204 CO 0.08 0.41 -0.30 0.00 -1.00 0.00 0.00 179.01 178.20 2j41 n ALA 205 N -2.24 3.16 1.28 3.43 0.00 -0.97 -5.10 120.51 120.07 2j41 n ALA 205 Ca 0.01 -0.62 0.10 0.00 0.00 0.00 0.00 53.44 52.94 2j41 n ALA 205 Cb 0.62 -0.86 0.61 0.00 0.00 0.00 0.00 19.45 19.82 2j41 n ALA 205 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67