#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j8i n SER -16 N 0.00 3.34 -4.62 6.43 2.88 -1.26 -4.94 113.62 115.45 2j8i n SER -16 Ca 0.00 -2.24 -0.43 0.00 -1.33 0.00 0.00 58.87 54.87 2j8i n SER -16 Cb 0.00 -0.45 -0.02 0.00 -0.75 0.00 0.00 64.21 62.99 2j8i n SER -16 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2j8i s HIS -15 N -1.65 2.98 -2.09 0.66 2.46 -1.26 -4.93 115.29 111.46 2j8i s HIS -15 Ca 0.36 0.92 0.15 0.00 0.47 0.00 0.00 55.06 56.97 2j8i s HIS -15 Cb 0.22 -4.06 0.47 0.00 -0.13 0.00 0.00 32.58 29.08 2j8i s HIS -15 CO 0.19 -1.02 1.37 0.72 -2.47 0.00 0.00 174.74 173.53 2j8i n HIS -14 N 7.35 0.46 -3.14 3.88 -0.00 -1.26 -4.93 115.22 117.57 2j8i n HIS -14 Ca 0.12 -0.23 -0.22 0.00 -0.00 0.00 0.00 57.72 57.39 2j8i n HIS -14 Cb 0.48 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.48 2j8i n HIS -14 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2j8i n HIS -13 N 0.64 -1.79 -2.69 4.41 -0.00 -1.26 -2.86 115.22 111.68 2j8i n HIS -13 Ca 0.15 0.42 -0.09 0.00 -0.00 0.00 0.00 57.72 58.20 2j8i n HIS -13 Cb 0.35 -3.37 0.05 0.00 -0.00 0.00 0.00 29.99 27.02 2j8i n HIS -13 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2j8i n HIS -12 N -4.03 -1.20 -3.91 4.41 -0.00 -1.26 -5.08 115.22 104.15 2j8i n HIS -12 Ca -0.06 0.49 -0.10 0.00 -0.00 0.00 0.00 57.72 58.05 2j8i n HIS -12 Cb 0.57 -3.58 -0.10 0.00 -0.00 0.00 0.00 29.99 26.89 2j8i n HIS -12 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2j8i s HIS -11 N -3.19 0.14 0.58 4.41 0.09 -1.13 -3.86 115.29 112.32 2j8i s HIS -11 Ca 0.05 -0.36 -0.18 0.00 -0.00 0.00 0.00 55.06 54.58 2j8i s HIS -11 Cb -0.01 -0.11 -0.11 0.00 -0.00 0.00 0.00 32.58 32.36 2j8i s HIS -11 CO 0.39 -0.33 0.20 1.58 -0.00 0.00 0.00 174.74 176.59 2j8i n HIS -10 N 1.07 -1.80 -0.01 1.40 -0.00 -1.26 -4.78 115.22 109.84 2j8i n HIS -10 Ca -0.21 0.41 0.14 0.00 0.46 0.00 0.00 57.72 58.53 2j8i n HIS -10 Cb 0.57 -1.82 0.58 0.00 -0.12 0.00 0.00 29.99 29.20 2j8i n HIS -10 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2j8i h SER -9 N 0.01 0.21 0.89 0.26 4.64 -1.96 -1.58 113.55 116.01 2j8i h SER -9 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2j8i h SER -9 Cb 1.41 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2j8i h SER -9 CO 0.43 0.12 0.00 0.77 -0.87 0.00 0.00 176.83 177.29 2j8i h SER -8 N 0.23 0.00 0.00 4.97 4.64 -2.02 -3.46 113.55 117.90 2j8i h SER -8 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2j8i h SER -8 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2j8i h SER -8 CO -0.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.53 2j8i n GLY -7 N 0.00 0.62 3.68 -0.77 0.00 -0.59 -5.01 105.19 103.12 2j8i n GLY -7 Ca 0.01 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.51 2j8i n GLY -7 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2j8i n LEU -6 N 0.00 2.76 -4.29 0.99 0.00 -1.26 -4.94 117.00 110.26 2j8i n LEU -6 Ca 0.00 1.04 -0.45 0.00 0.00 0.00 0.00 56.01 56.60 2j8i n LEU -6 Cb 0.00 -1.26 -0.05 0.00 0.00 0.00 0.00 43.42 42.11 2j8i n LEU -6 CO 0.00 -0.35 0.20 -0.69 0.00 0.00 0.00 177.39 176.54 2j8i s VAL -5 N 3.10 5.13 -1.34 1.96 1.01 -1.26 -4.60 120.40 124.41 2j8i s VAL -5 Ca 0.93 -1.87 0.25 0.00 0.00 0.00 0.00 61.98 61.28 2j8i s VAL -5 Cb -0.88 -4.26 0.39 0.00 0.00 0.00 0.00 36.38 31.63 2j8i s VAL -5 CO 0.55 -0.90 1.84 -0.81 0.00 0.00 0.00 175.10 175.78 2j8i n PRO -4 N 4.77 0.28 -1.66 2.72 -0.04 -1.26 -4.89 135.00 134.92 2j8i n PRO -4 Ca -0.04 0.05 -0.63 0.00 -0.04 0.00 0.00 63.50 62.83 2j8i n PRO -4 Cb 0.42 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 2j8i n PRO -4 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2j8i n ARG -3 N -1.33 0.16 -0.77 0.54 0.63 -1.25 -1.12 116.66 113.52 2j8i n ARG -3 Ca 0.11 0.06 0.00 0.00 -0.92 0.00 0.00 57.85 57.10 2j8i n ARG -3 Cb 0.22 -1.58 0.00 0.00 0.45 0.00 0.00 32.46 31.55 2j8i n ARG -3 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2j8i n GLY -2 N 3.15 1.24 3.87 5.14 0.00 -0.66 -4.92 105.19 113.00 2j8i n GLY -2 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.98 2j8i n GLY -2 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j8i s SER -1 N -3.07 6.11 -0.07 1.61 1.04 -0.27 -4.33 113.70 114.72 2j8i s SER -1 Ca 0.00 1.37 -0.18 0.00 0.48 0.00 0.00 55.95 57.62 2j8i s SER -1 Cb 0.00 -2.38 -0.05 0.00 0.10 0.00 0.00 66.02 63.69 2j8i s SER -1 CO 0.00 -0.94 0.49 -2.28 0.98 0.00 0.00 173.24 171.50 2j8i s HIS 0 N -3.20 3.59 0.11 5.02 2.46 -1.26 -0.74 115.29 121.26 2j8i s HIS 0 Ca 0.55 0.98 0.03 0.00 0.47 0.00 0.00 55.06 57.09 2j8i s HIS 0 Cb -0.11 -2.52 -0.04 0.00 -0.13 0.00 0.00 32.58 29.78 2j8i s HIS 0 CO 0.54 0.29 -0.08 -1.64 -2.47 0.00 0.00 174.74 171.37 2j8i s MET 1 N 0.16 0.89 0.46 2.88 -1.94 -1.15 -4.98 119.30 115.62 2j8i s MET 1 Ca 0.27 -1.32 0.07 0.00 -1.71 0.00 0.00 55.69 53.01 2j8i s MET 1 Cb -0.16 -0.38 0.00 0.00 2.01 0.00 0.00 34.83 36.31 2j8i s MET 1 CO 0.12 0.03 0.44 0.16 -0.01 0.00 0.00 175.02 175.76 2j8i s ASP 2 N -2.93 4.99 0.18 3.03 1.47 -1.26 -4.79 116.67 117.36 2j8i s ASP 2 Ca 0.11 -0.85 -0.13 0.00 1.18 0.00 0.00 52.55 52.86 2j8i s ASP 2 Cb 0.03 -0.28 0.10 0.00 -0.34 0.00 0.00 42.92 42.43 2j8i s ASP 2 CO -0.02 -0.82 1.82 1.62 0.68 0.00 0.00 175.17 178.45 2j8i h VAL 3 N 0.86 1.08 -0.45 2.11 3.04 -1.99 -2.08 116.25 118.81 2j8i h VAL 3 Ca -0.39 -0.23 0.09 0.00 -1.01 0.00 0.00 66.70 65.16 2j8i h VAL 3 Cb 1.28 0.36 -0.10 0.00 -2.01 0.00 0.00 31.29 30.82 2j8i h VAL 3 CO 0.55 0.12 -0.28 -0.08 -1.01 0.00 0.00 177.57 176.87 2j8i h GLU 4 N 0.66 -0.17 -0.56 4.17 4.81 -1.96 -0.21 114.58 121.32 2j8i h GLU 4 Ca 0.21 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 2j8i h GLU 4 Cb -0.00 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 2j8i h GLU 4 CO -0.08 -0.12 0.27 -0.22 -0.73 0.00 0.00 179.01 178.13 2j8i h LYS 5 N -0.18 0.80 0.06 1.92 1.63 -1.88 -0.29 116.57 118.64 2j8i h LYS 5 Ca 0.20 -0.12 -0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2j8i h LYS 5 Cb 0.51 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 2j8i h LYS 5 CO -0.56 0.66 -0.03 1.25 -3.45 0.00 0.00 179.45 177.32 2j8i h LEU 6 N 0.76 -0.07 -0.75 5.20 6.46 -0.84 -1.57 115.31 124.48 2j8i h LEU 6 Ca 0.19 -0.06 0.11 0.00 -0.12 0.00 0.00 57.88 58.01 2j8i h LEU 6 Cb 0.12 0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 39.98 2j8i h LEU 6 CO -0.02 0.01 0.37 0.03 -0.62 0.00 0.00 178.44 178.21 2j8i h ARG 7 N -0.15 0.57 -0.45 1.25 3.08 -0.91 0.40 114.38 118.18 2j8i h ARG 7 Ca -0.01 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 2j8i h ARG 7 Cb 0.12 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2j8i h ARG 7 CO 0.01 0.38 0.17 1.96 -1.07 0.00 0.00 179.97 181.42 2j8i h GLN 8 N 0.59 0.68 -0.18 0.04 4.20 -0.61 0.38 115.11 120.21 2j8i h GLN 8 Ca 0.39 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.87 2j8i h GLN 8 Cb 0.47 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 2j8i h GLN 8 CO -0.31 0.63 -0.25 -0.07 -0.67 0.00 0.00 178.83 178.17 2j8i h LEU 9 N 0.59 0.54 -0.78 1.46 3.38 -0.93 -2.18 115.31 117.38 2j8i h LEU 9 Ca 0.15 -0.51 0.04 0.00 0.09 0.00 0.00 57.88 57.65 2j8i h LEU 9 Cb 0.22 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 2j8i h LEU 9 CO -0.01 0.94 0.49 0.22 0.09 0.00 0.00 178.44 180.17 2j8i h TYR 10 N 0.14 0.92 0.00 1.13 5.03 -0.89 -1.97 116.97 121.33 2j8i h TYR 10 Ca 0.02 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.36 2j8i h TYR 10 Cb 0.82 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 38.80 2j8i h TYR 10 CO 0.09 0.50 0.00 0.00 -1.32 0.00 0.00 178.16 177.43 2j8i h ALA 11 N 1.35 1.00 -0.20 1.82 0.00 -0.74 -1.61 119.26 120.87 2j8i h ALA 11 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2j8i h ALA 11 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2j8i h ALA 11 CO -0.13 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.12 2j8i n ALA 12 N -1.97 2.50 -0.02 0.00 0.00 -0.83 -4.95 120.51 115.24 2j8i n ALA 12 Ca -0.00 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2j8i n ALA 12 Cb 0.21 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2j8i n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j8i n GLY 13 N 1.19 0.30 3.74 0.00 0.00 -0.60 -4.35 105.19 105.47 2j8i n GLY 13 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2j8i n GLY 13 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j8i s GLU 14 N -0.95 4.21 0.00 1.61 2.56 -0.80 -4.47 118.70 120.87 2j8i s GLU 14 Ca 0.00 2.40 0.00 0.00 0.00 0.00 0.00 54.97 57.37 2j8i s GLU 14 Cb 0.00 -3.08 0.00 0.00 2.00 0.00 0.00 34.13 33.05 2j8i s GLU 14 CO 0.00 -0.50 0.00 0.54 -0.56 0.00 0.00 175.26 174.74 2j8i n ARG 15 N 2.38 2.84 -3.01 4.30 5.12 -1.26 -4.31 116.66 122.72 2j8i n ARG 15 Ca 0.08 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.55 2j8i n ARG 15 Cb 0.39 -0.70 -0.02 0.00 -1.16 0.00 0.00 32.46 30.97 2j8i n ARG 15 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2j8i s ASP 16 N -1.25 6.73 -0.49 0.55 2.15 -1.26 0.01 116.67 123.11 2j8i s ASP 16 Ca 0.00 -2.33 0.02 0.00 0.43 0.00 0.00 52.55 50.68 2j8i s ASP 16 Cb 0.00 -2.36 0.47 0.00 -0.30 0.00 0.00 42.92 40.73 2j8i s ASP 16 CO 0.00 -0.92 1.68 0.49 -0.17 0.00 0.00 175.17 176.26 2j8i n PHE 17 N 5.90 2.86 -2.11 -5.34 3.72 -0.33 -3.94 117.46 118.22 2j8i n PHE 17 Ca 0.24 -2.56 -0.36 0.00 -0.05 0.00 0.00 57.45 54.73 2j8i n PHE 17 Cb 0.48 -0.95 0.02 0.00 -0.94 0.00 0.00 39.48 38.08 2j8i n PHE 17 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2j8i s SER 18 N -2.48 5.48 -1.24 4.37 1.04 -1.14 -3.13 113.70 116.61 2j8i s SER 18 Ca 0.58 2.33 0.00 0.00 0.48 0.00 0.00 55.95 59.34 2j8i s SER 18 Cb 0.46 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.99 2j8i s SER 18 CO 0.01 -1.39 0.00 2.30 0.98 0.00 0.00 173.24 175.14 2j8i n ILE 19 N -1.34 0.00 -1.40 -1.02 -5.35 0.71 -1.66 119.36 109.31 2j8i n ILE 19 Ca 0.12 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.28 2j8i n ILE 19 Cb 0.50 -1.12 0.08 0.00 -1.74 0.00 0.00 39.64 37.36 2j8i n ILE 19 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 2j8i s VAL 20 N -1.98 3.22 -0.47 7.28 -7.23 -1.18 -3.75 120.40 116.28 2j8i s VAL 20 Ca 0.00 0.46 -0.16 0.00 -1.81 0.00 0.00 61.98 60.46 2j8i s VAL 20 Cb 0.00 -2.94 0.07 0.00 0.56 0.00 0.00 36.38 34.07 2j8i s VAL 20 CO 0.00 -0.46 0.43 -0.62 -0.31 0.00 0.00 175.10 174.14 2j8i s ASP 21 N -3.07 6.16 -0.15 4.85 -1.08 0.08 -0.01 116.67 123.45 2j8i s ASP 21 Ca 0.64 -1.23 0.16 0.00 -0.52 0.00 0.00 52.55 51.60 2j8i s ASP 21 Cb -0.19 -2.20 0.43 0.00 -1.46 0.00 0.00 42.92 39.50 2j8i s ASP 21 CO 0.51 -0.68 1.20 0.18 0.52 0.00 0.00 175.17 176.90 2j8i n LEU 22 N 5.37 2.24 -4.73 -1.34 4.77 0.10 -2.94 117.00 120.46 2j8i n LEU 22 Ca -0.11 -3.28 -0.42 0.00 -0.03 0.00 0.00 56.01 52.17 2j8i n LEU 22 Cb 0.44 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2j8i n LEU 22 CO 0.48 1.13 1.17 -0.13 -1.33 0.00 0.00 177.39 178.71 2j8i s ARG 23 N -2.19 4.23 0.00 3.23 0.52 -0.95 -1.94 118.95 121.86 2j8i s ARG 23 Ca 0.37 2.35 0.00 0.00 -0.52 0.00 0.00 55.73 57.94 2j8i s ARG 23 Cb 0.38 -3.12 0.00 0.00 0.52 0.00 0.00 34.95 32.73 2j8i s ARG 23 CO -0.09 -0.52 0.00 0.41 0.02 0.00 0.00 175.30 175.12 2j8i n GLY 24 N 2.80 0.65 3.76 -3.53 0.00 0.37 -4.92 105.19 104.31 2j8i n GLY 24 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 2j8i n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 25 N -2.88 2.68 -0.86 4.61 0.00 -0.82 -4.69 121.76 119.80 2j8i s ALA 25 Ca 0.00 1.00 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 2j8i s ALA 25 Cb 0.00 -3.44 0.23 0.00 0.00 0.00 0.00 23.12 19.91 2j8i s ALA 25 CO 0.00 -1.03 0.82 0.08 0.00 0.00 0.00 175.76 175.62 2j8i s VAL 26 N -1.58 5.65 -0.20 0.00 1.01 -1.26 -0.24 120.40 123.78 2j8i s VAL 26 Ca 0.74 -2.58 0.15 0.00 0.00 0.00 0.00 61.98 60.29 2j8i s VAL 26 Cb -0.30 -4.49 0.34 0.00 0.00 0.00 0.00 36.38 31.93 2j8i s VAL 26 CO 0.34 -1.05 1.24 0.18 0.00 0.00 0.00 175.10 175.80 2j8i n LEU 27 N 3.85 2.90 -4.58 3.92 4.77 0.55 -4.65 117.00 123.75 2j8i n LEU 27 Ca 0.15 -2.84 -0.46 0.00 -0.03 0.00 0.00 56.01 52.84 2j8i n LEU 27 Cb 0.46 -0.40 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 2j8i n LEU 27 CO 0.35 0.67 0.60 1.21 -1.33 0.00 0.00 177.39 178.89 2j8i n GLU 28 N -0.83 1.29 -0.70 3.23 2.13 -0.76 -1.85 120.64 123.15 2j8i n GLU 28 Ca 0.16 0.45 0.00 0.00 0.66 0.00 0.00 57.16 58.43 2j8i n GLU 28 Cb 0.66 -1.85 0.00 0.00 0.27 0.00 0.00 31.44 30.53 2j8i n GLU 28 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2j8i n ASN 29 N 1.45 -1.62 -4.75 4.31 3.02 0.31 -4.93 115.26 113.06 2j8i n ASN 29 Ca 0.11 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.26 2j8i n ASN 29 Cb 0.30 -2.40 0.02 0.00 -0.61 0.00 0.00 39.78 37.09 2j8i n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j8i n ILE 30 N -2.04 2.73 -3.09 2.41 3.06 -0.77 -4.68 119.36 116.98 2j8i n ILE 30 Ca 0.00 -0.50 -0.43 0.00 -2.50 0.00 0.00 62.75 59.32 2j8i n ILE 30 Cb 0.12 -1.81 -0.06 0.00 0.54 0.00 0.00 39.64 38.43 2j8i n ILE 30 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 2j8i s ASN 31 N -0.47 6.30 -0.19 9.51 2.47 -1.26 -0.78 114.94 130.52 2j8i s ASN 31 Ca 0.61 -0.51 0.13 0.00 0.42 0.00 0.00 52.86 53.52 2j8i s ASN 31 Cb -0.46 -2.33 0.38 0.00 -1.45 0.00 0.00 41.25 37.40 2j8i s ASN 31 CO 0.58 -0.87 1.20 0.18 -3.72 0.00 0.00 177.10 174.47 2j8i n LEU 32 N 6.39 2.60 -4.69 3.21 4.77 0.70 -4.97 117.00 125.01 2j8i n LEU 32 Ca -0.03 -3.66 -0.44 0.00 -0.03 0.00 0.00 56.01 51.86 2j8i n LEU 32 Cb 0.47 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2j8i n LEU 32 CO 0.55 1.20 1.37 -1.54 -1.33 0.00 0.00 177.39 177.63 2j8i n SER 33 N -1.21 3.73 0.00 -1.43 3.41 -0.86 -1.44 113.62 115.82 2j8i n SER 33 Ca 0.18 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.83 2j8i n SER 33 Cb 0.68 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.12 2j8i n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j8i n GLY 34 N 3.93 1.57 3.77 5.00 0.00 0.02 -4.95 105.19 114.53 2j8i n GLY 34 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2j8i n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 35 N -3.66 3.27 -0.34 4.61 0.00 -0.52 -4.77 121.76 120.35 2j8i s ALA 35 Ca 0.00 1.32 -0.21 0.00 0.00 0.00 0.00 51.96 53.07 2j8i s ALA 35 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2j8i s ALA 35 CO 0.00 -0.96 0.66 0.42 0.00 0.00 0.00 175.76 175.88 2j8i s ILE 36 N -1.24 4.88 -0.15 0.00 1.01 0.10 -1.45 121.20 124.35 2j8i s ILE 36 Ca 0.58 0.72 0.16 0.00 0.00 0.00 0.00 60.65 62.10 2j8i s ILE 36 Cb -0.40 -4.08 0.42 0.00 0.01 0.00 0.00 42.46 38.42 2j8i s ILE 36 CO 0.52 -0.28 1.20 0.18 0.00 0.00 0.00 174.94 176.56 2j8i n LEU 37 N 6.06 2.22 -4.67 2.97 4.77 0.24 -1.18 117.00 127.40 2j8i n LEU 37 Ca -0.00 -3.33 -0.50 0.00 -0.03 0.00 0.00 56.01 52.14 2j8i n LEU 37 Cb 0.49 -0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2j8i n LEU 37 CO 0.49 1.14 1.31 1.57 -1.33 0.00 0.00 177.39 180.57 2j8i n HIS 38 N -0.61 2.14 -0.86 -1.77 -0.00 -0.59 -1.65 115.22 111.88 2j8i n HIS 38 Ca 0.15 0.27 0.00 0.00 0.46 0.00 0.00 57.72 58.60 2j8i n HIS 38 Cb 0.84 -2.55 0.00 0.00 -0.12 0.00 0.00 29.99 28.16 2j8i n HIS 38 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2j8i n GLY 39 N 3.88 0.47 3.74 1.57 0.00 -0.69 -0.20 105.19 113.96 2j8i n GLY 39 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 2j8i n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 40 N -2.30 2.52 -0.39 4.61 0.00 -0.66 -4.21 121.76 121.34 2j8i s ALA 40 Ca 0.00 1.16 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 2j8i s ALA 40 Cb 0.00 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.63 2j8i s ALA 40 CO 0.00 -1.38 0.24 -1.64 0.00 0.00 0.00 175.76 172.98 2j8i s MET 41 N -3.27 2.86 -0.13 0.00 -1.94 0.98 -1.74 119.30 116.06 2j8i s MET 41 Ca 0.79 -1.09 0.15 0.00 -1.71 0.00 0.00 55.69 53.83 2j8i s MET 41 Cb -0.35 -3.82 0.30 0.00 2.01 0.00 0.00 34.83 32.96 2j8i s MET 41 CO 0.38 -0.74 1.15 1.28 -0.01 0.00 0.00 175.02 177.09 2j8i n LEU 42 N 5.05 2.13 -4.62 -0.03 4.77 0.41 -0.72 117.00 123.98 2j8i n LEU 42 Ca -0.11 -3.02 -0.49 0.00 -0.03 0.00 0.00 56.01 52.36 2j8i n LEU 42 Cb 0.46 -0.39 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2j8i n LEU 42 CO 0.38 0.82 1.00 0.47 -1.33 0.00 0.00 177.39 178.73 2j8i n ASP 43 N -1.13 2.21 -1.74 -1.43 8.00 -1.05 -1.70 116.55 119.71 2j8i n ASP 43 Ca 0.15 1.11 -0.17 0.00 0.71 0.00 0.00 54.79 56.59 2j8i n ASP 43 Cb 0.68 -1.29 -0.05 0.00 -0.02 0.00 0.00 41.12 40.43 2j8i n ASP 43 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2j8i n GLU 44 N 2.74 -1.52 -2.19 -1.24 1.02 0.47 -0.48 120.64 119.44 2j8i n GLU 44 Ca 0.17 0.94 -0.36 0.00 -0.02 0.00 0.00 57.16 57.89 2j8i n GLU 44 Cb 0.24 -5.34 0.01 0.00 -0.02 0.00 0.00 31.44 26.32 2j8i n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2j8i s ALA 45 N -2.53 2.75 -0.60 0.62 0.00 -0.69 -3.96 121.76 117.35 2j8i s ALA 45 Ca 0.00 0.91 -0.21 0.00 0.00 0.00 0.00 51.96 52.67 2j8i s ALA 45 Cb 0.00 -3.39 0.08 0.00 0.00 0.00 0.00 23.12 19.81 2j8i s ALA 45 CO 0.00 -0.84 0.80 1.21 0.00 0.00 0.00 175.76 176.93 2j8i s ASN 46 N -1.59 6.20 -0.26 0.00 3.84 0.66 -0.86 114.94 122.93 2j8i s ASN 46 Ca 0.71 -1.12 0.11 0.00 0.21 0.00 0.00 52.86 52.77 2j8i s ASN 46 Cb -0.27 -2.35 0.53 0.00 -0.55 0.00 0.00 41.25 38.60 2j8i s ASN 46 CO 0.31 -1.21 1.48 0.18 -2.79 0.00 0.00 177.10 175.07 2j8i n LEU 47 N 6.89 4.22 -4.66 3.21 4.77 0.92 -0.33 117.00 132.02 2j8i n LEU 47 Ca -0.06 -3.48 -0.46 0.00 -0.03 0.00 0.00 56.01 51.97 2j8i n LEU 47 Cb 0.44 -0.62 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 2j8i n LEU 47 CO 0.60 1.03 1.08 0.00 -1.33 0.00 0.00 177.39 178.77 2j8i n GLN 48 N -0.90 1.98 -1.12 3.23 6.02 -0.88 -1.76 117.38 123.94 2j8i n GLN 48 Ca 0.31 0.71 -0.06 0.00 -0.01 0.00 0.00 57.00 57.95 2j8i n GLN 48 Cb 1.03 -2.42 -0.02 0.00 1.02 0.00 0.00 30.24 29.85 2j8i n GLN 48 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2j8i n GLN 49 N 2.76 -1.84 -2.16 -1.09 1.13 -0.33 -0.53 117.38 115.31 2j8i n GLN 49 Ca 0.15 0.67 -0.40 0.00 -1.94 0.00 0.00 57.00 55.48 2j8i n GLN 49 Cb 0.29 -5.06 -0.02 0.00 0.11 0.00 0.00 30.24 25.56 2j8i n GLN 49 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2j8i s ALA 50 N -1.43 3.32 -0.52 -1.58 0.00 -0.72 -4.22 121.76 116.59 2j8i s ALA 50 Ca 0.00 1.15 -0.25 0.00 0.00 0.00 0.00 51.96 52.87 2j8i s ALA 50 Cb 0.00 -3.45 0.04 0.00 0.00 0.00 0.00 23.12 19.71 2j8i s ALA 50 CO 0.00 -0.65 0.93 1.21 0.00 0.00 0.00 175.76 177.26 2j8i s ASN 51 N -0.77 6.39 -0.19 0.00 3.84 0.04 -0.40 114.94 123.85 2j8i s ASN 51 Ca 0.53 -0.20 0.13 0.00 0.21 0.00 0.00 52.86 53.54 2j8i s ASN 51 Cb -0.36 -2.44 0.39 0.00 -0.55 0.00 0.00 41.25 38.29 2j8i s ASN 51 CO 0.47 -1.17 1.22 0.18 -2.79 0.00 0.00 177.10 175.01 2j8i n LEU 52 N 7.36 2.74 -4.74 3.21 4.77 0.10 -0.21 117.00 130.23 2j8i n LEU 52 Ca 0.03 -3.63 -0.42 0.00 -0.03 0.00 0.00 56.01 51.96 2j8i n LEU 52 Cb 0.48 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 41.04 2j8i n LEU 52 CO 0.64 1.17 1.24 -0.94 -1.33 0.00 0.00 177.39 178.17 2j8i s SER 53 N -3.05 6.47 -0.36 -1.43 1.04 -0.93 -2.04 113.70 113.40 2j8i s SER 53 Ca 0.37 2.82 0.00 0.00 0.48 0.00 0.00 55.95 59.62 2j8i s SER 53 Cb 0.35 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.85 2j8i s SER 53 CO -0.03 -0.87 0.00 0.54 0.98 0.00 0.00 173.24 173.86 2j8i n ARG 54 N 2.92 -1.33 -2.58 4.02 5.12 -0.01 -0.80 116.66 123.99 2j8i n ARG 54 Ca 0.11 0.51 -0.38 0.00 -1.93 0.00 0.00 57.85 56.15 2j8i n ARG 54 Cb 0.38 -4.58 -0.05 0.00 -1.16 0.00 0.00 32.46 27.05 2j8i n ARG 54 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2j8i s ALA 55 N -1.58 3.24 -0.59 7.54 0.00 -0.86 -4.14 121.76 125.37 2j8i s ALA 55 Ca 0.00 0.73 -0.20 0.00 0.00 0.00 0.00 51.96 52.49 2j8i s ALA 55 Cb 0.00 -3.27 0.09 0.00 0.00 0.00 0.00 23.12 19.94 2j8i s ALA 55 CO 0.00 -0.08 0.74 0.34 0.00 0.00 0.00 175.76 176.76 2j8i s ASP 56 N -1.31 6.19 -0.20 0.00 2.15 -0.53 -0.61 116.67 122.37 2j8i s ASP 56 Ca 0.50 -1.24 0.16 0.00 0.43 0.00 0.00 52.55 52.40 2j8i s ASP 56 Cb -0.25 -2.32 0.64 0.00 -0.30 0.00 0.00 42.92 40.69 2j8i s ASP 56 CO 0.32 -1.13 1.55 0.18 -0.17 0.00 0.00 175.17 175.92 2j8i n LEU 57 N 6.56 4.60 -4.69 -1.34 4.77 0.92 0.81 117.00 128.63 2j8i n LEU 57 Ca -0.08 -2.96 -0.44 0.00 -0.03 0.00 0.00 56.01 52.50 2j8i n LEU 57 Cb 0.44 -0.60 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2j8i n LEU 57 CO 0.59 0.66 1.37 -1.54 -1.33 0.00 0.00 177.39 177.14 2j8i n SER 58 N -0.03 3.74 0.00 -1.43 3.41 -0.56 -1.60 113.62 117.16 2j8i n SER 58 Ca 0.24 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.89 2j8i n SER 58 Cb 1.01 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 2j8i n SER 58 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j8i n GLY 59 N 3.94 0.53 3.78 5.00 0.00 0.11 -1.70 105.19 116.85 2j8i n GLY 59 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2j8i n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 60 N -2.47 2.55 -0.21 4.61 0.00 -0.63 -3.97 121.76 121.64 2j8i s ALA 60 Ca 0.00 0.53 -0.06 0.00 0.00 0.00 0.00 51.96 52.43 2j8i s ALA 60 Cb 0.00 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2j8i s ALA 60 CO 0.00 -1.14 0.03 -0.08 0.00 0.00 0.00 175.76 174.57 2j8i s THR 61 N -2.33 4.19 -0.25 0.00 -1.32 -0.71 -0.47 115.64 114.75 2j8i s THR 61 Ca 0.67 -0.23 0.13 0.00 -1.21 0.00 0.00 61.69 61.05 2j8i s THR 61 Cb -0.20 -2.91 0.46 0.00 -1.51 0.00 0.00 72.50 68.35 2j8i s THR 61 CO 0.39 0.41 1.17 0.18 -2.21 0.00 0.00 174.62 174.57 2j8i n LEU 62 N 4.30 3.44 -4.57 9.08 4.77 0.12 -0.44 117.00 133.70 2j8i n LEU 62 Ca -0.17 -3.97 -0.49 0.00 -0.03 0.00 0.00 56.01 51.35 2j8i n LEU 62 Cb 0.52 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 2j8i n LEU 62 CO 0.32 1.61 1.68 0.59 -1.33 0.00 0.00 177.39 180.25 2j8i n ASN 63 N -0.65 2.80 -0.77 -1.43 4.13 -1.21 -1.25 115.26 116.87 2j8i n ASN 63 Ca 0.28 0.60 -0.10 0.00 1.68 0.00 0.00 54.58 57.04 2j8i n ASN 63 Cb 0.90 -1.35 -0.04 0.00 -1.54 0.00 0.00 39.78 37.75 2j8i n ASN 63 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2j8i n GLY 64 N 5.54 1.03 3.81 7.41 0.00 -0.46 -0.39 105.19 122.14 2j8i n GLY 64 Ca 0.32 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 2j8i n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 65 N -2.37 2.90 -0.45 4.61 0.00 -0.38 -3.97 121.76 122.10 2j8i s ALA 65 Ca 0.00 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 2j8i s ALA 65 Cb 0.00 -3.20 0.08 0.00 0.00 0.00 0.00 23.12 20.00 2j8i s ALA 65 CO 0.00 -0.35 0.33 0.34 0.00 0.00 0.00 175.76 176.08 2j8i s ASP 66 N -2.44 5.86 -0.19 0.00 -1.08 -0.04 -0.95 116.67 117.83 2j8i s ASP 66 Ca 0.64 -1.47 0.16 0.00 -0.52 0.00 0.00 52.55 51.36 2j8i s ASP 66 Cb -0.14 -2.07 0.52 0.00 -1.46 0.00 0.00 42.92 39.77 2j8i s ASP 66 CO 0.25 -0.60 1.41 0.18 0.52 0.00 0.00 175.17 176.93 2j8i n LEU 67 N 5.04 3.84 -4.67 -1.34 4.77 0.40 -0.05 117.00 124.98 2j8i n LEU 67 Ca -0.11 -3.08 -0.46 0.00 -0.03 0.00 0.00 56.01 52.33 2j8i n LEU 67 Cb 0.43 -0.55 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 2j8i n LEU 67 CO 0.43 0.72 1.28 0.54 -1.33 0.00 0.00 177.39 179.03 2j8i n ARG 68 N -0.61 2.23 -1.42 3.23 1.74 -1.05 -2.06 116.66 118.72 2j8i n ARG 68 Ca 0.22 0.81 -0.14 0.00 -0.77 0.00 0.00 57.85 57.96 2j8i n ARG 68 Cb 0.90 -2.60 -0.06 0.00 -1.02 0.00 0.00 32.46 29.67 2j8i n ARG 68 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2j8i n GLY 69 N 3.70 1.40 3.79 -0.13 0.00 -0.91 -1.19 105.19 111.85 2j8i n GLY 69 Ca 0.18 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2j8i n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 70 N -2.27 2.99 -0.50 4.61 0.00 -0.87 -3.86 121.76 121.84 2j8i s ALA 70 Ca 0.00 0.66 -0.18 0.00 0.00 0.00 0.00 51.96 52.44 2j8i s ALA 70 Cb 0.00 -3.26 0.07 0.00 0.00 0.00 0.00 23.12 19.93 2j8i s ALA 70 CO 0.00 -0.25 0.56 1.21 0.00 0.00 0.00 175.76 177.28 2j8i s ASN 71 N -1.76 6.20 -0.39 0.00 3.84 0.47 -0.72 114.94 122.57 2j8i s ASN 71 Ca 0.62 -1.09 0.06 0.00 0.21 0.00 0.00 52.86 52.66 2j8i s ASN 71 Cb -0.19 -2.26 0.55 0.00 -0.55 0.00 0.00 41.25 38.80 2j8i s ASN 71 CO 0.24 -0.84 1.66 0.18 -2.79 0.00 0.00 177.10 175.55 2j8i n LEU 72 N 5.88 5.45 -4.70 3.21 4.77 0.72 0.03 117.00 132.35 2j8i n LEU 72 Ca -0.09 -3.87 -0.42 0.00 -0.03 0.00 0.00 56.01 51.60 2j8i n LEU 72 Cb 0.45 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 40.79 2j8i n LEU 72 CO 0.52 1.30 1.34 -0.44 -1.33 0.00 0.00 177.39 178.78 2j8i s SER 73 N -2.15 6.52 -2.13 -1.43 0.01 -1.16 -2.23 113.70 111.13 2j8i s SER 73 Ca 0.52 2.66 0.00 0.00 1.31 0.00 0.00 55.95 60.43 2j8i s SER 73 Cb 0.44 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 64.09 2j8i s SER 73 CO 0.03 -0.91 0.00 0.29 0.41 0.00 0.00 173.24 173.06 2j8i n LYS 74 N 4.79 -1.45 -2.71 12.44 5.02 -0.10 -0.83 118.16 135.32 2j8i n LYS 74 Ca 0.16 1.19 -0.34 0.00 -2.02 0.00 0.00 58.31 57.30 2j8i n LYS 74 Cb 0.38 -5.56 -0.06 0.00 -0.02 0.00 0.00 35.03 29.77 2j8i n LYS 74 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j8i s ALA 75 N -2.70 2.99 -0.41 7.82 0.00 -0.95 -3.98 121.76 124.54 2j8i s ALA 75 Ca 0.00 0.49 -0.17 0.00 0.00 0.00 0.00 51.96 52.29 2j8i s ALA 75 Cb 0.00 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 19.94 2j8i s ALA 75 CO 0.00 -0.04 0.41 0.34 0.00 0.00 0.00 175.76 176.47 2j8i s ASP 76 N -2.05 6.19 -0.19 0.00 -1.08 0.22 -0.54 116.67 119.22 2j8i s ASP 76 Ca 0.63 -0.61 0.16 0.00 -0.52 0.00 0.00 52.55 52.21 2j8i s ASP 76 Cb -0.13 -2.21 0.57 0.00 -1.46 0.00 0.00 42.92 39.69 2j8i s ASP 76 CO 0.17 -0.52 1.47 0.18 0.52 0.00 0.00 175.17 176.98 2j8i n LEU 77 N 5.52 4.13 -4.69 -1.34 4.77 0.81 -0.05 117.00 126.15 2j8i n LEU 77 Ca -0.08 -3.04 -0.54 0.00 -0.03 0.00 0.00 56.01 52.31 2j8i n LEU 77 Cb 0.48 -0.57 -0.06 0.00 -2.33 0.00 0.00 43.42 40.94 2j8i n LEU 77 CO 0.45 0.69 1.30 -1.20 -1.33 0.00 0.00 177.39 177.29 2j8i n SER 78 N -0.41 2.53 -0.56 -1.43 7.64 -0.94 -1.82 113.62 118.63 2j8i n SER 78 Ca 0.23 1.06 -0.07 0.00 1.01 0.00 0.00 58.87 61.10 2j8i n SER 78 Cb 0.94 -1.21 -0.03 0.00 -1.01 0.00 0.00 64.21 62.90 2j8i n SER 78 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2j8i n ASP 79 N 5.16 -5.53 -4.77 6.43 8.00 -1.26 0.09 116.55 124.66 2j8i n ASP 79 Ca 0.24 0.18 -0.38 0.00 0.71 0.00 0.00 54.79 55.54 2j8i n ASP 79 Cb 0.18 -3.68 -0.03 0.00 -0.02 0.00 0.00 41.12 37.57 2j8i n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j8i s ALA 80 N -1.72 3.17 -0.40 2.24 0.00 -0.75 -3.67 121.76 120.63 2j8i s ALA 80 Ca 0.00 0.89 -0.18 0.00 0.00 0.00 0.00 51.96 52.68 2j8i s ALA 80 Cb 0.00 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 19.79 2j8i s ALA 80 CO 0.00 -0.40 0.47 0.42 0.00 0.00 0.00 175.76 176.25 2j8i s ILE 81 N -1.44 5.05 -1.03 0.00 1.01 0.38 -4.90 121.20 120.26 2j8i s ILE 81 Ca 0.55 -0.09 0.10 0.00 0.00 0.00 0.00 60.65 61.22 2j8i s ILE 81 Cb -0.29 -4.01 0.20 0.00 0.01 0.00 0.00 42.46 38.37 2j8i s ILE 81 CO 0.36 -0.35 1.06 0.18 0.00 0.00 0.00 174.94 176.19 2j8i n LEU 82 N 5.68 2.43 -4.68 2.97 4.77 -1.26 0.13 117.00 127.05 2j8i n LEU 82 Ca -0.06 -1.58 -0.60 0.00 -0.03 0.00 0.00 56.01 53.74 2j8i n LEU 82 Cb 0.48 -0.12 -0.08 0.00 -2.33 0.00 0.00 43.42 41.37 2j8i n LEU 82 CO 0.46 0.56 1.11 0.47 -1.33 0.00 0.00 177.39 178.66 2j8i n ASP 83 N 0.49 1.58 0.00 -1.43 8.00 -1.26 -0.78 116.55 123.14 2j8i n ASP 83 Ca 0.09 1.13 0.00 0.00 0.71 0.00 0.00 54.79 56.72 2j8i n ASP 83 Cb 0.35 -1.03 0.00 0.00 -0.02 0.00 0.00 41.12 40.41 2j8i n ASP 83 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2j8i n ASN 84 N 3.99 -4.18 -4.76 -2.24 3.02 -1.26 -1.35 115.26 108.47 2j8i n ASN 84 Ca 0.26 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.40 2j8i n ASN 84 Cb 0.07 -2.50 -0.03 0.00 -0.61 0.00 0.00 39.78 36.70 2j8i n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j8i s ALA 85 N -1.38 3.44 -0.31 5.41 0.00 0.04 -3.74 121.76 125.23 2j8i s ALA 85 Ca 0.00 1.06 -0.15 0.00 0.00 0.00 0.00 51.96 52.87 2j8i s ALA 85 Cb 0.00 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2j8i s ALA 85 CO 0.00 -0.38 0.36 0.42 0.00 0.00 0.00 175.76 176.16 2j8i s ILE 86 N -1.16 5.18 -1.09 0.00 1.01 -0.13 -4.92 121.20 120.09 2j8i s ILE 86 Ca 0.47 0.30 0.10 0.00 0.00 0.00 0.00 60.65 61.52 2j8i s ILE 86 Cb -0.35 -3.75 0.20 0.00 0.01 0.00 0.00 42.46 38.57 2j8i s ILE 86 CO 0.46 0.04 1.06 0.18 0.00 0.00 0.00 174.94 176.68 2j8i n LEU 87 N 5.35 2.44 -4.69 2.97 4.77 -1.26 -0.45 117.00 126.12 2j8i n LEU 87 Ca -0.09 -1.55 -0.43 0.00 -0.03 0.00 0.00 56.01 53.91 2j8i n LEU 87 Cb 0.50 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 2j8i n LEU 87 CO 0.38 0.56 1.46 -0.62 -1.33 0.00 0.00 177.39 177.84 2j8i n GLU 88 N 0.53 2.73 -0.71 3.23 1.02 -1.26 -1.68 120.64 124.49 2j8i n GLU 88 Ca 0.09 0.99 0.00 0.00 -0.02 0.00 0.00 57.16 58.22 2j8i n GLU 88 Cb 0.35 -2.87 0.00 0.00 -0.02 0.00 0.00 31.44 28.90 2j8i n GLU 88 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j8i n GLY 89 N 4.18 1.27 3.80 0.62 0.00 -1.26 -2.13 105.19 111.67 2j8i n GLY 89 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2j8i n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j8i s ALA 90 N -3.59 2.85 -0.36 4.61 0.00 -0.68 -3.65 121.76 120.94 2j8i s ALA 90 Ca 0.00 0.57 -0.17 0.00 0.00 0.00 0.00 51.96 52.36 2j8i s ALA 90 Cb 0.00 -3.25 -0.00 0.00 0.00 0.00 0.00 23.12 19.87 2j8i s ALA 90 CO 0.00 -0.40 0.45 0.42 0.00 0.00 0.00 175.76 176.23 2j8i s ILE 91 N -2.07 5.07 -0.54 0.00 1.01 0.10 -4.92 121.20 119.86 2j8i s ILE 91 Ca 0.67 0.11 0.10 0.00 0.00 0.00 0.00 60.65 61.53 2j8i s ILE 91 Cb -0.16 -3.94 0.28 0.00 0.01 0.00 0.00 42.46 38.65 2j8i s ILE 91 CO 0.23 -0.22 1.22 0.18 0.00 0.00 0.00 174.94 176.35 2j8i n LEU 92 N 5.61 2.87 -4.68 2.97 4.77 -1.26 -0.20 117.00 127.08 2j8i n LEU 92 Ca -0.07 -2.26 -0.46 0.00 -0.03 0.00 0.00 56.01 53.19 2j8i n LEU 92 Cb 0.49 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2j8i n LEU 92 CO 0.44 0.67 1.37 0.47 -1.33 0.00 0.00 177.39 179.01 2j8i n ASP 93 N -0.02 3.40 -0.35 -1.43 8.00 -1.26 -1.74 116.55 123.16 2j8i n ASP 93 Ca 0.11 1.02 -0.05 0.00 0.71 0.00 0.00 54.79 56.58 2j8i n ASP 93 Cb 0.49 -1.42 -0.02 0.00 -0.02 0.00 0.00 41.12 40.15 2j8i n ASP 93 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2j8i n GLU 94 N 5.21 -1.57 -1.73 -1.24 1.02 -1.26 -0.92 120.64 120.15 2j8i n GLU 94 Ca 0.20 0.60 -0.42 0.00 -0.02 0.00 0.00 57.16 57.52 2j8i n GLU 94 Cb 0.31 -4.86 -0.01 0.00 -0.02 0.00 0.00 31.44 26.85 2j8i n GLU 94 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2j8i n ALA 95 N 1.08 1.86 -2.59 0.62 0.00 -0.71 -4.09 120.51 116.69 2j8i n ALA 95 Ca -0.05 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 2j8i n ALA 95 Cb 0.46 -2.35 -0.05 0.00 0.00 0.00 0.00 19.45 17.51 2j8i n ALA 95 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2j8i s VAL 96 N -0.73 4.77 -0.61 0.00 1.01 0.30 -4.91 120.40 120.24 2j8i s VAL 96 Ca 0.58 0.90 0.21 0.00 0.00 0.00 0.00 61.98 63.67 2j8i s VAL 96 Cb -0.54 -4.17 -0.27 0.00 0.00 0.00 0.00 36.38 31.41 2j8i s VAL 96 CO 0.58 -0.37 0.72 0.18 0.00 0.00 0.00 175.10 176.21 2j8i n LEU 97 N 6.30 0.59 0.00 3.92 4.77 -1.26 -0.14 117.00 131.19 2j8i n LEU 97 Ca 0.02 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2j8i n LEU 97 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2j8i n LEU 97 CO 0.52 0.15 0.00 0.59 -1.33 0.00 0.00 177.39 177.32