#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j9d s SER 0 N 0.00 6.78 0.03 1.61 0.15 -1.26 -5.02 113.70 115.98 2j9d s SER 0 Ca 0.00 0.93 0.05 0.00 0.70 0.00 0.00 55.95 57.62 2j9d s SER 0 Cb 0.00 -2.32 -0.03 0.00 -1.71 0.00 0.00 66.02 61.96 2j9d s SER 0 CO 0.00 -0.00 -0.08 -0.04 1.20 0.00 0.00 173.24 174.31 2j9d s MET 1 N 0.53 2.41 0.02 5.44 1.00 -1.26 -1.62 119.30 125.82 2j9d s MET 1 Ca 0.29 -0.82 0.02 0.00 0.00 0.00 0.00 55.69 55.18 2j9d s MET 1 Cb -0.16 -2.43 -0.01 0.00 0.00 0.00 0.00 34.83 32.23 2j9d s MET 1 CO 0.13 0.57 -0.07 0.15 0.00 0.00 0.00 175.02 175.80 2j9d s LYS 2 N -1.61 0.54 -0.23 2.03 -0.14 -0.03 -1.80 119.74 118.49 2j9d s LYS 2 Ca 0.18 -0.46 -0.13 0.00 -1.36 0.00 0.00 55.97 54.20 2j9d s LYS 2 Cb -0.11 -0.44 -0.04 0.00 -1.68 0.00 0.00 37.83 35.55 2j9d s LYS 2 CO 0.09 0.11 0.28 0.21 -0.76 0.00 0.00 175.35 175.28 2j9d s LYS 3 N -0.76 4.09 -0.32 1.68 2.20 0.58 -0.73 119.74 126.48 2j9d s LYS 3 Ca -0.02 -0.05 -0.13 0.00 -0.36 0.00 0.00 55.97 55.41 2j9d s LYS 3 Cb -0.06 -3.56 -0.03 0.00 -1.51 0.00 0.00 37.83 32.68 2j9d s LYS 3 CO 0.00 -0.04 0.25 0.08 -0.36 0.00 0.00 175.35 175.28 2j9d s VAL 4 N 1.33 5.27 -0.17 4.02 1.01 0.95 -0.90 120.40 131.91 2j9d s VAL 4 Ca 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 61.98 62.04 2j9d s VAL 4 Cb -0.14 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 2j9d s VAL 4 CO 0.07 0.06 -0.04 -1.61 0.00 0.00 0.00 175.10 173.58 2j9d s GLU 5 N 1.79 3.59 -0.09 2.72 2.02 0.22 -0.80 118.70 128.14 2j9d s GLU 5 Ca 0.07 -0.55 0.04 0.00 0.02 0.00 0.00 54.97 54.55 2j9d s GLU 5 Cb -0.17 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.12 2j9d s GLU 5 CO 0.11 0.11 -0.22 0.00 0.02 0.00 0.00 175.26 175.28 2j9d s ALA 6 N 0.70 2.01 -0.33 5.21 0.00 0.11 -0.10 121.76 129.36 2j9d s ALA 6 Ca -0.02 -0.89 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 2j9d s ALA 6 Cb -0.14 -0.74 0.02 0.00 0.00 0.00 0.00 23.12 22.25 2j9d s ALA 6 CO 0.02 0.28 0.12 0.42 0.00 0.00 0.00 175.76 176.60 2j9d s ILE 7 N 0.30 4.06 0.33 0.00 -1.09 -0.18 -0.61 121.20 124.02 2j9d s ILE 7 Ca -0.16 -0.86 0.03 0.00 -2.23 0.00 0.00 60.65 57.44 2j9d s ILE 7 Cb -0.17 -3.20 -0.05 0.00 -1.58 0.00 0.00 42.46 37.47 2j9d s ILE 7 CO 0.07 -0.07 0.10 0.27 -1.23 0.00 0.00 174.94 174.09 2j9d s ILE 8 N 1.48 0.74 0.22 2.92 -4.36 -0.12 -2.43 121.20 119.65 2j9d s ILE 8 Ca 0.01 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.10 2j9d s ILE 8 Cb -0.18 -2.59 -0.10 0.00 1.25 0.00 0.00 42.46 40.84 2j9d s ILE 8 CO 0.04 0.00 1.41 -0.13 0.24 0.00 0.00 174.94 176.50 2j9d s ARG 9 N -3.86 4.30 0.46 0.37 0.52 -1.26 -1.16 118.95 118.32 2j9d s ARG 9 Ca 0.33 2.23 0.16 0.00 -0.52 0.00 0.00 55.73 57.93 2j9d s ARG 9 Cb 0.06 -3.14 1.12 0.00 0.52 0.00 0.00 34.95 33.51 2j9d s ARG 9 CO 0.15 -0.39 2.01 -1.35 0.02 0.00 0.00 175.30 175.74 2j9d h PRO 10 N 5.35 0.28 0.00 3.54 0.11 -1.88 -0.78 132.00 138.61 2j9d h PRO 10 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2j9d h PRO 10 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2j9d h PRO 10 CO 0.79 0.19 0.00 -0.85 -0.21 0.00 0.00 178.00 177.92 2j9d n GLU 11 N -4.46 0.15 0.00 1.05 0.00 -1.26 -2.69 120.64 113.43 2j9d n GLU 11 Ca 0.08 0.14 0.12 0.00 0.00 0.00 0.00 57.16 57.49 2j9d n GLU 11 Cb 0.37 -1.50 0.10 0.00 0.00 0.00 0.00 31.44 30.41 2j9d n GLU 11 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2j9d n LYS 12 N -1.38 1.24 -0.02 3.44 4.76 -0.30 -4.55 118.16 121.34 2j9d n LYS 12 Ca 0.07 -0.97 -0.10 0.00 -2.87 0.00 0.00 58.31 54.44 2j9d n LYS 12 Cb 0.19 -1.48 -0.04 0.00 -1.84 0.00 0.00 35.03 31.85 2j9d n LYS 12 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2j9d h LEU 13 N 2.36 0.03 -0.22 -0.35 5.85 -1.57 -1.93 115.31 119.48 2j9d h LEU 13 Ca 0.00 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2j9d h LEU 13 Cb 0.72 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2j9d h LEU 13 CO 0.00 0.04 0.14 -0.08 -0.34 0.00 0.00 178.44 178.20 2j9d h GLU 14 N 0.10 0.30 -0.47 1.25 4.57 -1.82 0.61 114.58 119.13 2j9d h GLU 14 Ca 0.06 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.14 2j9d h GLU 14 Cb 0.04 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2j9d h GLU 14 CO -0.07 0.24 0.01 0.97 -1.18 0.00 0.00 179.01 178.98 2j9d h ILE 15 N 0.28 1.26 -0.37 2.32 6.09 -1.85 -1.60 117.51 123.64 2j9d h ILE 15 Ca 0.08 -1.03 -0.03 0.00 -1.37 0.00 0.00 64.86 62.51 2j9d h ILE 15 Cb 0.01 1.01 -0.02 0.00 0.47 0.00 0.00 36.82 38.29 2j9d h ILE 15 CO -0.02 0.36 0.12 0.58 -3.07 0.00 0.00 178.15 176.12 2j9d h VAL 16 N 0.67 1.21 -0.38 2.19 2.07 -1.14 -1.27 116.25 119.59 2j9d h VAL 16 Ca 0.13 -0.68 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 2j9d h VAL 16 Cb 0.48 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 2j9d h VAL 16 CO 0.02 0.24 -0.11 0.07 0.02 0.00 0.00 177.57 177.81 2j9d h LYS 17 N 0.45 0.67 0.12 1.57 2.10 -0.78 -0.51 116.57 120.19 2j9d h LYS 17 Ca 0.12 -0.21 -0.01 0.00 -2.00 0.00 0.00 60.65 58.55 2j9d h LYS 17 Cb 0.25 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 2j9d h LYS 17 CO -0.00 0.76 -0.06 -0.22 -2.00 0.00 0.00 179.45 177.93 2j9d h LYS 18 N 0.61 -0.16 -0.74 0.07 1.63 -1.17 -0.40 116.57 116.41 2j9d h LYS 18 Ca 0.11 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.97 2j9d h LYS 18 Cb 0.55 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 32.16 2j9d h LYS 18 CO 0.03 0.01 0.44 0.00 -3.45 0.00 0.00 179.45 176.49 2j9d h ALA 19 N 0.55 0.99 -0.39 5.00 0.00 -1.07 0.95 119.26 125.28 2j9d h ALA 19 Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2j9d h ALA 19 Cb 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2j9d h ALA 19 CO 0.03 0.18 0.16 -0.07 0.00 0.00 0.00 179.25 179.55 2j9d h LEU 20 N 0.83 0.54 -0.52 0.00 3.38 -0.99 -2.46 115.31 116.10 2j9d h LEU 20 Ca 0.31 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2j9d h LEU 20 Cb 0.12 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2j9d h LEU 20 CO -0.15 0.55 0.30 -1.28 0.09 0.00 0.00 178.44 177.95 2j9d h SER 21 N 0.49 0.63 -0.13 -0.43 0.87 -0.52 -0.06 113.55 114.40 2j9d h SER 21 Ca 0.13 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2j9d h SER 21 Cb 0.18 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2j9d h SER 21 CO -0.01 0.52 0.09 -0.78 -0.53 0.00 0.00 176.83 176.12 2j9d h ASP 22 N 0.69 0.12 -0.12 6.23 1.82 -0.71 -1.10 116.42 123.35 2j9d h ASP 22 Ca 0.18 -0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.82 2j9d h ASP 22 Cb 0.02 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.00 2j9d h ASP 22 CO -0.03 0.09 0.00 0.00 -1.61 0.00 0.00 179.24 177.69 2j9d n ALA 23 N -2.53 2.54 -0.17 -0.78 0.00 -0.94 -4.92 120.51 113.71 2j9d n ALA 23 Ca -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.97 2j9d n ALA 23 Cb 0.10 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2j9d n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j9d n GLY 24 N 1.10 0.77 3.31 0.00 0.00 -0.41 -5.03 105.19 104.92 2j9d n GLY 24 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.72 2j9d n GLY 24 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j9d s TYR 25 N -2.16 3.73 -0.15 1.61 1.51 -0.08 -4.86 117.35 116.97 2j9d s TYR 25 Ca 0.00 -2.05 0.17 0.00 -1.01 0.00 0.00 57.07 54.18 2j9d s TYR 25 Cb 0.00 -3.77 -0.24 0.00 -0.11 0.00 0.00 41.96 37.84 2j9d s TYR 25 CO 0.00 -0.98 0.28 0.28 -1.11 0.00 0.00 175.55 174.02 2j9d n VAL 26 N 3.94 1.37 -2.55 0.71 0.31 -1.26 -3.32 118.33 117.52 2j9d n VAL 26 Ca 0.13 -0.82 -0.43 0.00 -0.01 0.00 0.00 64.34 63.21 2j9d n VAL 26 Cb 0.46 -0.60 -0.02 0.00 -0.91 0.00 0.00 33.84 32.77 2j9d n VAL 26 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2j9d s GLY 27 N -5.31 1.27 0.03 2.92 0.00 -1.26 -4.99 107.32 99.98 2j9d s GLY 27 Ca -0.08 -0.39 -0.10 0.00 0.00 0.00 0.00 44.72 44.15 2j9d s GLY 27 CO 0.83 2.48 0.21 -3.16 0.00 0.00 0.00 173.10 173.46 2j9d s MET 28 N 4.50 0.67 -0.08 2.90 0.00 -1.26 -4.62 119.30 121.41 2j9d s MET 28 Ca 0.50 -0.52 0.02 0.00 0.00 0.00 0.00 55.69 55.69 2j9d s MET 28 Cb -0.09 0.28 -0.02 0.00 0.00 0.00 0.00 34.83 35.00 2j9d s MET 28 CO 0.31 -0.19 -0.14 0.99 0.00 0.00 0.00 175.02 175.99 2j9d s THR 29 N -2.21 3.03 -0.10 3.16 2.01 -0.02 -4.97 115.64 116.55 2j9d s THR 29 Ca -0.08 -0.71 0.03 0.00 0.31 0.00 0.00 61.69 61.24 2j9d s THR 29 Cb -0.03 -2.21 0.01 0.00 0.01 0.00 0.00 72.50 70.28 2j9d s THR 29 CO -0.02 0.57 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.62 2j9d s VAL 30 N -0.35 1.60 0.12 3.82 1.01 -1.26 -0.44 120.40 124.90 2j9d s VAL 30 Ca 0.03 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.36 2j9d s VAL 30 Cb -0.12 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2j9d s VAL 30 CO 0.02 0.46 -0.16 -0.44 0.00 0.00 0.00 175.10 174.98 2j9d s SER 31 N 0.72 2.22 -0.14 3.32 0.01 -0.21 -4.99 113.70 114.64 2j9d s SER 31 Ca -0.12 -0.77 -0.19 0.00 1.31 0.00 0.00 55.95 56.18 2j9d s SER 31 Cb -0.16 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 2j9d s SER 31 CO 0.03 -0.07 0.54 -1.61 0.41 0.00 0.00 173.24 172.54 2j9d s GLU 32 N -2.41 4.30 0.40 12.44 2.02 -1.26 -0.69 118.70 133.49 2j9d s GLU 32 Ca 0.08 0.53 0.06 0.00 0.02 0.00 0.00 54.97 55.66 2j9d s GLU 32 Cb -0.07 -3.49 -0.02 0.00 0.10 0.00 0.00 34.13 30.65 2j9d s GLU 32 CO 0.04 0.01 0.20 0.14 0.02 0.00 0.00 175.26 175.67 2j9d s VAL 33 N 1.08 0.31 0.01 2.63 -7.23 -0.48 -4.93 120.40 111.79 2j9d s VAL 33 Ca 0.28 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.50 2j9d s VAL 33 Cb -0.16 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 2j9d s VAL 33 CO 0.11 0.00 -0.17 -0.54 -0.31 0.00 0.00 175.10 174.19 2j9d s LYS 34 N -3.55 1.30 0.24 4.82 1.02 -1.26 -1.04 119.74 121.27 2j9d s LYS 34 Ca 0.28 -0.70 0.01 0.00 0.02 0.00 0.00 55.97 55.59 2j9d s LYS 34 Cb 0.01 -1.29 -0.04 0.00 -0.52 0.00 0.00 37.83 35.99 2j9d s LYS 34 CO 0.20 0.34 0.14 0.20 -0.92 0.00 0.00 175.35 175.32 2j9d s GLY 35 N -0.68 1.69 0.49 -3.33 0.00 0.02 -4.88 107.32 100.62 2j9d s GLY 35 Ca 0.06 -1.78 -0.22 0.00 0.00 0.00 0.00 44.72 42.77 2j9d s GLY 35 CO 0.00 -1.48 1.21 1.09 0.00 0.00 0.00 173.10 173.92 2j9d s ARG 36 N -4.01 3.58 1.03 2.90 1.04 -1.26 -0.07 118.95 122.16 2j9d s ARG 36 Ca 0.38 1.89 -0.17 0.00 -1.04 0.00 0.00 55.73 56.79 2j9d s ARG 36 Cb 0.06 -2.35 0.22 0.00 -2.04 0.00 0.00 34.95 30.84 2j9d s ARG 36 CO 0.15 -0.73 1.23 0.20 -0.04 0.00 0.00 175.30 176.10 2j9d s GLY 37 N -1.27 1.69 0.18 3.88 0.00 -1.26 -4.75 107.32 105.78 2j9d s GLY 37 Ca 0.66 -1.03 -0.03 0.00 0.00 0.00 0.00 44.72 44.32 2j9d s GLY 37 CO 0.38 -0.25 1.49 -0.24 0.00 0.00 0.00 173.10 174.47 2j9d h VAL 38 N -1.93 1.33 -1.95 1.40 3.04 -1.96 -3.50 116.25 112.68 2j9d h VAL 38 Ca -0.45 -1.85 0.18 0.00 -1.01 0.00 0.00 66.70 63.57 2j9d h VAL 38 Cb 1.27 1.83 -0.10 0.00 -2.01 0.00 0.00 31.29 32.28 2j9d h VAL 38 CO 0.40 0.57 -0.70 0.00 -1.01 0.00 0.00 177.57 176.84 2j9d n GLN 39 N -3.94 -1.88 0.00 4.17 10.64 -1.26 -5.06 117.38 120.05 2j9d n GLN 39 Ca -0.03 1.53 0.00 0.00 -1.83 0.00 0.00 57.00 56.67 2j9d n GLN 39 Cb 0.62 -2.16 0.00 0.00 -0.86 0.00 0.00 30.24 27.84 2j9d n GLN 39 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.06 176.78 2j9d n VAL 53 N -3.21 0.00 -1.98 -0.39 3.14 -1.26 -5.27 118.33 109.36 2j9d n VAL 53 Ca -0.05 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 60.96 2j9d n VAL 53 Cb 0.37 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.17 2j9d n VAL 53 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 2j9d s ASP 54 N 0.00 5.55 0.64 6.55 1.11 -1.26 -5.00 116.67 124.26 2j9d s ASP 54 Ca 0.00 2.55 -0.13 0.00 0.18 0.00 0.00 52.55 55.15 2j9d s ASP 54 Cb 0.00 -2.62 -0.02 0.00 1.07 0.00 0.00 42.92 41.36 2j9d s ASP 54 CO 0.00 -1.36 1.06 -0.76 1.18 0.00 0.00 175.17 175.29 2j9d s LEU 55 N -3.45 3.32 0.27 1.23 1.43 -1.26 -4.39 118.68 115.83 2j9d s LEU 55 Ca 0.70 1.70 0.10 0.00 -1.03 0.00 0.00 54.13 55.60 2j9d s LEU 55 Cb -0.35 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.31 2j9d s LEU 55 CO 0.41 -1.28 -0.15 0.27 0.23 0.00 0.00 176.35 175.83 2j9d s ILE 56 N -2.76 2.14 0.25 -0.59 -4.36 0.90 -4.87 121.20 111.91 2j9d s ILE 56 Ca 0.61 -2.29 -0.30 0.00 -0.26 0.00 0.00 60.65 58.41 2j9d s ILE 56 Cb -0.15 -2.31 -0.10 0.00 1.25 0.00 0.00 42.46 41.16 2j9d s ILE 56 CO 0.46 -0.41 1.37 -2.84 0.24 0.00 0.00 174.94 173.76 2j9d s PRO 57 N -3.59 4.33 0.19 0.37 0.02 -1.26 -0.80 135.00 134.25 2j9d s PRO 57 Ca 0.28 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.51 2j9d s PRO 57 Cb -0.02 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.33 2j9d s PRO 57 CO 0.13 -0.31 0.07 0.15 -0.33 0.00 0.00 177.00 176.70 2j9d s LYS 58 N -0.61 1.15 -0.08 5.54 -0.14 -0.20 -4.55 119.74 120.84 2j9d s LYS 58 Ca 0.56 -1.58 0.02 0.00 -1.36 0.00 0.00 55.97 53.61 2j9d s LYS 58 Cb -0.40 -0.01 -0.02 0.00 -1.68 0.00 0.00 37.83 35.73 2j9d s LYS 58 CO 0.44 -0.26 -0.15 0.08 -0.76 0.00 0.00 175.35 174.70 2j9d s VAL 59 N -3.90 2.96 -0.26 3.17 1.01 -0.31 -1.38 120.40 121.70 2j9d s VAL 59 Ca 0.30 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 2j9d s VAL 59 Cb 0.07 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 2j9d s VAL 59 CO 0.07 0.56 0.12 -0.75 0.00 0.00 0.00 175.10 175.11 2j9d s LYS 60 N -0.24 3.81 -0.17 2.72 2.20 0.13 -0.95 119.74 127.24 2j9d s LYS 60 Ca 0.01 -0.40 -0.06 0.00 -0.36 0.00 0.00 55.97 55.16 2j9d s LYS 60 Cb -0.13 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.69 2j9d s LYS 60 CO 0.03 -0.15 0.02 0.42 -0.36 0.00 0.00 175.35 175.31 2j9d s ILE 61 N 1.58 4.37 -0.13 5.43 1.01 0.22 -1.04 121.20 132.63 2j9d s ILE 61 Ca 0.06 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.56 2j9d s ILE 61 Cb -0.15 -2.95 0.01 0.00 0.01 0.00 0.00 42.46 39.38 2j9d s ILE 61 CO 0.06 0.47 -0.22 -1.61 0.00 0.00 0.00 174.94 173.65 2j9d s GLU 62 N 0.40 3.00 -0.06 2.79 2.02 0.41 -0.72 118.70 126.54 2j9d s GLU 62 Ca -0.00 -0.85 0.01 0.00 0.02 0.00 0.00 54.97 54.15 2j9d s GLU 62 Cb -0.13 -2.40 0.02 0.00 0.10 0.00 0.00 34.13 31.71 2j9d s GLU 62 CO 0.01 0.00 -0.06 -0.51 0.02 0.00 0.00 175.26 174.73 2j9d s LEU 63 N 0.77 1.32 -0.26 1.80 1.02 0.02 -0.84 118.68 122.51 2j9d s LEU 63 Ca -0.08 -0.19 -0.11 0.00 0.02 0.00 0.00 54.13 53.77 2j9d s LEU 63 Cb -0.16 -0.58 -0.05 0.00 0.02 0.00 0.00 46.19 45.42 2j9d s LEU 63 CO -0.01 -0.05 0.20 -0.69 0.02 0.00 0.00 176.35 175.81 2j9d s VAL 64 N 1.05 5.32 0.18 -1.59 1.01 -1.26 -0.03 120.40 125.08 2j9d s VAL 64 Ca -0.09 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.13 2j9d s VAL 64 Cb -0.14 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 2j9d s VAL 64 CO -0.00 0.29 0.05 0.68 0.00 0.00 0.00 175.10 176.11 2j9d s VAL 65 N 1.40 0.42 0.39 2.92 -7.23 0.10 -4.96 120.40 113.44 2j9d s VAL 65 Ca 0.08 -1.97 -0.27 0.00 -1.81 0.00 0.00 61.98 58.02 2j9d s VAL 65 Cb -0.15 -2.23 -0.11 0.00 0.56 0.00 0.00 36.38 34.46 2j9d s VAL 65 CO 0.08 -0.34 1.32 0.29 -0.31 0.00 0.00 175.10 176.14 2j9d n LYS 66 N -0.24 2.14 -0.29 4.82 5.02 -1.26 -0.85 118.16 127.50 2j9d n LYS 66 Ca -0.04 0.76 0.14 0.00 -2.02 0.00 0.00 58.31 57.14 2j9d n LYS 66 Cb 0.64 -2.42 0.39 0.00 -0.02 0.00 0.00 35.03 33.61 2j9d n LYS 66 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2j9d h GLU 67 N 2.40 0.64 0.00 1.97 4.81 -1.64 -0.33 114.58 122.44 2j9d h GLU 67 Ca -0.48 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2j9d h GLU 67 Cb 1.28 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.51 2j9d h GLU 67 CO 0.62 0.43 -0.01 1.05 -0.73 0.00 0.00 179.01 180.37 2j9d h GLU 68 N 0.66 0.00 -0.01 1.92 4.11 -1.91 -2.48 114.58 116.88 2j9d h GLU 68 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.92 2j9d h GLU 68 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2j9d h GLU 68 CO -0.24 0.01 -0.46 -0.25 0.07 0.00 0.00 179.01 178.13 2j9d n ASP 69 N -3.13 0.99 -0.03 3.06 8.00 -0.14 -4.52 116.55 120.79 2j9d n ASP 69 Ca -0.02 -0.78 -0.10 0.00 0.71 0.00 0.00 54.79 54.60 2j9d n ASP 69 Cb 0.15 0.33 -0.04 0.00 -0.02 0.00 0.00 41.12 41.55 2j9d n ASP 69 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2j9d h VAL 70 N 0.83 0.96 -0.64 2.53 2.07 -1.46 -1.44 116.25 119.09 2j9d h VAL 70 Ca 0.00 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.53 2j9d h VAL 70 Cb 0.54 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 2j9d h VAL 70 CO 0.00 0.02 0.36 0.44 0.02 0.00 0.00 177.57 178.41 2j9d h ASP 71 N 0.13 0.54 -0.30 0.57 3.32 -1.80 -0.38 116.42 118.50 2j9d h ASP 71 Ca 0.07 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 2j9d h ASP 71 Cb 0.05 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 2j9d h ASP 71 CO -0.08 0.35 0.12 -1.13 -1.72 0.00 0.00 179.24 176.79 2j9d h ASN 72 N 0.67 0.41 -0.39 6.45 -1.24 -1.78 -0.80 115.58 118.91 2j9d h ASN 72 Ca 0.28 -0.16 0.02 0.00 0.71 0.00 0.00 56.30 57.14 2j9d h ASN 72 Cb 0.15 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.07 2j9d h ASN 72 CO -0.17 0.46 0.23 0.58 -1.29 0.00 0.00 177.43 177.25 2j9d h VAL 73 N 0.33 1.05 -0.62 2.57 2.07 -0.77 -1.27 116.25 119.62 2j9d h VAL 73 Ca 0.10 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 2j9d h VAL 73 Cb 0.18 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 2j9d h VAL 73 CO -0.01 0.09 0.37 0.40 0.02 0.00 0.00 177.57 178.44 2j9d h ILE 74 N 0.47 1.18 -0.22 4.57 2.04 -0.97 -1.33 117.51 123.26 2j9d h ILE 74 Ca 0.15 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.61 2j9d h ILE 74 Cb -0.00 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 2j9d h ILE 74 CO -0.07 0.19 0.12 0.44 0.00 0.00 0.00 178.15 178.84 2j9d h ASP 75 N 0.84 0.20 -0.34 1.72 3.32 -0.74 -0.88 116.42 120.53 2j9d h ASP 75 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2j9d h ASP 75 Cb -0.02 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2j9d h ASP 75 CO -0.04 0.15 0.22 0.40 -1.72 0.00 0.00 179.24 178.25 2j9d h ILE 76 N 0.26 1.09 -0.14 0.35 2.04 -1.03 -1.14 117.51 118.93 2j9d h ILE 76 Ca 0.08 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 2j9d h ILE 76 Cb -0.00 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2j9d h ILE 76 CO -0.04 0.09 0.06 0.40 0.00 0.00 0.00 178.15 178.66 2j9d h ILE 77 N 0.46 1.15 -0.28 -0.67 2.04 -1.09 -2.02 117.51 117.10 2j9d h ILE 77 Ca 0.12 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.55 2j9d h ILE 77 Cb -0.05 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2j9d h ILE 77 CO -0.03 0.14 0.18 0.00 0.00 0.00 0.00 178.15 178.43 2j9d h GLU 79 N 0.36 0.84 0.00 0.00 4.81 -1.10 -2.50 114.58 116.99 2j9d h GLU 79 Ca 0.10 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 2j9d h GLU 79 Cb -0.03 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.16 2j9d h GLU 79 CO -0.03 0.56 -1.09 0.09 -0.73 0.00 0.00 179.01 177.81 2j9d n ASN 80 N -4.66 0.80 0.06 1.04 4.13 -0.77 -4.16 115.26 111.71 2j9d n ASN 80 Ca 0.07 0.31 0.09 0.00 1.68 0.00 0.00 54.58 56.73 2j9d n ASN 80 Cb 0.07 0.52 -0.06 0.00 -1.54 0.00 0.00 39.78 38.77 2j9d n ASN 80 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2j9d n ALA 81 N -2.20 2.46 -1.78 5.41 0.00 0.52 -4.62 120.51 120.30 2j9d n ALA 81 Ca -0.01 -0.38 -0.35 0.00 0.00 0.00 0.00 53.44 52.70 2j9d n ALA 81 Cb 0.57 -0.97 -0.00 0.00 0.00 0.00 0.00 19.45 19.05 2j9d n ALA 81 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2j9d s ARG 82 N -3.30 3.40 0.00 0.00 1.70 -0.94 -4.82 118.95 114.98 2j9d s ARG 82 Ca -0.03 1.59 0.00 0.00 -0.47 0.00 0.00 55.73 56.83 2j9d s ARG 82 Cb 0.10 -2.02 0.00 0.00 -0.57 0.00 0.00 34.95 32.47 2j9d s ARG 82 CO 0.82 -0.81 0.00 0.25 -1.08 0.00 0.00 175.30 174.48 2j9d n THR 83 N -1.26 0.00 -0.17 4.99 -2.24 -1.26 -5.03 114.28 109.30 2j9d n THR 83 Ca 0.11 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2j9d n THR 83 Cb 0.51 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 2j9d n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j9d n GLY 84 N 1.02 0.78 3.70 3.38 0.00 -1.26 -5.06 105.19 107.74 2j9d n GLY 84 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2j9d n GLY 84 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j9d s ASN 85 N -2.83 5.14 0.22 1.61 0.01 -1.26 -5.09 114.94 112.74 2j9d s ASN 85 Ca 0.00 -0.07 -0.30 0.00 -0.71 0.00 0.00 52.86 51.78 2j9d s ASN 85 Cb 0.00 -1.31 -0.15 0.00 0.41 0.00 0.00 41.25 40.20 2j9d s ASN 85 CO 0.00 0.23 0.95 -2.65 -1.51 0.00 0.00 177.10 174.12 2j9d n PRO 86 N 0.98 0.93 -0.02 -0.60 -0.02 -1.26 -3.38 135.00 131.64 2j9d n PRO 86 Ca -0.12 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2j9d n PRO 86 Cb 0.52 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 2j9d n PRO 86 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j9d n GLY 87 N 1.66 0.99 0.24 -1.23 0.00 -1.26 -4.87 105.19 100.73 2j9d n GLY 87 Ca 0.14 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.27 2j9d n GLY 87 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2j9d h ASP 88 N 0.00 0.00 -5.00 1.61 3.32 -1.91 -3.42 116.42 111.02 2j9d h ASP 88 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2j9d h ASP 88 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2j9d h ASP 88 CO 0.00 0.13 0.00 0.61 -1.72 0.00 0.00 179.24 178.26 2j9d n GLY 89 N 0.12 -0.82 3.11 2.75 0.00 -1.26 -4.29 105.19 104.80 2j9d n GLY 89 Ca 0.00 -2.20 -0.09 0.00 0.00 0.00 0.00 46.02 43.74 2j9d n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j9d s LYS 90 N -0.13 0.59 -0.04 1.61 1.02 -1.02 -5.00 119.74 116.77 2j9d s LYS 90 Ca 0.00 -0.82 0.06 0.00 0.02 0.00 0.00 55.97 55.23 2j9d s LYS 90 Cb 0.00 0.23 -0.01 0.00 -0.52 0.00 0.00 37.83 37.53 2j9d s LYS 90 CO 0.00 -0.14 -0.21 0.42 -0.92 0.00 0.00 175.35 174.49 2j9d s ILE 91 N -2.79 1.75 0.04 2.17 1.01 -1.26 -1.01 121.20 121.10 2j9d s ILE 91 Ca -0.03 -0.91 0.09 0.00 0.00 0.00 0.00 60.65 59.80 2j9d s ILE 91 Cb -0.00 -1.48 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 2j9d s ILE 91 CO -0.05 0.49 -0.25 -0.36 0.00 0.00 0.00 174.94 174.77 2j9d s PHE 92 N -0.16 2.19 -0.17 3.97 0.08 0.85 -4.98 117.98 119.76 2j9d s PHE 92 Ca -0.01 -0.40 -0.02 0.00 0.12 0.00 0.00 56.93 56.62 2j9d s PHE 92 Cb -0.12 -1.32 -0.01 0.00 -0.57 0.00 0.00 43.02 41.00 2j9d s PHE 92 CO 0.02 0.10 -0.09 0.08 -0.10 0.00 0.00 175.22 175.23 2j9d s VAL 93 N -0.78 3.20 -0.07 -0.44 1.01 -1.26 -0.61 120.40 121.45 2j9d s VAL 93 Ca 0.11 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.55 2j9d s VAL 93 Cb -0.10 -2.40 -0.00 0.00 0.00 0.00 0.00 36.38 33.88 2j9d s VAL 93 CO 0.02 0.48 -0.21 -0.63 0.00 0.00 0.00 175.10 174.76 2j9d s ILE 94 N 0.87 1.74 0.32 2.22 1.01 -0.08 -4.97 121.20 122.31 2j9d s ILE 94 Ca -0.02 -0.86 -0.29 0.00 0.00 0.00 0.00 60.65 59.47 2j9d s ILE 94 Cb -0.15 -1.50 -0.11 0.00 0.01 0.00 0.00 42.46 40.72 2j9d s ILE 94 CO 0.01 0.49 1.42 -2.16 0.00 0.00 0.00 174.94 174.69 2j9d s PRO 95 N 0.17 4.24 -0.17 2.79 0.04 -1.26 -0.31 135.00 140.50 2j9d s PRO 95 Ca -0.10 2.38 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2j9d s PRO 95 Cb -0.15 -3.04 0.01 0.00 0.04 0.00 0.00 34.50 31.36 2j9d s PRO 95 CO 0.05 -0.39 -0.17 0.08 0.04 0.00 0.00 177.00 176.62 2j9d s VAL 96 N -0.78 2.45 -0.25 -0.36 1.01 -0.75 -4.77 120.40 116.95 2j9d s VAL 96 Ca 0.54 -0.83 0.22 0.00 0.00 0.00 0.00 61.98 61.91 2j9d s VAL 96 Cb -0.43 -2.04 0.03 0.00 0.00 0.00 0.00 36.38 33.95 2j9d s VAL 96 CO 0.54 0.52 1.11 -0.33 0.00 0.00 0.00 175.10 176.93 2j9d h GLU 97 N 7.65 0.00 -2.39 2.72 5.08 -1.95 -3.35 114.58 122.33 2j9d h GLU 97 Ca -0.39 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.89 2j9d h GLU 97 Cb 1.17 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.19 2j9d h GLU 97 CO 0.60 0.06 -0.08 1.03 -1.00 0.00 0.00 179.01 179.61 2j9d s ARG 98 N -3.27 0.63 -0.08 2.33 0.52 -1.26 -5.00 118.95 112.83 2j9d s ARG 98 Ca 0.00 0.80 0.02 0.00 -0.52 0.00 0.00 55.73 56.04 2j9d s ARG 98 Cb 0.09 0.28 0.01 0.00 0.52 0.00 0.00 34.95 35.84 2j9d s ARG 98 CO 0.77 -0.09 -0.14 0.08 0.02 0.00 0.00 175.30 175.94 2j9d s VAL 99 N 0.47 1.31 -0.09 3.52 1.01 -1.26 -5.04 120.40 120.32 2j9d s VAL 99 Ca -0.01 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2j9d s VAL 99 Cb -0.04 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 35.17 2j9d s VAL 99 CO -0.02 0.40 -0.11 -0.69 0.00 0.00 0.00 175.10 174.68 2j9d s VAL 100 N 0.66 1.15 -0.02 2.92 1.01 -1.26 -2.36 120.40 122.49 2j9d s VAL 100 Ca -0.14 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 2j9d s VAL 100 Cb -0.16 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 2j9d s VAL 100 CO 0.04 0.37 1.04 -0.60 0.00 0.00 0.00 175.10 175.95 2j9d s ARG 101 N 1.06 4.49 0.05 2.72 3.52 0.01 -4.98 118.95 125.82 2j9d s ARG 101 Ca -0.07 1.49 -0.26 0.00 -0.13 0.00 0.00 55.73 56.76 2j9d s ARG 101 Cb -0.15 -3.47 -0.17 0.00 -1.56 0.00 0.00 34.95 29.60 2j9d s ARG 101 CO -0.01 -0.19 1.55 0.28 -0.81 0.00 0.00 175.30 176.12 2j9d h VAL 102 N 4.85 0.82 0.00 7.11 2.07 -1.95 0.27 116.25 129.42 2j9d h VAL 102 Ca -0.38 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 2j9d h VAL 102 Cb 1.19 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2j9d h VAL 102 CO 0.80 0.06 -0.12 0.08 0.02 0.00 0.00 177.57 178.40 2j9d h ARG 103 N -0.43 0.00 -0.00 1.57 0.11 -1.98 -3.20 114.38 110.45 2j9d h ARG 103 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2j9d h ARG 103 Cb 0.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.41 2j9d h ARG 103 CO 0.05 0.12 -0.05 0.25 0.10 0.00 0.00 179.97 180.45 2j9d n THR 104 N -3.28 0.00 -0.94 0.08 -2.24 -1.22 -5.01 114.28 101.67 2j9d n THR 104 Ca 0.00 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2j9d n THR 104 Cb 0.37 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 2j9d n THR 104 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2j9d n LYS 105 N -0.97 -1.63 -1.25 -0.78 4.76 0.95 -4.98 118.16 114.27 2j9d n LYS 105 Ca 0.00 0.41 -0.35 0.00 -2.87 0.00 0.00 58.31 55.50 2j9d n LYS 105 Cb 0.02 -4.80 0.09 0.00 -1.84 0.00 0.00 35.03 28.49 2j9d n LYS 105 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2j9d n GLU 106 N 0.38 0.34 -4.24 1.97 1.02 -1.25 -4.68 120.64 114.18 2j9d n GLU 106 Ca 0.00 0.17 -0.14 0.00 -0.02 0.00 0.00 57.16 57.17 2j9d n GLU 106 Cb 0.41 -2.11 -0.10 0.00 -0.02 0.00 0.00 31.44 29.61 2j9d n GLU 106 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2j9d s GLU 107 N -3.30 1.25 3.06 3.49 2.02 -1.26 -0.81 118.70 123.15 2j9d s GLU 107 Ca 0.70 -1.66 0.00 0.00 0.02 0.00 0.00 54.97 54.03 2j9d s GLU 107 Cb -0.33 0.02 0.00 0.00 0.10 0.00 0.00 34.13 33.92 2j9d s GLU 107 CO 0.54 -0.32 0.00 0.41 0.02 0.00 0.00 175.26 175.91 2j9d n GLY 108 N -0.33 0.12 0.26 -1.39 0.00 -0.99 -3.62 105.19 99.24 2j9d n GLY 108 Ca -0.00 -0.94 0.09 0.00 0.00 0.00 0.00 46.02 45.17 2j9d n GLY 108 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2j9d h LYS 109 N 0.00 0.00 -0.96 1.61 2.10 -1.95 -1.36 116.57 116.01 2j9d h LYS 109 Ca 0.00 0.00 0.08 0.00 -2.00 0.00 0.00 60.65 58.73 2j9d h LYS 109 Cb 0.00 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.26 2j9d h LYS 109 CO 0.00 0.02 0.60 0.93 -2.00 0.00 0.00 179.45 179.01 2j9d h GLU 110 N 0.00 1.02 0.00 0.07 3.07 -1.97 -1.47 114.58 115.30 2j9d h GLU 110 Ca -0.00 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.80 2j9d h GLU 110 Cb 0.05 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 27.73 2j9d h GLU 110 CO 0.00 0.67 -0.01 0.00 -1.40 0.00 0.00 179.01 178.28 2j9d h ALA 111 N 1.47 1.10 0.00 3.43 0.00 -1.33 -2.78 119.26 121.15 2j9d h ALA 111 Ca 0.44 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 55.09 2j9d h ALA 111 Cb 0.28 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2j9d h ALA 111 CO -0.21 0.01 -1.29 -0.07 0.00 0.00 0.00 179.25 177.70 2j9d h LEU 112 N 0.00 0.00 0.00 0.00 3.38 -1.37 -3.43 115.31 113.90 2j9d h LEU 112 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2j9d h LEU 112 Cb 0.11 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2j9d h LEU 112 CO 0.00 1.00 0.00 0.18 0.09 0.00 0.00 178.44 179.71 2j9d n LEU 113 N -3.23 0.00 0.00 1.67 4.32 -1.05 -4.94 117.00 113.77 2j9d n LEU 113 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.92 2j9d n LEU 113 Cb 0.99 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.79 2j9d n LEU 113 CO 0.46 0.00 0.00 1.21 -1.22 0.00 0.00 177.39 177.84