#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 6.33 0.03 1.61 0.01 -1.26 -4.91 113.70 115.51 2j9d s SER 0 Ca 0.00 1.38 0.01 0.00 1.31 0.00 0.00 55.95 58.65 2j9d s SER 0 Cb 0.00 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 2j9d s SER 0 CO 0.00 -0.75 0.07 -0.04 0.41 0.00 0.00 173.24 172.93 2j9d s MET 1 N -4.83 2.96 0.02 12.44 1.00 -1.26 -0.82 119.30 128.82 2j9d s MET 1 Ca 0.55 -0.58 0.02 0.00 0.00 0.00 0.00 55.69 55.68 2j9d s MET 1 Cb -0.11 -2.79 -0.01 0.00 0.00 0.00 0.00 34.83 31.92 2j9d s MET 1 CO 0.47 0.61 -0.08 0.15 0.00 0.00 0.00 175.02 176.18 2j9d s LYS 2 N -1.97 0.55 -0.25 2.03 -0.14 -0.16 -2.18 119.74 117.62 2j9d s LYS 2 Ca 0.25 -0.45 -0.16 0.00 -1.36 0.00 0.00 55.97 54.25 2j9d s LYS 2 Cb -0.12 -0.47 -0.03 0.00 -1.68 0.00 0.00 37.83 35.53 2j9d s LYS 2 CO 0.17 0.12 0.42 0.21 -0.76 0.00 0.00 175.35 175.51 2j9d s LYS 3 N -0.72 4.07 -0.30 1.68 2.20 0.73 -0.91 119.74 126.49 2j9d s LYS 3 Ca -0.02 0.17 -0.13 0.00 -0.36 0.00 0.00 55.97 55.63 2j9d s LYS 3 Cb -0.05 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.60 2j9d s LYS 3 CO 0.00 -0.24 0.26 0.08 -0.36 0.00 0.00 175.35 175.09 2j9d s VAL 4 N 1.96 5.26 -0.16 4.02 1.01 0.81 -0.74 120.40 132.55 2j9d s VAL 4 Ca 0.18 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.28 2j9d s VAL 4 Cb -0.15 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 2j9d s VAL 4 CO 0.09 0.14 -0.06 -1.61 0.00 0.00 0.00 175.10 173.66 2j9d s GLU 5 N 1.85 3.56 -0.10 2.72 2.02 0.28 -0.82 118.70 128.21 2j9d s GLU 5 Ca 0.09 -0.57 0.03 0.00 0.02 0.00 0.00 54.97 54.54 2j9d s GLU 5 Cb -0.16 -2.88 0.01 0.00 0.10 0.00 0.00 34.13 31.20 2j9d s GLU 5 CO 0.11 0.16 -0.19 0.00 0.02 0.00 0.00 175.26 175.36 2j9d s ALA 6 N 0.56 1.85 -0.37 5.21 0.00 0.60 -0.29 121.76 129.31 2j9d s ALA 6 Ca -0.04 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.01 2j9d s ALA 6 Cb -0.15 -0.76 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2j9d s ALA 6 CO 0.03 0.16 0.23 0.42 0.00 0.00 0.00 175.76 176.59 2j9d s ILE 7 N 0.57 4.87 0.36 0.00 -1.09 -0.36 -0.46 121.20 125.10 2j9d s ILE 7 Ca -0.15 -0.65 0.04 0.00 -2.23 0.00 0.00 60.65 57.66 2j9d s ILE 7 Cb -0.17 -3.65 -0.05 0.00 -1.58 0.00 0.00 42.46 37.01 2j9d s ILE 7 CO 0.05 -0.18 0.08 0.27 -1.23 0.00 0.00 174.94 173.93 2j9d s ILE 8 N 1.62 0.99 0.30 2.92 -4.36 0.06 -2.67 121.20 120.06 2j9d s ILE 8 Ca 0.04 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.14 2j9d s ILE 8 Cb -0.19 -2.63 -0.10 0.00 1.25 0.00 0.00 42.46 40.80 2j9d s ILE 8 CO 0.08 0.00 1.34 -0.13 0.24 0.00 0.00 174.94 176.47 2j9d s ARG 9 N -3.84 4.34 0.44 0.37 0.52 -1.26 -1.32 118.95 118.19 2j9d s ARG 9 Ca 0.31 2.22 0.10 0.00 -0.52 0.00 0.00 55.73 57.85 2j9d s ARG 9 Cb 0.07 -3.09 0.99 0.00 0.52 0.00 0.00 34.95 33.43 2j9d s ARG 9 CO 0.15 -0.25 2.08 -1.35 0.02 0.00 0.00 175.30 175.95 2j9d h PRO 10 N 3.94 0.35 0.00 3.54 0.11 -1.88 -1.10 132.00 136.96 2j9d h PRO 10 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2j9d h PRO 10 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2j9d h PRO 10 CO 0.69 0.24 0.00 -0.85 -0.21 0.00 0.00 178.00 177.88 2j9d n GLU 11 N -4.49 0.19 0.00 1.05 0.00 -1.26 -2.38 120.64 113.75 2j9d n GLU 11 Ca 0.01 0.13 0.11 0.00 0.00 0.00 0.00 57.16 57.41 2j9d n GLU 11 Cb 0.08 -1.50 0.07 0.00 0.00 0.00 0.00 31.44 30.08 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 -1.35 1.31 0.00 3.44 4.76 -0.42 -4.60 118.16 121.31 2j9d n LYS 12 Ca 0.08 -1.05 -0.10 0.00 -2.87 0.00 0.00 58.31 54.36 2j9d n LYS 12 Cb 0.17 -1.48 -0.05 0.00 -1.84 0.00 0.00 35.03 31.83 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 2.56 -0.05 -0.58 -0.35 5.85 -1.53 -1.08 115.31 120.14 2j9d h LEU 13 Ca 0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 2j9d h LEU 13 Cb 0.75 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 2j9d h LEU 13 CO 0.00 -0.01 0.28 -0.33 -0.34 0.00 0.00 178.44 178.04 2j9d h GLU 14 N 0.03 0.83 -0.01 1.25 4.39 -1.81 0.87 114.58 120.13 2j9d h GLU 14 Ca 0.05 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 2j9d h GLU 14 Cb 0.06 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.56 2j9d h GLU 14 CO -0.08 0.68 0.00 0.82 -1.16 0.00 0.00 179.01 179.27 2j9d h ILE 15 N 0.78 1.10 -0.37 3.13 2.04 -1.83 -1.84 117.51 120.53 2j9d h ILE 15 Ca 0.20 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 2j9d h ILE 15 Cb 0.12 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2j9d h ILE 15 CO -0.02 0.08 0.20 0.58 0.00 0.00 0.00 178.15 178.99 2j9d h VAL 16 N -0.11 1.14 -0.33 1.67 2.07 -0.94 -1.37 116.25 118.37 2j9d h VAL 16 Ca 0.00 -0.35 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 2j9d h VAL 16 Cb 0.12 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2j9d h VAL 16 CO -0.00 0.14 -0.16 0.07 0.02 0.00 0.00 177.57 177.64 2j9d h LYS 17 N 0.47 0.60 -0.12 1.57 2.10 -0.79 -0.24 116.57 120.15 2j9d h LYS 17 Ca 0.13 -0.20 -0.02 0.00 -2.00 0.00 0.00 60.65 58.56 2j9d h LYS 17 Cb 0.05 -0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 31.32 2j9d h LYS 17 CO -0.02 0.74 0.01 -0.22 -2.00 0.00 0.00 179.45 177.95 2j9d h LYS 18 N 0.54 0.22 -0.82 0.07 3.64 -1.17 -0.11 116.57 118.94 2j9d h LYS 18 Ca 0.09 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.45 2j9d h LYS 18 Cb 0.59 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 2j9d h LYS 18 CO 0.04 0.44 0.51 0.00 -2.27 0.00 0.00 179.45 178.17 2j9d h ALA 19 N 0.76 1.10 -0.35 5.00 0.00 -1.01 0.12 119.26 124.88 2j9d h ALA 19 Ca 0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2j9d h ALA 19 Cb 0.34 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2j9d h ALA 19 CO 0.01 0.29 0.13 -0.07 0.00 0.00 0.00 179.25 179.60 2j9d h LEU 20 N 0.97 0.49 -0.33 0.00 3.38 -0.95 -2.60 115.31 116.26 2j9d h LEU 20 Ca 0.34 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2j9d h LEU 20 Cb 0.09 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2j9d h LEU 20 CO -0.14 0.53 0.16 0.28 0.09 0.00 0.00 178.44 179.35 2j9d h SER 21 N 0.41 0.22 0.05 -0.43 0.02 -0.49 -0.19 113.55 113.15 2j9d h SER 21 Ca 0.11 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2j9d h SER 21 Cb 0.21 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 2j9d h SER 21 CO -0.01 0.17 -0.05 0.44 -1.14 0.00 0.00 176.83 176.24 2j9d h ASP 22 N 0.33 0.00 -0.14 3.07 3.32 -0.71 -1.13 116.42 121.15 2j9d h ASP 22 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2j9d h ASP 22 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 2j9d h ASP 22 CO -0.11 0.05 0.00 0.00 -1.72 0.00 0.00 179.24 177.46 2j9d n ALA 23 N -2.51 2.53 -0.08 3.45 0.00 -0.95 -4.92 120.51 118.04 2j9d n ALA 23 Ca -0.03 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.95 2j9d n ALA 23 Cb 0.13 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 1.08 0.60 3.34 0.00 0.00 -0.43 -5.03 105.19 104.76 2j9d n GLY 24 Ca 0.16 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.13 3.66 -0.16 1.61 1.51 -0.13 -4.83 117.35 116.87 2j9d s TYR 25 Ca 0.00 -1.87 0.16 0.00 -1.01 0.00 0.00 57.07 54.35 2j9d s TYR 25 Cb 0.00 -3.86 -0.24 0.00 -0.11 0.00 0.00 41.96 37.75 2j9d s TYR 25 CO 0.00 -1.04 0.21 0.28 -1.11 0.00 0.00 175.55 173.89 2j9d n VAL 26 N 4.23 1.45 -2.62 0.71 0.31 -1.26 -3.38 118.33 117.76 2j9d n VAL 26 Ca 0.12 -0.84 -0.43 0.00 -0.01 0.00 0.00 64.34 63.18 2j9d n VAL 26 Cb 0.46 -0.63 -0.02 0.00 -0.91 0.00 0.00 33.84 32.75 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 -5.42 1.27 0.02 2.92 0.00 -1.26 -4.98 107.32 99.87 2j9d s GLY 27 Ca -0.09 -0.60 -0.11 0.00 0.00 0.00 0.00 44.72 43.92 2j9d s GLY 27 CO 0.82 2.40 0.22 -3.16 0.00 0.00 0.00 173.10 173.39 2j9d s MET 28 N 4.51 0.65 -0.08 2.90 0.00 -1.26 -4.60 119.30 121.42 2j9d s MET 28 Ca 0.46 -0.44 0.02 0.00 0.00 0.00 0.00 55.69 55.72 2j9d s MET 28 Cb -0.07 0.27 -0.02 0.00 0.00 0.00 0.00 34.83 35.01 2j9d s MET 28 CO 0.30 -0.18 -0.15 0.99 0.00 0.00 0.00 175.02 175.98 2j9d s THR 29 N -1.94 2.99 -0.09 3.16 2.01 -0.05 -4.97 115.64 116.74 2j9d s THR 29 Ca -0.10 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.21 2j9d s THR 29 Cb -0.04 -2.20 0.01 0.00 0.01 0.00 0.00 72.50 70.28 2j9d s THR 29 CO -0.00 0.56 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.61 2j9d s VAL 30 N -0.25 1.68 0.13 3.82 1.01 -1.26 -0.56 120.40 124.98 2j9d s VAL 30 Ca 0.01 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.28 2j9d s VAL 30 Cb -0.13 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2j9d s VAL 30 CO 0.03 0.48 -0.18 -0.44 0.00 0.00 0.00 175.10 174.98 2j9d s SER 31 N 0.53 2.48 -0.26 3.32 0.01 -0.10 -5.00 113.70 114.69 2j9d s SER 31 Ca -0.16 -0.79 -0.14 0.00 1.31 0.00 0.00 55.95 56.18 2j9d s SER 31 Cb -0.17 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.89 2j9d s SER 31 CO 0.06 -0.02 0.31 -1.61 0.41 0.00 0.00 173.24 172.38 2j9d s GLU 32 N -2.44 4.03 0.40 12.44 2.02 -1.26 -0.74 118.70 133.15 2j9d s GLU 32 Ca 0.11 -0.06 0.04 0.00 0.02 0.00 0.00 54.97 55.08 2j9d s GLU 32 Cb -0.07 -3.62 -0.03 0.00 0.10 0.00 0.00 34.13 30.51 2j9d s GLU 32 CO 0.05 -0.17 0.13 0.14 0.02 0.00 0.00 175.26 175.43 2j9d s VAL 33 N 1.74 0.59 0.01 2.63 -7.23 -0.78 -4.96 120.40 112.40 2j9d s VAL 33 Ca 0.13 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.36 2j9d s VAL 33 Cb -0.15 -2.37 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 2j9d s VAL 33 CO 0.09 0.00 -0.19 -0.54 -0.31 0.00 0.00 175.10 174.15 2j9d s LYS 34 N -3.71 1.43 0.26 4.82 1.02 -1.26 -0.83 119.74 121.47 2j9d s LYS 34 Ca 0.25 -0.74 0.04 0.00 0.02 0.00 0.00 55.97 55.53 2j9d s LYS 34 Cb 0.03 -1.43 -0.05 0.00 -0.52 0.00 0.00 37.83 35.86 2j9d s LYS 34 CO 0.15 0.38 0.01 0.20 -0.92 0.00 0.00 175.35 175.18 2j9d s GLY 35 N -0.69 1.69 0.03 -3.33 0.00 0.46 -4.87 107.32 100.62 2j9d s GLY 35 Ca 0.07 -1.84 0.06 0.00 0.00 0.00 0.00 44.72 43.00 2j9d s GLY 35 CO 0.00 -1.70 -0.17 -1.60 0.00 0.00 0.00 173.10 169.63 2j9d s ARG 36 N -3.88 1.17 0.00 2.90 3.52 -1.26 0.10 118.95 121.50 2j9d s ARG 36 Ca 0.31 -0.78 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 2j9d s ARG 36 Cb 0.06 -1.21 0.00 0.00 -1.56 0.00 0.00 34.95 32.24 2j9d s ARG 36 CO 0.11 0.31 0.00 0.41 -0.81 0.00 0.00 175.30 175.32 2j9d n GLY 37 N 2.06 -2.32 0.69 8.12 0.00 -1.25 -5.05 105.19 107.45 2j9d n GLY 37 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2j9d n GLY 37 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2j9d n VAL 38 N 0.00 0.00 -3.00 1.61 3.14 -1.26 -5.10 118.33 113.72 2j9d n VAL 38 Ca 0.00 -0.05 -0.13 0.00 -2.96 0.00 0.00 64.34 61.21 2j9d n VAL 38 Cb 0.00 0.11 -0.03 0.00 -1.06 0.00 0.00 33.84 32.86 2j9d n VAL 38 CO 0.00 0.00 0.00 2.30 -6.46 0.00 0.00 176.83 172.67 2j9d n ILE 52 N -0.15 -0.26 -2.33 1.55 -6.64 -1.26 -5.20 119.36 105.07 2j9d n ILE 52 Ca 0.00 -0.13 -0.36 0.00 -1.77 0.00 0.00 62.75 60.50 2j9d n ILE 52 Cb 0.10 -0.31 -0.01 0.00 -1.44 0.00 0.00 39.64 37.98 2j9d n ILE 52 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 2j9d s VAL 53 N -3.01 3.30 -1.98 7.28 0.11 -1.26 -4.97 120.40 119.87 2j9d s VAL 53 Ca 0.09 0.88 0.25 0.00 -2.93 0.00 0.00 61.98 60.26 2j9d s VAL 53 Cb -0.05 -3.40 0.15 0.00 -1.53 0.00 0.00 36.38 31.55 2j9d s VAL 53 CO 0.37 -0.11 1.34 -0.90 -3.33 0.00 0.00 175.10 172.47 2j9d n ASP 54 N -0.87 1.61 -4.64 3.54 5.75 -1.26 -4.78 116.55 115.90 2j9d n ASP 54 Ca 0.09 -1.26 -0.39 0.00 -0.01 0.00 0.00 54.79 53.22 2j9d n ASP 54 Cb 0.50 0.28 -0.08 0.00 -1.03 0.00 0.00 41.12 40.80 2j9d n ASP 54 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2j9d s LEU 55 N -2.44 4.09 0.20 -2.12 1.43 -1.26 -3.76 118.68 114.82 2j9d s LEU 55 Ca 0.22 0.47 0.11 0.00 -1.03 0.00 0.00 54.13 53.91 2j9d s LEU 55 Cb 0.19 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 2j9d s LEU 55 CO 0.53 -0.18 -0.22 0.27 0.23 0.00 0.00 176.35 176.98 2j9d s ILE 56 N 1.84 2.25 0.30 -0.59 -0.00 0.11 -4.84 121.20 120.28 2j9d s ILE 56 Ca 0.19 -2.07 -0.30 0.00 -0.00 0.00 0.00 60.65 58.47 2j9d s ILE 56 Cb -0.15 -2.09 -0.11 0.00 -0.00 0.00 0.00 42.46 40.10 2j9d s ILE 56 CO 0.09 -0.21 1.60 -2.84 -0.00 0.00 0.00 174.94 173.58 2j9d s PRO 57 N -2.85 4.11 0.25 0.37 0.02 -1.26 -0.40 135.00 135.24 2j9d s PRO 57 Ca 0.21 2.60 0.02 0.00 0.02 0.00 0.00 61.00 63.85 2j9d s PRO 57 Cb -0.07 -3.01 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 2j9d s PRO 57 CO 0.10 -0.65 0.16 0.15 -0.33 0.00 0.00 177.00 176.43 2j9d s LYS 58 N -0.61 1.40 -0.07 5.54 -0.14 -0.01 -4.56 119.74 121.30 2j9d s LYS 58 Ca 0.63 -1.77 0.06 0.00 -1.36 0.00 0.00 55.97 53.53 2j9d s LYS 58 Cb -0.48 0.13 -0.01 0.00 -1.68 0.00 0.00 37.83 35.79 2j9d s LYS 58 CO 0.49 -0.43 -0.25 0.14 -0.76 0.00 0.00 175.35 174.55 2j9d s VAL 59 N -3.87 2.07 -0.26 3.17 -7.23 -0.44 -1.86 120.40 111.98 2j9d s VAL 59 Ca 0.38 -1.05 -0.12 0.00 -1.81 0.00 0.00 61.98 59.39 2j9d s VAL 59 Cb 0.06 -1.75 -0.05 0.00 0.56 0.00 0.00 36.38 35.20 2j9d s VAL 59 CO 0.16 0.57 0.22 -0.75 -0.31 0.00 0.00 175.10 174.99 2j9d s LYS 60 N -0.07 4.00 -0.17 4.82 2.20 0.08 -0.76 119.74 129.84 2j9d s LYS 60 Ca -0.06 -0.23 -0.06 0.00 -0.36 0.00 0.00 55.97 55.26 2j9d s LYS 60 Cb -0.15 -3.62 -0.03 0.00 -1.51 0.00 0.00 37.83 32.52 2j9d s LYS 60 CO 0.05 -0.12 0.02 0.42 -0.36 0.00 0.00 175.35 175.35 2j9d s ILE 61 N 1.60 4.36 -0.15 5.43 1.01 0.40 -0.93 121.20 132.92 2j9d s ILE 61 Ca 0.09 -0.19 0.02 0.00 0.00 0.00 0.00 60.65 60.57 2j9d s ILE 61 Cb -0.15 -2.94 0.01 0.00 0.01 0.00 0.00 42.46 39.39 2j9d s ILE 61 CO 0.09 0.47 -0.22 -1.61 0.00 0.00 0.00 174.94 173.68 2j9d s GLU 62 N 0.41 3.00 -0.09 2.79 2.02 0.28 -0.29 118.70 126.82 2j9d s GLU 62 Ca -0.00 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.14 2j9d s GLU 62 Cb -0.13 -2.45 0.02 0.00 0.10 0.00 0.00 34.13 31.67 2j9d s GLU 62 CO 0.02 -0.05 -0.07 -1.17 0.02 0.00 0.00 175.26 174.00 2j9d s LEU 63 N 0.90 1.21 -0.25 1.80 2.96 -0.00 -0.87 118.68 124.43 2j9d s LEU 63 Ca -0.05 -0.25 -0.13 0.00 -0.22 0.00 0.00 54.13 53.48 2j9d s LEU 63 Cb -0.15 -0.74 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 2j9d s LEU 63 CO -0.04 -0.09 0.26 -0.69 -1.32 0.00 0.00 176.35 174.47 2j9d s VAL 64 N 1.44 5.27 0.18 1.68 1.01 -1.26 -0.14 120.40 128.59 2j9d s VAL 64 Ca -0.01 0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.35 2j9d s VAL 64 Cb -0.13 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 2j9d s VAL 64 CO -0.04 0.26 0.02 0.68 0.00 0.00 0.00 175.10 176.01 2j9d s VAL 65 N 1.53 0.61 0.44 2.92 -7.23 -0.09 -4.96 120.40 113.62 2j9d s VAL 65 Ca 0.11 -1.98 -0.25 0.00 -1.81 0.00 0.00 61.98 58.05 2j9d s VAL 65 Cb -0.15 -2.18 -0.08 0.00 0.56 0.00 0.00 36.38 34.52 2j9d s VAL 65 CO 0.08 -0.41 1.41 -0.54 -0.31 0.00 0.00 175.10 175.33 2j9d s LYS 66 N -3.94 3.74 0.33 4.82 1.02 -1.26 -0.98 119.74 123.45 2j9d s LYS 66 Ca 0.26 2.38 0.09 0.00 0.02 0.00 0.00 55.97 58.72 2j9d s LYS 66 Cb 0.06 -2.68 0.86 0.00 -0.52 0.00 0.00 37.83 35.56 2j9d s LYS 66 CO 0.05 -0.76 1.76 1.49 -0.92 0.00 0.00 175.35 176.97 2j9d h GLU 67 N 2.39 0.61 0.00 1.68 4.81 -1.30 0.25 114.58 123.02 2j9d h GLU 67 Ca -0.51 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 2j9d h GLU 67 Cb 1.26 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.50 2j9d h GLU 67 CO 0.61 0.41 -0.04 1.05 -0.73 0.00 0.00 179.01 180.31 2j9d h GLU 68 N 0.63 0.00 -0.00 1.92 4.11 -1.91 -2.64 114.58 116.70 2j9d h GLU 68 Ca 0.60 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.03 2j9d h GLU 68 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2j9d h GLU 68 CO -0.39 0.04 -0.40 -0.25 0.07 0.00 0.00 179.01 178.07 2j9d n ASP 69 N -3.44 0.55 -0.12 3.06 8.00 0.08 -4.51 116.55 120.16 2j9d n ASP 69 Ca -0.02 -0.31 -0.08 0.00 0.71 0.00 0.00 54.79 55.08 2j9d n ASP 69 Cb 0.15 0.15 -0.00 0.00 -0.02 0.00 0.00 41.12 41.40 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 0.23 1.12 -0.50 2.53 2.07 -1.51 -1.08 116.25 119.10 2j9d h VAL 70 Ca 0.00 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.30 2j9d h VAL 70 Cb 0.49 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 2j9d h VAL 70 CO 0.00 0.12 0.25 0.44 0.02 0.00 0.00 177.57 178.40 2j9d h ASP 71 N 0.51 0.36 -0.42 0.57 3.32 -1.80 -0.61 116.42 118.35 2j9d h ASP 71 Ca 0.14 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 2j9d h ASP 71 Cb -0.01 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2j9d h ASP 71 CO -0.03 0.25 0.17 -1.13 -1.72 0.00 0.00 179.24 176.79 2j9d h ASN 72 N 0.50 0.58 -0.45 6.45 -1.24 -1.74 -0.85 115.58 118.83 2j9d h ASN 72 Ca 0.22 -0.16 -0.00 0.00 0.71 0.00 0.00 56.30 57.06 2j9d h ASN 72 Cb 0.13 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 2j9d h ASN 72 CO -0.15 0.58 0.26 0.58 -1.29 0.00 0.00 177.43 177.41 2j9d h VAL 73 N 0.54 1.14 -0.50 2.57 2.07 -0.89 -1.54 116.25 119.65 2j9d h VAL 73 Ca 0.14 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.34 2j9d h VAL 73 Cb 0.18 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2j9d h VAL 73 CO -0.01 0.15 0.30 0.40 0.02 0.00 0.00 177.57 178.43 2j9d h ILE 74 N 0.59 1.06 -0.20 4.57 2.04 -0.97 -1.15 117.51 123.46 2j9d h ILE 74 Ca 0.16 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2j9d h ILE 74 Cb 0.01 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 2j9d h ILE 74 CO -0.03 0.11 0.10 0.44 0.00 0.00 0.00 178.15 178.77 2j9d h ASP 75 N 0.61 0.15 -0.32 1.72 3.32 -0.90 -0.62 116.42 120.38 2j9d h ASP 75 Ca 0.20 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2j9d h ASP 75 Cb 0.00 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2j9d h ASP 75 CO -0.08 0.12 0.21 0.40 -1.72 0.00 0.00 179.24 178.16 2j9d h ILE 76 N 0.21 1.07 -0.18 0.35 2.04 -1.09 -0.53 117.51 119.38 2j9d h ILE 76 Ca 0.08 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2j9d h ILE 76 Cb 0.02 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 2j9d h ILE 76 CO -0.05 0.08 0.06 0.40 0.00 0.00 0.00 178.15 178.63 2j9d h ILE 77 N 0.42 1.19 -0.24 -0.67 2.04 -1.02 -2.12 117.51 117.11 2j9d h ILE 77 Ca 0.12 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.41 2j9d h ILE 77 Cb -0.04 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2j9d h ILE 77 CO -0.03 0.18 0.12 0.00 0.00 0.00 0.00 178.15 178.42 2j9d h GLU 79 N 0.26 0.77 0.00 0.00 4.81 -1.03 -2.34 114.58 117.06 2j9d h GLU 79 Ca 0.10 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2j9d h GLU 79 Cb 0.02 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.22 2j9d h GLU 79 CO -0.06 0.51 -1.12 0.09 -0.73 0.00 0.00 179.01 177.70 2j9d n ASN 80 N -4.71 0.62 0.03 1.04 4.13 -0.80 -4.22 115.26 111.33 2j9d n ASN 80 Ca 0.08 0.05 0.11 0.00 1.68 0.00 0.00 54.58 56.50 2j9d n ASN 80 Cb 0.13 0.78 -0.10 0.00 -1.54 0.00 0.00 39.78 39.05 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 -2.02 2.86 -1.78 5.41 0.00 0.41 -4.60 120.51 120.79 2j9d n ALA 81 Ca 0.00 -0.42 -0.36 0.00 0.00 0.00 0.00 53.44 52.66 2j9d n ALA 81 Cb 0.50 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 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 -3.42 3.91 0.00 0.00 1.70 -0.89 -4.82 118.95 115.43 2j9d s ARG 82 Ca -0.04 1.60 0.00 0.00 -0.47 0.00 0.00 55.73 56.82 2j9d s ARG 82 Cb 0.13 -2.40 0.00 0.00 -0.57 0.00 0.00 34.95 32.11 2j9d s ARG 82 CO 0.86 -0.38 0.00 0.25 -1.08 0.00 0.00 175.30 174.95 2j9d n THR 83 N -0.43 0.00 -0.44 4.99 -2.24 -1.26 -5.02 114.28 109.88 2j9d n THR 83 Ca 0.07 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2j9d n THR 83 Cb 0.49 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 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 1.49 0.89 3.80 3.38 0.00 -1.26 -5.06 105.19 108.42 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 -3.01 5.70 0.24 1.61 0.01 -1.26 -5.09 114.94 113.15 2j9d s ASN 85 Ca 0.00 0.08 -0.31 0.00 -0.71 0.00 0.00 52.86 51.92 2j9d s ASN 85 Cb 0.00 -1.60 -0.14 0.00 0.41 0.00 0.00 41.25 39.92 2j9d s ASN 85 CO 0.00 0.20 1.22 -2.65 -1.51 0.00 0.00 177.10 174.35 2j9d n PRO 86 N 0.62 1.59 0.00 -0.60 -0.02 -1.26 -3.28 135.00 132.05 2j9d n PRO 86 Ca -0.09 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2j9d n PRO 86 Cb 0.52 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 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 1.73 1.07 0.24 -1.23 0.00 -1.26 -4.99 105.19 100.74 2j9d n GLY 87 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.90 -3.42 116.42 111.03 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 0.19 0.00 0.61 -1.72 0.00 0.00 179.24 178.32 2j9d n GLY 89 N -0.69 -0.34 3.06 2.75 0.00 -1.26 -4.24 105.19 104.46 2j9d n GLY 89 Ca -0.02 -2.25 -0.09 0.00 0.00 0.00 0.00 46.02 43.66 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 -0.19 0.52 -0.06 1.61 -0.14 -1.09 -4.99 119.74 115.39 2j9d s LYS 90 Ca 0.00 -0.95 0.05 0.00 -1.36 0.00 0.00 55.97 53.72 2j9d s LYS 90 Cb 0.00 0.04 -0.01 0.00 -1.68 0.00 0.00 37.83 36.18 2j9d s LYS 90 CO 0.00 -0.05 -0.22 0.42 -0.76 0.00 0.00 175.35 174.73 2j9d s ILE 91 N -2.60 1.86 -0.03 2.17 1.01 -1.26 -1.22 121.20 121.14 2j9d s ILE 91 Ca -0.03 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 59.74 2j9d s ILE 91 Cb -0.02 -1.59 -0.02 0.00 0.01 0.00 0.00 42.46 40.85 2j9d s ILE 91 CO -0.04 0.52 -0.25 -0.36 0.00 0.00 0.00 174.94 174.81 2j9d s PHE 92 N -0.03 2.38 -0.21 3.97 0.08 0.60 -4.98 117.98 119.79 2j9d s PHE 92 Ca -0.06 -0.46 -0.04 0.00 0.12 0.00 0.00 56.93 56.49 2j9d s PHE 92 Cb -0.14 -1.53 -0.02 0.00 -0.57 0.00 0.00 43.02 40.77 2j9d s PHE 92 CO 0.04 -0.05 -0.02 0.08 -0.10 0.00 0.00 175.22 175.17 2j9d s VAL 93 N -0.54 3.69 -0.05 -0.44 1.01 -1.26 -0.56 120.40 122.24 2j9d s VAL 93 Ca 0.08 -0.40 0.04 0.00 0.00 0.00 0.00 61.98 61.70 2j9d s VAL 93 Cb -0.11 -2.67 -0.00 0.00 0.00 0.00 0.00 36.38 33.60 2j9d s VAL 93 CO -0.00 0.43 -0.19 -0.63 0.00 0.00 0.00 175.10 174.71 2j9d s ILE 94 N 1.18 1.58 0.28 2.22 1.01 0.08 -4.97 121.20 122.58 2j9d s ILE 94 Ca 0.03 -0.79 -0.29 0.00 0.00 0.00 0.00 60.65 59.59 2j9d s ILE 94 Cb -0.14 -1.36 -0.10 0.00 0.01 0.00 0.00 42.46 40.87 2j9d s ILE 94 CO 0.00 0.45 1.20 -2.16 0.00 0.00 0.00 174.94 174.43 2j9d s PRO 95 N 0.07 4.51 -0.17 2.79 0.04 -1.26 -0.19 135.00 140.79 2j9d s PRO 95 Ca -0.06 1.97 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 2j9d s PRO 95 Cb -0.13 -3.15 -0.00 0.00 0.04 0.00 0.00 34.50 31.26 2j9d s PRO 95 CO 0.03 0.01 -0.13 0.08 0.04 0.00 0.00 177.00 177.03 2j9d s VAL 96 N -0.95 2.83 -0.17 -0.36 1.01 -0.93 -4.79 120.40 117.04 2j9d s VAL 96 Ca 0.48 -0.70 0.18 0.00 0.00 0.00 0.00 61.98 61.93 2j9d s VAL 96 Cb -0.35 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 2j9d s VAL 96 CO 0.45 0.50 1.02 -0.33 0.00 0.00 0.00 175.10 176.74 2j9d h GLU 97 N 7.48 0.00 -2.70 2.72 5.08 -1.96 -3.35 114.58 121.85 2j9d h GLU 97 Ca -0.35 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.89 2j9d h GLU 97 Cb 1.18 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.20 2j9d h GLU 97 CO 0.58 0.24 -0.20 0.50 -1.00 0.00 0.00 179.01 179.14 2j9d s ARG 98 N -3.05 0.56 -0.06 2.33 3.52 -1.26 -4.99 118.95 116.00 2j9d s ARG 98 Ca -0.01 0.46 0.02 0.00 -0.13 0.00 0.00 55.73 56.08 2j9d s ARG 98 Cb 0.08 0.27 0.01 0.00 -1.56 0.00 0.00 34.95 33.76 2j9d s ARG 98 CO 0.79 -0.09 -0.11 0.08 -0.81 0.00 0.00 175.30 175.15 2j9d s VAL 99 N -0.08 1.06 -0.08 7.11 1.01 -1.26 -5.04 120.40 123.11 2j9d s VAL 99 Ca -0.03 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2j9d s VAL 99 Cb -0.03 -0.98 0.02 0.00 0.00 0.00 0.00 36.38 35.39 2j9d s VAL 99 CO 0.02 0.34 -0.09 -0.69 0.00 0.00 0.00 175.10 174.68 2j9d s VAL 100 N 0.70 0.97 -0.20 2.92 1.01 -1.26 -1.90 120.40 122.63 2j9d s VAL 100 Ca -0.14 -0.32 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 2j9d s VAL 100 Cb -0.16 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.27 2j9d s VAL 100 CO 0.03 0.34 1.00 -0.60 0.00 0.00 0.00 175.10 175.87 2j9d s ARG 101 N 1.22 4.28 0.29 2.72 3.52 0.09 -4.94 118.95 126.14 2j9d s ARG 101 Ca -0.05 1.30 -0.01 0.00 -0.13 0.00 0.00 55.73 56.85 2j9d s ARG 101 Cb -0.14 -3.62 0.47 0.00 -1.56 0.00 0.00 34.95 30.11 2j9d s ARG 101 CO -0.02 -0.54 1.91 0.28 -0.81 0.00 0.00 175.30 176.11 2j9d h VAL 102 N 5.37 1.09 -0.45 7.11 2.07 -1.95 0.21 116.25 129.69 2j9d h VAL 102 Ca -0.22 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2j9d h VAL 102 Cb 1.08 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2j9d h VAL 102 CO 0.94 0.20 0.18 -0.09 0.02 0.00 0.00 177.57 178.82 2j9d h ARG 103 N 1.10 0.67 0.00 1.57 2.43 -1.97 -3.32 114.38 114.86 2j9d h ARG 103 Ca 0.40 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2j9d h ARG 103 Cb 0.16 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 2j9d h ARG 103 CO -0.15 0.61 -0.41 0.25 -1.51 0.00 0.00 179.97 178.76 2j9d n THR 104 N -4.60 0.00 -1.01 0.20 -2.24 -1.19 -4.99 114.28 100.45 2j9d n THR 104 Ca 0.01 -0.32 -0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2j9d n THR 104 Cb 0.15 0.95 -0.00 0.00 -2.10 0.00 0.00 70.33 69.33 2j9d n THR 104 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2j9d n LYS 105 N -1.21 -1.91 -1.78 -0.78 0.00 0.72 -4.98 118.16 108.22 2j9d n LYS 105 Ca 0.01 0.49 -0.40 0.00 0.00 0.00 0.00 58.31 58.42 2j9d n LYS 105 Cb 0.12 -4.93 0.02 0.00 0.00 0.00 0.00 35.03 30.24 2j9d n LYS 105 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 2j9d s GLU 106 N -1.96 3.66 0.32 1.64 2.02 -1.25 -4.70 118.70 118.43 2j9d s GLU 106 Ca 0.00 2.43 0.10 0.00 0.02 0.00 0.00 54.97 57.52 2j9d s GLU 106 Cb 0.00 -2.64 -0.06 0.00 0.10 0.00 0.00 34.13 31.53 2j9d s GLU 106 CO 0.00 -0.85 -0.12 -1.21 0.02 0.00 0.00 175.26 173.11 2j9d s GLU 107 N -2.47 1.81 3.46 1.61 2.02 -1.26 -0.73 118.70 123.13 2j9d s GLU 107 Ca 0.61 -1.86 0.00 0.00 0.02 0.00 0.00 54.97 53.75 2j9d s GLU 107 Cb -0.44 -1.75 0.00 0.00 0.10 0.00 0.00 34.13 32.04 2j9d s GLU 107 CO 0.56 0.21 0.00 0.41 0.02 0.00 0.00 175.26 176.46 2j9d n GLY 108 N -0.75 0.03 0.18 -1.39 0.00 -0.80 -3.71 105.19 98.75 2j9d n GLY 108 Ca -0.05 -1.04 0.05 0.00 0.00 0.00 0.00 46.02 44.98 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 0.00 1.61 2.10 -1.92 -1.80 116.57 116.57 2j9d h LYS 109 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2j9d h LYS 109 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2j9d h LYS 109 CO 0.00 0.40 0.00 1.05 -2.00 0.00 0.00 179.45 178.90 2j9d h GLU 110 N 0.00 0.00 0.00 0.07 9.09 -1.96 -2.23 114.58 119.55 2j9d h GLU 110 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2j9d h GLU 110 Cb 0.97 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.07 2j9d h GLU 110 CO 0.05 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.11 2j9d h ALA 111 N 2.16 1.00 -0.03 1.06 0.00 -1.40 -3.46 119.26 118.59 2j9d h ALA 111 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2j9d h ALA 111 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2j9d h ALA 111 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53