#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 7.30 0.03 1.61 0.15 -1.26 -4.97 113.70 116.55 2j9d s SER 0 Ca 0.00 1.57 0.08 0.00 0.70 0.00 0.00 55.95 58.30 2j9d s SER 0 Cb 0.00 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.75 2j9d s SER 0 CO 0.00 -0.23 -0.24 -0.04 1.20 0.00 0.00 173.24 173.93 2j9d s MET 1 N 0.94 1.72 0.02 5.44 1.00 -1.26 -1.37 119.30 125.80 2j9d s MET 1 Ca 0.49 -0.98 0.04 0.00 0.00 0.00 0.00 55.69 55.23 2j9d s MET 1 Cb -0.20 -1.81 -0.02 0.00 0.00 0.00 0.00 34.83 32.80 2j9d s MET 1 CO 0.26 0.48 -0.11 0.15 0.00 0.00 0.00 175.02 175.80 2j9d s LYS 2 N -1.01 0.79 -0.24 2.03 -0.14 -0.07 -1.61 119.74 119.49 2j9d s LYS 2 Ca 0.10 -0.59 -0.15 0.00 -1.36 0.00 0.00 55.97 53.97 2j9d s LYS 2 Cb -0.09 -0.75 -0.04 0.00 -1.68 0.00 0.00 37.83 35.27 2j9d s LYS 2 CO 0.01 0.19 0.38 0.21 -0.76 0.00 0.00 175.35 175.38 2j9d s LYS 3 N -0.84 4.09 -0.30 1.68 2.20 0.62 -0.92 119.74 126.26 2j9d s LYS 3 Ca 0.01 0.10 -0.14 0.00 -0.36 0.00 0.00 55.97 55.58 2j9d s LYS 3 Cb -0.06 -3.60 -0.03 0.00 -1.51 0.00 0.00 37.83 32.63 2j9d s LYS 3 CO 0.00 -0.16 0.34 0.08 -0.36 0.00 0.00 175.35 175.25 2j9d s VAL 4 N 1.71 5.20 -0.19 4.02 1.01 0.38 -0.69 120.40 131.84 2j9d s VAL 4 Ca 0.17 0.27 -0.03 0.00 0.00 0.00 0.00 61.98 62.39 2j9d s VAL 4 Cb -0.15 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 2j9d s VAL 4 CO 0.09 0.07 -0.07 -1.61 0.00 0.00 0.00 175.10 173.57 2j9d s GLU 5 N 1.99 3.41 -0.10 2.72 2.02 0.27 -1.01 118.70 127.99 2j9d s GLU 5 Ca 0.12 -0.63 0.03 0.00 0.02 0.00 0.00 54.97 54.51 2j9d s GLU 5 Cb -0.16 -2.88 -0.01 0.00 0.10 0.00 0.00 34.13 31.18 2j9d s GLU 5 CO 0.11 -0.03 -0.21 0.00 0.02 0.00 0.00 175.26 175.15 2j9d s ALA 6 N 1.02 2.29 -0.30 5.21 0.00 0.18 -0.24 121.76 129.92 2j9d s ALA 6 Ca -0.00 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.93 2j9d s ALA 6 Cb -0.15 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.08 2j9d s ALA 6 CO -0.00 0.30 0.10 0.42 0.00 0.00 0.00 175.76 176.58 2j9d s ILE 7 N 0.26 4.12 0.34 0.00 1.01 -0.16 -0.28 121.20 126.48 2j9d s ILE 7 Ca -0.15 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 59.89 2j9d s ILE 7 Cb -0.17 -3.13 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 2j9d s ILE 7 CO 0.07 0.06 0.14 0.27 0.00 0.00 0.00 174.94 175.49 2j9d s ILE 8 N 1.52 0.49 0.27 2.92 -4.36 -0.16 -2.39 121.20 119.50 2j9d s ILE 8 Ca 0.03 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.12 2j9d s ILE 8 Cb -0.17 -2.50 -0.10 0.00 1.25 0.00 0.00 42.46 40.95 2j9d s ILE 8 CO 0.03 0.00 1.28 -0.13 0.24 0.00 0.00 174.94 176.37 2j9d s ARG 9 N -3.78 4.41 0.43 0.37 0.52 -1.26 -1.28 118.95 118.36 2j9d s ARG 9 Ca 0.32 2.09 0.13 0.00 -0.52 0.00 0.00 55.73 57.76 2j9d s ARG 9 Cb 0.05 -3.14 1.01 0.00 0.52 0.00 0.00 34.95 33.38 2j9d s ARG 9 CO 0.17 -0.16 1.98 -1.35 0.02 0.00 0.00 175.30 175.96 2j9d h PRO 10 N 4.34 0.42 0.00 3.54 0.11 -1.89 -1.25 132.00 137.27 2j9d h PRO 10 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2j9d h PRO 10 Cb 1.22 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2j9d h PRO 10 CO 0.71 0.28 0.00 0.39 -0.21 0.00 0.00 178.00 179.17 2j9d n GLU 11 N -4.47 0.08 0.00 1.05 4.71 -1.26 -2.54 120.64 118.21 2j9d n GLU 11 Ca 0.10 0.16 0.12 0.00 -0.01 0.00 0.00 57.16 57.52 2j9d n GLU 11 Cb 0.35 -1.50 0.10 0.00 -1.01 0.00 0.00 31.44 29.38 2j9d n GLU 11 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2j9d n LYS 12 N -1.44 1.07 -0.03 3.49 4.76 -0.47 -4.55 118.16 121.00 2j9d n LYS 12 Ca 0.06 -0.83 -0.09 0.00 -2.87 0.00 0.00 58.31 54.57 2j9d n LYS 12 Cb 0.20 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 31.87 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 2.04 0.01 -0.22 -0.35 5.85 -1.56 -1.65 115.31 119.43 2j9d h LEU 13 Ca 0.00 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2j9d h LEU 13 Cb 0.68 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2j9d h LEU 13 CO 0.00 0.03 0.14 -0.33 -0.34 0.00 0.00 178.44 177.94 2j9d h GLU 14 N 0.11 0.30 -0.25 1.25 4.39 -1.81 -0.23 114.58 118.33 2j9d h GLU 14 Ca 0.08 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 2j9d h GLU 14 Cb 0.07 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2j9d h GLU 14 CO -0.10 0.23 0.04 0.97 -1.16 0.00 0.00 179.01 178.99 2j9d h ILE 15 N 0.28 1.23 -0.47 3.13 6.09 -1.83 -1.92 117.51 124.01 2j9d h ILE 15 Ca 0.08 -0.76 -0.00 0.00 -1.37 0.00 0.00 64.86 62.80 2j9d h ILE 15 Cb 0.01 1.24 -0.02 0.00 0.47 0.00 0.00 36.82 38.52 2j9d h ILE 15 CO -0.02 0.24 0.28 0.58 -3.07 0.00 0.00 178.15 176.17 2j9d h VAL 16 N 0.23 1.14 -0.72 2.19 2.07 -1.17 -0.99 116.25 119.00 2j9d h VAL 16 Ca 0.08 -0.32 0.03 0.00 0.82 0.00 0.00 66.70 67.31 2j9d h VAL 16 Cb 0.32 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 2j9d h VAL 16 CO 0.00 0.14 0.45 0.11 0.02 0.00 0.00 177.57 178.30 2j9d h LYS 17 N 0.62 0.86 -0.04 1.57 1.57 -0.97 -0.44 116.57 119.75 2j9d h LYS 17 Ca 0.17 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2j9d h LYS 17 Cb -0.01 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 2j9d h LYS 17 CO -0.03 0.57 0.00 -0.22 -0.57 0.00 0.00 179.45 179.20 2j9d h LYS 18 N 0.89 0.07 -0.62 3.15 3.64 -0.98 -1.10 116.57 121.60 2j9d h LYS 18 Ca 0.29 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.70 2j9d h LYS 18 Cb 0.01 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 2j9d h LYS 18 CO -0.11 0.34 0.34 0.00 -2.27 0.00 0.00 179.45 177.75 2j9d h ALA 19 N 0.72 0.82 -0.30 5.00 0.00 -1.05 0.88 119.26 125.34 2j9d h ALA 19 Ca 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2j9d h ALA 19 Cb 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2j9d h ALA 19 CO 0.00 0.01 0.17 -0.07 0.00 0.00 0.00 179.25 179.37 2j9d h LEU 20 N 0.64 0.36 -0.50 0.00 3.38 -1.03 -2.17 115.31 115.98 2j9d h LEU 20 Ca 0.28 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.20 2j9d h LEU 20 Cb 0.16 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2j9d h LEU 20 CO -0.17 0.32 0.31 -1.28 0.09 0.00 0.00 178.44 177.70 2j9d h SER 21 N 0.37 0.50 0.22 -0.43 0.87 -0.73 -0.74 113.55 113.61 2j9d h SER 21 Ca 0.11 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2j9d h SER 21 Cb 0.03 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 61.88 2j9d h SER 21 CO -0.02 0.35 -0.07 0.44 -0.53 0.00 0.00 176.83 177.01 2j9d h ASP 22 N 0.61 0.00 -0.21 6.23 3.32 -0.61 -1.34 116.42 124.42 2j9d h ASP 22 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2j9d h ASP 22 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2j9d h ASP 22 CO -0.08 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.51 2j9d n ALA 23 N -2.29 2.50 -0.08 3.45 0.00 -0.83 -4.94 120.51 118.32 2j9d n ALA 23 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2j9d n ALA 23 Cb 0.17 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 1.22 0.67 3.30 0.00 0.00 -0.50 -5.04 105.19 104.85 2j9d n GLY 24 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.11 3.68 -0.18 1.61 1.51 -0.35 -4.86 117.35 116.66 2j9d s TYR 25 Ca 0.00 -2.00 0.16 0.00 -1.01 0.00 0.00 57.07 54.22 2j9d s TYR 25 Cb 0.00 -3.75 -0.24 0.00 -0.11 0.00 0.00 41.96 37.86 2j9d s TYR 25 CO 0.00 -0.98 0.15 1.33 -1.11 0.00 0.00 175.55 174.94 2j9d n VAL 26 N 4.05 1.44 -2.61 0.71 0.24 -1.26 -3.15 118.33 117.74 2j9d n VAL 26 Ca 0.10 -0.83 -0.43 0.00 -2.04 0.00 0.00 64.34 61.14 2j9d n VAL 26 Cb 0.45 -0.63 -0.02 0.00 -1.47 0.00 0.00 33.84 32.18 2j9d n VAL 26 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2j9d s GLY 27 N -5.50 1.50 0.07 7.63 0.00 -1.26 -4.99 107.32 104.78 2j9d s GLY 27 Ca -0.11 -0.09 -0.13 0.00 0.00 0.00 0.00 44.72 44.39 2j9d s GLY 27 CO 0.81 2.33 0.29 -3.16 0.00 0.00 0.00 173.10 173.37 2j9d s MET 28 N 3.82 0.86 -0.06 2.90 0.00 -1.26 -4.64 119.30 120.91 2j9d s MET 28 Ca 0.47 -0.66 0.05 0.00 0.00 0.00 0.00 55.69 55.56 2j9d s MET 28 Cb -0.12 0.37 -0.01 0.00 0.00 0.00 0.00 34.83 35.07 2j9d s MET 28 CO 0.18 -0.29 -0.24 0.99 0.00 0.00 0.00 175.02 175.67 2j9d s THR 29 N -3.11 1.99 -0.06 3.16 2.01 -0.20 -4.98 115.64 114.45 2j9d s THR 29 Ca -0.01 -1.02 0.04 0.00 0.31 0.00 0.00 61.69 61.01 2j9d s THR 29 Cb 0.01 -1.69 -0.00 0.00 0.01 0.00 0.00 72.50 70.83 2j9d s THR 29 CO -0.07 0.55 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.52 2j9d s VAL 30 N -0.04 1.69 0.03 3.82 1.01 -1.26 -0.50 120.40 125.15 2j9d s VAL 30 Ca -0.07 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2j9d s VAL 30 Cb -0.14 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 2j9d s VAL 30 CO 0.05 0.48 -0.06 -0.94 0.00 0.00 0.00 175.10 174.63 2j9d s SER 31 N 0.12 0.58 -0.12 3.32 1.04 -0.42 -5.00 113.70 113.23 2j9d s SER 31 Ca -0.08 -0.47 -0.23 0.00 0.48 0.00 0.00 55.95 55.65 2j9d s SER 31 Cb -0.14 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 2j9d s SER 31 CO 0.04 -0.21 0.69 -1.61 0.98 0.00 0.00 173.24 173.13 2j9d s GLU 32 N -1.36 4.35 0.40 4.02 2.02 -1.26 -0.61 118.70 126.26 2j9d s GLU 32 Ca -0.11 0.81 0.05 0.00 0.02 0.00 0.00 54.97 55.75 2j9d s GLU 32 Cb -0.09 -3.50 -0.02 0.00 0.10 0.00 0.00 34.13 30.62 2j9d s GLU 32 CO -0.00 -0.08 0.19 0.14 0.02 0.00 0.00 175.26 175.54 2j9d s VAL 33 N 1.31 0.33 0.04 2.63 -7.23 -0.67 -4.94 120.40 111.86 2j9d s VAL 33 Ca 0.35 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.58 2j9d s VAL 33 Cb -0.17 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.41 2j9d s VAL 33 CO 0.15 0.00 -0.20 -0.54 -0.31 0.00 0.00 175.10 174.20 2j9d s LYS 34 N -3.56 1.31 0.00 4.82 1.02 -1.26 -0.80 119.74 121.26 2j9d s LYS 34 Ca 0.28 -0.91 0.00 0.00 0.02 0.00 0.00 55.97 55.36 2j9d s LYS 34 Cb 0.01 -1.40 0.00 0.00 -0.52 0.00 0.00 37.83 35.92 2j9d s LYS 34 CO 0.19 0.36 0.00 0.41 -0.92 0.00 0.00 175.35 175.39 2j9d n GLY 35 N 1.86 3.87 3.69 -3.33 0.00 -1.07 -4.90 105.19 105.31 2j9d n GLY 35 Ca -0.17 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 2j9d n GLY 35 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2j9d s ARG 36 N -2.62 0.37 0.00 1.61 1.70 -1.25 -4.63 118.95 114.14 2j9d s ARG 36 Ca 0.00 0.38 0.00 0.00 -0.47 0.00 0.00 55.73 55.64 2j9d s ARG 36 Cb 0.00 -1.74 0.00 0.00 -0.57 0.00 0.00 34.95 32.64 2j9d s ARG 36 CO 0.00 -2.74 0.00 0.41 -1.08 0.00 0.00 175.30 171.89 2j9d n GLY 37 N -1.35 4.41 0.00 3.88 0.00 -1.26 -4.60 105.19 106.28 2j9d n GLY 37 Ca 0.06 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2j9d n GLY 37 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2j9d n VAL 38 N -1.49 0.00 0.00 1.61 0.24 -1.26 -5.11 118.33 112.32 2j9d n VAL 38 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2j9d n VAL 38 Cb 0.00 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 2j9d n VAL 38 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2j9d n VAL 53 N 0.00 0.00 -1.46 3.34 0.31 -1.26 -5.24 118.33 114.02 2j9d n VAL 53 Ca 0.00 0.00 0.19 0.00 -0.01 0.00 0.00 64.34 64.52 2j9d n VAL 53 Cb 0.04 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.90 2j9d n VAL 53 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2j9d n ASP 54 N 0.00 -8.70 -4.71 4.52 2.03 -1.26 -4.91 116.55 103.52 2j9d n ASP 54 Ca 0.00 0.97 -0.39 0.00 0.52 0.00 0.00 54.79 55.88 2j9d n ASP 54 Cb 0.00 -4.67 -0.05 0.00 -0.72 0.00 0.00 41.12 35.68 2j9d n ASP 54 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2j9d s LEU 55 N -7.20 4.29 0.29 -2.67 2.01 -1.26 -3.79 118.68 110.35 2j9d s LEU 55 Ca 0.00 1.03 0.12 0.00 0.01 0.00 0.00 54.13 55.29 2j9d s LEU 55 Cb 0.00 -2.93 -0.05 0.00 0.01 0.00 0.00 46.19 43.22 2j9d s LEU 55 CO 0.00 -0.09 -0.19 0.27 1.01 0.00 0.00 176.35 177.35 2j9d s ILE 56 N 0.84 2.44 0.34 -0.59 -4.36 -1.26 -4.79 121.20 113.82 2j9d s ILE 56 Ca 0.33 -2.38 -0.29 0.00 -0.26 0.00 0.00 60.65 58.05 2j9d s ILE 56 Cb -0.17 -2.34 -0.11 0.00 1.25 0.00 0.00 42.46 41.10 2j9d s ILE 56 CO 0.15 -0.38 1.43 -2.84 0.24 0.00 0.00 174.94 173.54 2j9d s PRO 57 N -3.52 4.21 0.19 0.37 0.02 -1.26 -2.58 135.00 132.43 2j9d s PRO 57 Ca 0.30 2.42 -0.01 0.00 0.02 0.00 0.00 61.00 63.73 2j9d s PRO 57 Cb -0.04 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 2j9d s PRO 57 CO 0.15 -0.41 0.10 0.15 -0.33 0.00 0.00 177.00 176.67 2j9d s LYS 58 N -1.63 1.15 -0.07 5.54 -0.14 0.02 -4.55 119.74 120.06 2j9d s LYS 58 Ca 0.53 -1.60 0.05 0.00 -1.36 0.00 0.00 55.97 53.59 2j9d s LYS 58 Cb -0.44 0.19 -0.01 0.00 -1.68 0.00 0.00 37.83 35.89 2j9d s LYS 58 CO 0.56 -0.34 -0.22 0.08 -0.76 0.00 0.00 175.35 174.67 2j9d s VAL 59 N -4.07 2.30 -0.28 3.17 1.01 -0.40 -1.67 120.40 120.45 2j9d s VAL 59 Ca 0.35 -0.97 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 2j9d s VAL 59 Cb 0.07 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2j9d s VAL 59 CO 0.09 0.56 0.13 -0.75 0.00 0.00 0.00 175.10 175.14 2j9d s LYS 60 N -0.08 3.63 -0.17 2.72 2.20 0.22 -0.98 119.74 127.28 2j9d s LYS 60 Ca -0.05 -0.51 -0.07 0.00 -0.36 0.00 0.00 55.97 54.98 2j9d s LYS 60 Cb -0.14 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 2j9d s LYS 60 CO 0.04 -0.26 0.06 0.42 -0.36 0.00 0.00 175.35 175.26 2j9d s ILE 61 N 1.65 4.83 -0.14 5.43 1.01 0.61 -1.30 121.20 133.30 2j9d s ILE 61 Ca 0.06 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 60.70 2j9d s ILE 61 Cb -0.16 -3.15 0.01 0.00 0.01 0.00 0.00 42.46 39.17 2j9d s ILE 61 CO 0.06 0.49 -0.20 -1.61 0.00 0.00 0.00 174.94 173.69 2j9d s GLU 62 N 0.08 2.81 -0.07 2.79 2.02 0.34 -0.65 118.70 126.03 2j9d s GLU 62 Ca 0.05 -0.78 0.01 0.00 0.02 0.00 0.00 54.97 54.28 2j9d s GLU 62 Cb -0.12 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.81 2j9d s GLU 62 CO 0.01 -0.06 -0.09 -0.51 0.02 0.00 0.00 175.26 174.63 2j9d s LEU 63 N 0.93 1.45 -0.25 1.80 1.02 -0.18 -1.03 118.68 122.42 2j9d s LEU 63 Ca -0.05 -0.25 -0.13 0.00 0.02 0.00 0.00 54.13 53.73 2j9d s LEU 63 Cb -0.15 -0.72 -0.05 0.00 0.02 0.00 0.00 46.19 45.30 2j9d s LEU 63 CO -0.03 -0.02 0.26 -0.69 0.02 0.00 0.00 176.35 175.88 2j9d s VAL 64 N 0.95 5.27 0.13 -1.59 1.01 -1.26 -0.47 120.40 124.45 2j9d s VAL 64 Ca -0.10 0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.25 2j9d s VAL 64 Cb -0.15 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 2j9d s VAL 64 CO 0.00 0.26 0.00 0.68 0.00 0.00 0.00 175.10 176.04 2j9d s VAL 65 N 1.54 0.47 0.48 2.92 -7.23 -0.09 -4.96 120.40 113.52 2j9d s VAL 65 Ca 0.11 -1.93 -0.24 0.00 -1.81 0.00 0.00 61.98 58.11 2j9d s VAL 65 Cb -0.15 -1.95 -0.08 0.00 0.56 0.00 0.00 36.38 34.76 2j9d s VAL 65 CO 0.08 -0.61 1.28 0.29 -0.31 0.00 0.00 175.10 175.83 2j9d n LYS 66 N -0.12 1.79 -0.21 4.82 5.02 -1.26 -0.89 118.16 127.31 2j9d n LYS 66 Ca -0.08 0.65 0.15 0.00 -2.02 0.00 0.00 58.31 57.00 2j9d n LYS 66 Cb 0.63 -2.44 0.47 0.00 -0.02 0.00 0.00 35.03 33.67 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 1.77 0.48 0.00 1.97 4.81 -1.56 -1.48 114.58 120.57 2j9d h GLU 67 Ca -0.49 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2j9d h GLU 67 Cb 1.30 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 2j9d h GLU 67 CO 0.58 0.32 -0.02 1.05 -0.73 0.00 0.00 179.01 180.21 2j9d h GLU 68 N 0.50 0.00 -0.01 1.92 4.11 -1.90 -2.63 114.58 116.57 2j9d h GLU 68 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.84 2j9d h GLU 68 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2j9d h GLU 68 CO -0.15 0.02 -0.40 -0.25 0.07 0.00 0.00 179.01 178.30 2j9d n ASP 69 N -3.18 1.11 -0.11 3.06 8.00 -0.56 -4.53 116.55 120.34 2j9d n ASP 69 Ca -0.01 -0.90 -0.09 0.00 0.71 0.00 0.00 54.79 54.50 2j9d n ASP 69 Cb 0.19 0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 41.56 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 1.12 1.15 -0.57 2.53 2.07 -1.53 -1.32 116.25 119.71 2j9d h VAL 70 Ca 0.00 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.12 2j9d h VAL 70 Cb 0.55 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 2j9d h VAL 70 CO 0.00 0.16 0.35 0.44 0.02 0.00 0.00 177.57 178.54 2j9d h ASP 71 N 0.42 0.57 -0.40 0.57 3.32 -1.80 -0.87 116.42 118.23 2j9d h ASP 71 Ca 0.12 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 2j9d h ASP 71 Cb 0.10 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2j9d h ASP 71 CO -0.02 0.40 0.13 -1.13 -1.72 0.00 0.00 179.24 176.91 2j9d h ASN 72 N 0.69 0.58 -0.22 6.45 -1.24 -1.78 -0.99 115.58 119.07 2j9d h ASN 72 Ca 0.23 -0.20 0.01 0.00 0.71 0.00 0.00 56.30 57.05 2j9d h ASN 72 Cb 0.02 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 38.90 2j9d h ASN 72 CO -0.10 0.63 0.13 0.58 -1.29 0.00 0.00 177.43 177.38 2j9d h VAL 73 N 0.51 1.03 -0.54 2.57 2.07 -0.96 -1.41 116.25 119.51 2j9d h VAL 73 Ca 0.13 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.59 2j9d h VAL 73 Cb 0.25 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2j9d h VAL 73 CO -0.01 0.05 0.32 0.40 0.02 0.00 0.00 177.57 178.35 2j9d h ILE 74 N 0.27 1.04 -0.24 4.57 2.04 -1.01 -1.17 117.51 123.00 2j9d h ILE 74 Ca 0.09 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2j9d h ILE 74 Cb -0.01 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 2j9d h ILE 74 CO -0.04 0.12 0.12 -0.78 0.00 0.00 0.00 178.15 177.57 2j9d h ASP 75 N 0.63 0.31 -0.51 1.72 1.82 -0.95 -0.80 116.42 118.65 2j9d h ASP 75 Ca 0.22 -0.12 0.05 0.00 -0.39 0.00 0.00 57.03 56.80 2j9d h ASP 75 Cb 0.04 -0.08 -0.05 0.00 0.68 0.00 0.00 39.33 39.92 2j9d h ASP 75 CO -0.11 0.34 0.25 0.40 -1.61 0.00 0.00 179.24 178.51 2j9d h ILE 76 N 0.26 0.93 0.06 2.25 2.04 -1.05 -0.92 117.51 121.09 2j9d h ILE 76 Ca 0.08 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 2j9d h ILE 76 Cb 0.11 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2j9d h ILE 76 CO -0.01 0.09 -0.03 0.40 0.00 0.00 0.00 178.15 178.60 2j9d h ILE 77 N 0.48 1.07 -0.44 -0.67 2.04 -0.99 -2.20 117.51 116.80 2j9d h ILE 77 Ca 0.23 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.68 2j9d h ILE 77 Cb 0.16 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 2j9d h ILE 77 CO -0.17 0.11 0.27 0.00 0.00 0.00 0.00 178.15 178.35 2j9d h GLU 79 N 0.55 1.07 0.00 0.00 4.39 -1.10 -2.27 114.58 117.21 2j9d h GLU 79 Ca 0.17 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 2j9d h GLU 79 Cb -0.01 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 2j9d h GLU 79 CO -0.07 0.71 -1.20 0.09 -1.16 0.00 0.00 179.01 177.38 2j9d n ASN 80 N -4.53 0.77 0.06 1.42 4.13 -0.84 -4.29 115.26 111.98 2j9d n ASN 80 Ca 0.10 0.31 0.08 0.00 1.68 0.00 0.00 54.58 56.74 2j9d n ASN 80 Cb 0.05 0.53 -0.06 0.00 -1.54 0.00 0.00 39.78 38.76 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 -2.24 2.39 -1.78 5.41 0.00 0.77 -4.64 120.51 120.42 2j9d n ALA 81 Ca -0.03 -0.40 -0.37 0.00 0.00 0.00 0.00 53.44 52.64 2j9d n ALA 81 Cb 0.62 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 19.08 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 -3.25 3.97 0.00 0.00 1.70 -0.86 -4.84 118.95 115.66 2j9d s ARG 82 Ca -0.03 1.61 0.00 0.00 -0.47 0.00 0.00 55.73 56.84 2j9d s ARG 82 Cb 0.10 -2.45 0.00 0.00 -0.57 0.00 0.00 34.95 32.03 2j9d s ARG 82 CO 0.82 -0.33 0.00 0.25 -1.08 0.00 0.00 175.30 174.96 2j9d n THR 83 N -0.31 0.00 -0.27 4.99 -2.24 -1.26 -5.03 114.28 110.16 2j9d n THR 83 Ca 0.06 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2j9d n THR 83 Cb 0.49 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 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 1.52 0.68 3.71 3.38 0.00 -1.26 -5.08 105.19 108.15 2j9d n GLY 84 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.95 5.01 0.41 1.61 -0.87 -1.26 -5.09 114.94 111.79 2j9d s ASN 85 Ca 0.00 -0.34 -0.26 0.00 -1.57 0.00 0.00 52.86 50.69 2j9d s ASN 85 Cb 0.00 -1.14 -0.10 0.00 -0.02 0.00 0.00 41.25 39.99 2j9d s ASN 85 CO 0.00 0.06 1.30 -2.65 -2.57 0.00 0.00 177.10 173.25 2j9d n PRO 86 N -0.36 2.04 0.00 -0.60 -0.02 -1.26 -3.31 135.00 131.49 2j9d n PRO 86 Ca -0.09 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2j9d n PRO 86 Cb 0.56 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 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 0.76 1.03 0.22 -1.23 0.00 -1.26 -4.99 105.19 99.71 2j9d n GLY 87 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 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 -4.66 1.61 5.19 -1.91 -3.42 116.42 113.23 2j9d h ASP 88 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2j9d h ASP 88 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2j9d h ASP 88 CO 0.00 0.26 0.00 0.61 -3.12 0.00 0.00 179.24 176.99 2j9d n GLY 89 N -0.40 -0.59 3.09 2.75 0.00 -1.26 -4.26 105.19 104.52 2j9d n GLY 89 Ca -0.01 -2.20 -0.10 0.00 0.00 0.00 0.00 46.02 43.70 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 0.00 0.50 -0.05 1.61 1.02 -1.01 -5.00 119.74 116.82 2j9d s LYS 90 Ca 0.00 -0.59 0.06 0.00 0.02 0.00 0.00 55.97 55.46 2j9d s LYS 90 Cb 0.00 0.20 -0.01 0.00 -0.52 0.00 0.00 37.83 37.50 2j9d s LYS 90 CO 0.00 -0.12 -0.24 0.42 -0.92 0.00 0.00 175.35 174.49 2j9d s ILE 91 N -1.95 1.98 0.01 2.17 1.01 -1.26 -0.99 121.20 122.18 2j9d s ILE 91 Ca -0.11 -1.03 0.09 0.00 0.00 0.00 0.00 60.65 59.60 2j9d s ILE 91 Cb -0.05 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 2j9d s ILE 91 CO -0.02 0.55 -0.26 -0.36 0.00 0.00 0.00 174.94 174.86 2j9d s PHE 92 N -0.19 2.33 -0.18 3.97 0.08 0.67 -4.98 117.98 119.68 2j9d s PHE 92 Ca -0.02 -0.42 -0.02 0.00 0.12 0.00 0.00 56.93 56.58 2j9d s PHE 92 Cb -0.13 -1.44 -0.01 0.00 -0.57 0.00 0.00 43.02 40.86 2j9d s PHE 92 CO 0.03 0.05 -0.08 0.08 -0.10 0.00 0.00 175.22 175.20 2j9d s VAL 93 N -0.71 3.21 -0.07 -0.44 1.01 -1.26 -0.57 120.40 121.57 2j9d s VAL 93 Ca 0.11 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.56 2j9d s VAL 93 Cb -0.10 -2.41 -0.00 0.00 0.00 0.00 0.00 36.38 33.87 2j9d s VAL 93 CO 0.01 0.47 -0.20 -0.63 0.00 0.00 0.00 175.10 174.75 2j9d s ILE 94 N 0.99 1.73 0.33 2.22 1.01 0.13 -4.98 121.20 122.63 2j9d s ILE 94 Ca -0.01 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 2j9d s ILE 94 Cb -0.15 -1.49 -0.11 0.00 0.01 0.00 0.00 42.46 40.72 2j9d s ILE 94 CO -0.00 0.49 1.43 -2.16 0.00 0.00 0.00 174.94 174.70 2j9d s PRO 95 N 0.21 4.21 -0.20 2.79 0.04 -1.26 -0.28 135.00 140.51 2j9d s PRO 95 Ca -0.11 2.42 -0.00 0.00 0.04 0.00 0.00 61.00 63.35 2j9d s PRO 95 Cb -0.15 -3.03 0.01 0.00 0.04 0.00 0.00 34.50 31.38 2j9d s PRO 95 CO 0.05 -0.42 -0.15 0.08 0.04 0.00 0.00 177.00 176.60 2j9d s VAL 96 N -0.83 2.43 -0.19 -0.36 1.01 -0.64 -4.77 120.40 117.05 2j9d s VAL 96 Ca 0.54 -0.85 0.17 0.00 0.00 0.00 0.00 61.98 61.84 2j9d s VAL 96 Cb -0.44 -2.07 0.02 0.00 0.00 0.00 0.00 36.38 33.89 2j9d s VAL 96 CO 0.55 0.48 1.20 -0.33 0.00 0.00 0.00 175.10 177.01 2j9d h GLU 97 N 7.98 0.00 -2.58 2.72 5.08 -1.95 -3.35 114.58 122.47 2j9d h GLU 97 Ca -0.44 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.82 2j9d h GLU 97 Cb 1.14 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.17 2j9d h GLU 97 CO 0.62 0.31 -0.13 1.03 -1.00 0.00 0.00 179.01 179.84 2j9d s ARG 98 N -3.03 0.63 -0.06 2.33 0.52 -1.26 -5.00 118.95 113.08 2j9d s ARG 98 Ca 0.01 0.50 0.03 0.00 -0.52 0.00 0.00 55.73 55.75 2j9d s ARG 98 Cb 0.08 0.30 0.01 0.00 0.52 0.00 0.00 34.95 35.86 2j9d s ARG 98 CO 0.76 -0.11 -0.13 0.08 0.02 0.00 0.00 175.30 175.92 2j9d s VAL 99 N -0.14 1.17 -0.04 3.52 1.01 -1.26 -5.02 120.40 119.65 2j9d s VAL 99 Ca -0.03 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2j9d s VAL 99 Cb -0.03 -1.06 0.01 0.00 0.00 0.00 0.00 36.38 35.30 2j9d s VAL 99 CO 0.02 0.36 -0.11 -0.69 0.00 0.00 0.00 175.10 174.69 2j9d s VAL 100 N 0.50 0.95 -0.23 2.92 1.01 -1.26 -1.69 120.40 122.60 2j9d s VAL 100 Ca -0.12 -0.42 -0.23 0.00 0.00 0.00 0.00 61.98 61.21 2j9d s VAL 100 Cb -0.14 -0.85 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 2j9d s VAL 100 CO 0.03 0.30 0.76 -0.60 0.00 0.00 0.00 175.10 175.59 2j9d s ARG 101 N 0.39 4.19 0.18 2.72 3.52 -0.37 -4.97 118.95 124.61 2j9d s ARG 101 Ca -0.08 0.83 -0.14 0.00 -0.13 0.00 0.00 55.73 56.22 2j9d s ARG 101 Cb -0.12 -3.62 0.13 0.00 -1.56 0.00 0.00 34.95 29.78 2j9d s ARG 101 CO 0.02 -0.42 1.77 0.28 -0.81 0.00 0.00 175.30 176.13 2j9d h VAL 102 N 5.35 0.91 0.00 7.11 2.07 -1.95 0.53 116.25 130.27 2j9d h VAL 102 Ca -0.26 -0.14 -0.10 0.00 0.82 0.00 0.00 66.70 67.02 2j9d h VAL 102 Cb 1.11 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2j9d h VAL 102 CO 0.83 0.08 -0.45 0.08 0.02 0.00 0.00 177.57 178.12 2j9d h ARG 103 N 0.41 0.00 0.00 1.57 0.11 -1.98 -3.30 114.38 111.20 2j9d h ARG 103 Ca 0.21 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.29 2j9d h ARG 103 Cb 0.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.25 2j9d h ARG 103 CO -0.18 0.45 -1.00 0.25 0.10 0.00 0.00 179.97 179.59 2j9d n THR 104 N -3.38 0.00 -1.32 0.08 -2.24 -1.15 -4.99 114.28 101.27 2j9d n THR 104 Ca 0.01 -0.23 -0.11 0.00 -2.27 0.00 0.00 64.05 61.45 2j9d n THR 104 Cb 0.62 0.56 -0.05 0.00 -2.10 0.00 0.00 70.33 69.36 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 -1.56 -1.71 -1.68 -0.78 5.02 0.18 -4.99 118.16 112.64 2j9d n LYS 105 Ca -0.00 0.89 -0.37 0.00 -2.02 0.00 0.00 58.31 56.81 2j9d n LYS 105 Cb 0.17 -5.33 0.07 0.00 -0.02 0.00 0.00 35.03 29.92 2j9d n LYS 105 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2j9d n GLU 106 N -0.81 1.02 -4.37 1.97 1.02 -1.25 -4.74 120.64 113.48 2j9d n GLU 106 Ca -0.11 0.40 -0.28 0.00 -0.02 0.00 0.00 57.16 57.15 2j9d n GLU 106 Cb 0.60 -2.44 -0.07 0.00 -0.02 0.00 0.00 31.44 29.51 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 -3.25 2.16 4.02 3.49 2.02 -1.26 -1.23 118.70 124.65 2j9d s GLU 107 Ca 0.81 -2.08 0.00 0.00 0.02 0.00 0.00 54.97 53.73 2j9d s GLU 107 Cb -0.38 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 32.04 2j9d s GLU 107 CO 0.42 -0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.87 2j9d n GLY 108 N -1.26 1.04 0.26 -1.39 0.00 -0.68 -2.82 105.19 100.33 2j9d n GLY 108 Ca -0.07 -0.62 0.06 0.00 0.00 0.00 0.00 46.02 45.40 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 0.16 -0.32 1.61 2.10 -1.93 -1.59 116.57 116.60 2j9d h LYS 109 Ca 0.00 -0.02 -0.03 0.00 -2.00 0.00 0.00 60.65 58.61 2j9d h LYS 109 Cb 0.00 -0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 31.28 2j9d h LYS 109 CO 0.00 0.16 0.09 0.93 -2.00 0.00 0.00 179.45 178.62 2j9d h GLU 110 N 0.16 0.46 0.00 0.07 3.07 -1.93 0.33 114.58 116.75 2j9d h GLU 110 Ca 0.04 -0.07 -0.05 0.00 -0.50 0.00 0.00 59.36 58.78 2j9d h GLU 110 Cb 0.07 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 2j9d h GLU 110 CO -0.00 0.43 -0.26 0.00 -1.40 0.00 0.00 179.01 177.77 2j9d h ALA 111 N 1.64 1.19 0.00 3.43 0.00 -1.12 -2.93 119.26 121.46 2j9d h ALA 111 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2j9d h ALA 111 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2j9d h ALA 111 CO -0.01 0.33 -1.22 1.28 0.00 0.00 0.00 179.25 179.63 2j9d n LEU 112 N -3.68 0.66 -4.50 0.00 4.77 -0.48 -4.63 117.00 109.15 2j9d n LEU 112 Ca -0.01 -0.25 -0.21 0.00 -0.03 0.00 0.00 56.01 55.50 2j9d n LEU 112 Cb 0.38 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.34 2j9d n LEU 112 CO 0.34 0.14 1.27 0.18 -1.33 0.00 0.00 177.39 177.99 2j9d n LEU 113 N -1.78 2.01 -0.46 2.23 7.99 0.10 -5.05 117.00 122.04 2j9d n LEU 113 Ca 0.02 -2.70 0.06 0.00 -0.01 0.00 0.00 56.01 53.38 2j9d n LEU 113 Cb 0.41 -1.66 0.05 0.00 -0.11 0.00 0.00 43.42 42.11 2j9d n LEU 113 CO 0.43 -2.86 0.43 -1.84 -1.51 0.00 0.00 177.39 172.04