#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o8t n GLN 2 N 0.00 -3.19 -4.89 1.09 0.00 -1.26 -5.07 117.38 104.07 1o8t n GLN 2 Ca 0.00 2.52 -0.27 0.00 -0.00 0.00 0.00 57.00 59.25 1o8t n GLN 2 Cb 0.00 -3.28 -0.16 0.00 0.00 0.00 0.00 30.24 26.80 1o8t n GLN 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.06 175.92 1o8t s GLN 3 N -1.04 1.81 0.53 3.69 -0.44 -1.26 -5.03 119.66 117.92 1o8t s GLN 3 Ca -0.05 -0.65 0.27 0.00 -2.50 0.00 0.00 55.36 52.43 1o8t s GLN 3 Cb 0.00 -1.60 1.41 0.00 -1.64 0.00 0.00 33.01 31.19 1o8t s GLN 3 CO 0.14 0.28 1.96 -1.00 0.50 0.00 0.00 175.29 177.16 1o8t h PRO 4 N 6.14 0.02 -0.03 1.67 0.13 -1.98 0.20 132.00 138.15 1o8t h PRO 4 Ca -0.33 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.76 1o8t h PRO 4 Cb 1.17 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1o8t h PRO 4 CO 0.48 0.01 -0.11 0.37 -0.23 0.00 0.00 178.00 178.52 1o8t h GLN 5 N 0.02 0.13 0.03 0.86 -0.00 -2.04 -3.34 115.11 110.78 1o8t h GLN 5 Ca 0.32 -0.10 -0.00 0.00 -0.00 0.00 0.00 58.65 58.87 1o8t h GLN 5 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.74 1o8t h GLN 5 CO -0.01 0.72 -0.02 1.96 0.00 0.00 0.00 178.83 181.49 1o8t h GLN 6 N -0.44 -0.04 -6.23 1.69 4.20 -1.72 -3.41 115.11 109.16 1o8t h GLN 6 Ca -0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 1o8t h GLN 6 Cb 0.73 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.48 1o8t h GLN 6 CO 0.02 0.34 1.24 -0.51 -0.67 0.00 0.00 178.83 179.26 1o8t s ASP 7 N -5.54 5.78 -0.52 1.46 1.11 0.62 -4.93 116.67 114.64 1o8t s ASP 7 Ca -0.15 0.70 -0.27 0.00 0.18 0.00 0.00 52.55 53.00 1o8t s ASP 7 Cb 0.02 -2.53 -0.01 0.00 1.07 0.00 0.00 42.92 41.47 1o8t s ASP 7 CO 0.66 -1.91 1.77 -1.61 1.18 0.00 0.00 175.17 175.26 1o8t s GLU 8 N 6.02 2.93 0.67 8.23 0.41 -1.26 -4.75 118.70 130.94 1o8t s GLU 8 Ca 0.67 0.82 -0.15 0.00 -0.41 0.00 0.00 54.97 55.90 1o8t s GLU 8 Cb -0.16 -4.29 0.00 0.00 -1.78 0.00 0.00 34.13 27.91 1o8t s GLU 8 CO 0.27 -2.36 1.12 -1.64 -0.49 0.00 0.00 175.26 172.16 1o8t s MET 9 N 6.41 2.72 0.26 1.61 -1.94 -1.26 -4.97 119.30 122.13 1o8t s MET 9 Ca 0.68 1.42 -0.30 0.00 -1.71 0.00 0.00 55.69 55.79 1o8t s MET 9 Cb -0.15 -1.94 -0.10 0.00 2.01 0.00 0.00 34.83 34.65 1o8t s MET 9 CO 0.25 -1.32 1.42 -1.25 -0.01 0.00 0.00 175.02 174.12 1o8t s PRO 10 N -4.09 4.28 -0.05 2.03 0.04 -1.26 -4.97 135.00 130.97 1o8t s PRO 10 Ca 0.68 2.29 -0.18 0.00 0.04 0.00 0.00 61.00 63.83 1o8t s PRO 10 Cb -0.21 -3.11 -0.12 0.00 0.04 0.00 0.00 34.50 31.10 1o8t s PRO 10 CO 0.42 -0.40 0.74 0.77 0.04 0.00 0.00 177.00 178.57 1o8t h SER 11 N 4.87 -0.28 -3.18 6.66 0.02 -2.05 -3.46 113.55 116.12 1o8t h SER 11 Ca -0.46 -0.19 -0.33 0.00 -0.84 0.00 0.00 61.79 59.96 1o8t h SER 11 Cb 1.22 0.07 0.15 0.00 0.14 0.00 0.00 62.40 63.99 1o8t h SER 11 CO 0.76 0.22 0.18 -0.81 -1.14 0.00 0.00 176.83 176.04 1o8t n PRO 12 N -5.00 -2.20 -2.15 3.45 -0.04 -1.26 -4.89 135.00 122.90 1o8t n PRO 12 Ca -0.07 -1.51 -0.32 0.00 -0.04 0.00 0.00 63.50 61.57 1o8t n PRO 12 Cb 0.23 -1.26 -0.04 0.00 -0.04 0.00 0.00 33.50 32.39 1o8t n PRO 12 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1o8t s THR 13 N -2.86 3.52 0.00 0.52 2.01 -1.26 -4.65 115.64 112.92 1o8t s THR 13 Ca 0.59 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 62.29 1o8t s THR 13 Cb -0.04 -4.21 0.00 0.00 0.01 0.00 0.00 72.50 68.26 1o8t s THR 13 CO 0.44 -1.15 0.00 0.33 -0.69 0.00 0.00 174.62 173.55 1o8t n PHE 14 N 12.70 0.00 0.04 4.92 7.35 -1.26 -4.47 117.46 136.74 1o8t n PHE 14 Ca 0.34 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.90 1o8t n PHE 14 Cb 0.49 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.24 1o8t n PHE 14 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1o8t h LEU 15 N 0.00 -0.02 -1.40 -2.13 3.38 -1.92 -2.33 115.31 110.88 1o8t h LEU 15 Ca 0.00 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.91 1o8t h LEU 15 Cb 0.00 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1o8t h LEU 15 CO 0.00 0.11 0.46 0.71 0.09 0.00 0.00 178.44 179.81 1o8t h THR 16 N -0.16 1.02 0.52 0.22 1.35 -1.91 -2.73 112.91 111.22 1o8t h THR 16 Ca -0.00 -0.25 -0.03 0.00 -0.55 0.00 0.00 66.41 65.58 1o8t h THR 16 Cb 0.15 0.23 0.01 0.00 -1.73 0.00 0.00 68.15 66.80 1o8t h THR 16 CO 0.00 0.13 -0.25 -0.61 -0.25 0.00 0.00 175.52 174.55 1o8t h GLN 17 N 0.73 -0.67 -0.53 4.72 4.15 -1.71 -3.21 115.11 118.59 1o8t h GLN 17 Ca 0.30 0.05 0.09 0.00 0.77 0.00 0.00 58.65 59.86 1o8t h GLN 17 Cb 0.26 0.15 -0.09 0.00 0.21 0.00 0.00 27.48 28.01 1o8t h GLN 17 CO -0.10 -0.40 -0.19 0.28 -1.93 0.00 0.00 178.83 176.49 1o8t n VAL 18 N -5.35 -0.26 -0.06 2.39 0.31 -0.91 0.36 118.33 114.81 1o8t n VAL 18 Ca -0.12 1.24 -0.08 0.00 -0.01 0.00 0.00 64.34 65.38 1o8t n VAL 18 Cb 0.31 -1.66 -0.01 0.00 -0.91 0.00 0.00 33.84 31.57 1o8t n VAL 18 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1o8t h LYS 19 N 0.00 -0.18 0.00 5.55 6.56 -1.63 -0.27 116.57 126.60 1o8t h LYS 19 Ca 0.21 0.01 -0.04 0.00 -1.06 0.00 0.00 60.65 59.77 1o8t h LYS 19 Cb 0.34 0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 32.03 1o8t h LYS 19 CO -0.53 -0.12 -0.21 0.93 -2.06 0.00 0.00 179.45 177.46 1o8t h GLU 20 N -0.19 0.00 -0.70 3.15 4.39 -0.21 -2.30 114.58 118.72 1o8t h GLU 20 Ca 0.15 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 1o8t h GLU 20 Cb 0.42 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 1o8t h GLU 20 CO -0.38 0.21 0.31 1.03 -1.16 0.00 0.00 179.01 179.01 1o8t h SER 21 N 0.00 0.94 0.03 1.42 0.87 0.05 -2.27 113.55 114.59 1o8t h SER 21 Ca -0.00 -0.15 -0.16 0.00 -1.23 0.00 0.00 61.79 60.25 1o8t h SER 21 Cb 0.37 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 1o8t h SER 21 CO 0.03 0.84 -0.53 -0.07 -0.53 0.00 0.00 176.83 176.56 1o8t h LEU 22 N 0.99 0.60 0.37 2.23 3.38 -0.80 -2.63 115.31 119.45 1o8t h LEU 22 Ca 0.24 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1o8t h LEU 22 Cb 0.16 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1o8t h LEU 22 CO -0.02 1.01 -0.22 0.28 0.09 0.00 0.00 178.44 179.58 1o8t h SER 23 N 0.42 -0.54 0.39 -0.43 0.02 -1.11 -1.38 113.55 110.92 1o8t h SER 23 Ca 0.01 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1o8t h SER 23 Cb 1.07 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1o8t h SER 23 CO 0.10 -0.35 0.00 0.28 -1.14 0.00 0.00 176.83 175.72 1o8t h SER 24 N -0.56 0.00 -0.07 3.07 0.02 -1.46 -2.42 113.55 112.13 1o8t h SER 24 Ca -0.04 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.71 1o8t h SER 24 Cb 0.45 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.01 1o8t h SER 24 CO 0.05 0.00 -0.74 0.22 -1.14 0.00 0.00 176.83 175.22 1o8t h TYR 25 N 0.00 0.88 -0.54 3.45 5.03 -0.89 -3.24 116.97 121.66 1o8t h TYR 25 Ca 0.00 -0.43 -0.05 0.00 2.58 0.00 0.00 58.73 60.83 1o8t h TYR 25 Cb 0.19 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.33 1o8t h TYR 25 CO 0.00 1.25 0.13 2.35 -1.32 0.00 0.00 178.16 180.57 1o8t h TRP 26 N 0.27 0.85 -0.89 -3.82 -0.00 -0.82 -0.32 115.95 111.23 1o8t h TRP 26 Ca -0.07 -0.08 0.08 0.00 -0.00 0.00 0.00 58.89 58.82 1o8t h TRP 26 Cb 1.40 -0.25 -0.11 0.00 -0.00 0.00 0.00 29.16 30.20 1o8t h TRP 26 CO 0.11 0.72 -0.57 1.49 -0.00 0.00 0.00 178.44 180.19 1o8t h GLU 27 N 0.80 -0.05 0.00 2.65 4.22 -1.56 0.15 114.58 120.79 1o8t h GLU 27 Ca 0.18 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.62 1o8t h GLU 27 Cb 0.30 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1o8t h GLU 27 CO -0.00 -0.04 -0.43 0.43 -2.18 0.00 0.00 179.01 176.79 1o8t n SER 28 N -5.20 0.52 0.06 1.04 7.64 -1.20 -3.96 113.62 112.51 1o8t n SER 28 Ca 0.01 0.07 0.04 0.00 1.01 0.00 0.00 58.87 60.00 1o8t n SER 28 Cb 0.26 0.02 0.45 0.00 -1.01 0.00 0.00 64.21 63.93 1o8t n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1o8t h ALA 29 N 2.78 1.72 -0.48 -0.43 0.00 0.11 -2.73 119.26 120.23 1o8t h ALA 29 Ca 0.00 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 54.94 1o8t h ALA 29 Cb 0.61 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 1o8t h ALA 29 CO 0.00 0.24 0.06 0.87 0.00 0.00 0.00 179.25 180.43 1o8t h LYS 30 N 0.43 0.18 -1.03 0.00 6.56 -1.58 0.42 116.57 121.55 1o8t h LYS 30 Ca 0.11 -0.01 0.26 0.00 -1.06 0.00 0.00 60.65 59.95 1o8t h LYS 30 Cb 0.02 -0.04 -0.11 0.00 -0.57 0.00 0.00 32.23 31.52 1o8t h LYS 30 CO -0.02 0.12 0.63 1.15 -2.06 0.00 0.00 179.45 179.28 1o8t h THR 31 N 0.19 0.52 -0.57 -0.16 2.02 -1.75 0.45 112.91 113.59 1o8t h THR 31 Ca 0.24 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 1o8t h THR 31 Cb 0.33 -0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.71 1o8t h THR 31 CO -0.34 0.09 0.28 0.00 0.37 0.00 0.00 175.52 175.91 1o8t h ALA 32 N 1.68 0.74 -0.27 6.16 0.00 -1.01 -0.35 119.26 126.21 1o8t h ALA 32 Ca 0.63 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.47 1o8t h ALA 32 Cb 1.39 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 1o8t h ALA 32 CO -0.40 0.30 -0.38 0.00 0.00 0.00 0.00 179.25 178.77 1o8t h ALA 33 N 1.11 -0.41 -0.45 0.00 0.00 0.21 0.52 119.26 120.23 1o8t h ALA 33 Ca 0.20 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1o8t h ALA 33 Cb 0.11 0.77 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1o8t h ALA 33 CO -0.03 -0.84 0.04 0.37 0.00 0.00 0.00 179.25 178.79 1o8t h GLN 34 N -0.37 0.72 0.00 0.00 5.75 -1.39 -1.75 115.11 118.06 1o8t h GLN 34 Ca 0.12 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 1o8t h GLN 34 Cb 0.58 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 1o8t h GLN 34 CO -0.47 0.71 -0.07 -0.97 -2.65 0.00 0.00 178.83 175.37 1o8t h ASN 35 N 0.68 0.00 -0.47 -0.69 -1.24 0.83 -1.21 115.58 113.49 1o8t h ASN 35 Ca 0.14 0.00 0.06 0.00 0.71 0.00 0.00 56.30 57.21 1o8t h ASN 35 Cb 0.37 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.37 1o8t h ASN 35 CO 0.01 0.07 0.18 0.25 -1.29 0.00 0.00 177.43 176.66 1o8t h LEU 36 N 0.00 0.21 -0.66 0.34 6.46 0.88 0.52 115.31 123.06 1o8t h LEU 36 Ca -0.00 0.05 -0.04 0.00 -0.12 0.00 0.00 57.88 57.77 1o8t h LEU 36 Cb 0.15 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.07 1o8t h LEU 36 CO 0.01 0.15 0.26 1.88 -0.62 0.00 0.00 178.44 180.12 1o8t h TYR 37 N 0.37 1.02 0.36 1.25 0.05 -1.28 -3.00 116.97 115.73 1o8t h TYR 37 Ca 0.22 -0.08 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 1o8t h TYR 37 Cb 0.20 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.62 1o8t h TYR 37 CO -0.14 0.80 -0.29 0.93 -1.05 0.00 0.00 178.16 178.41 1o8t h GLU 38 N 0.94 -0.63 0.00 4.88 3.07 -0.17 -2.15 114.58 120.52 1o8t h GLU 38 Ca 0.22 0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 1o8t h GLU 38 Cb 0.22 0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1o8t h GLU 38 CO -0.02 -0.42 0.12 -0.22 -1.40 0.00 0.00 179.01 177.07 1o8t h LYS 39 N -0.66 0.00 -0.09 2.33 3.11 -0.01 -1.40 116.57 119.85 1o8t h LYS 39 Ca -0.03 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.74 1o8t h LYS 39 Cb 0.57 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.80 1o8t h LYS 39 CO -0.01 0.00 -0.21 1.15 -2.81 0.00 0.00 179.45 177.57 1o8t h THR 40 N 0.00 1.40 -0.26 1.00 2.02 -1.25 -3.29 112.91 112.53 1o8t h THR 40 Ca 0.00 -1.52 -0.04 0.00 0.77 0.00 0.00 66.41 65.62 1o8t h THR 40 Cb 0.24 2.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.80 1o8t h THR 40 CO 0.00 0.43 0.01 1.88 0.37 0.00 0.00 175.52 178.21 1o8t h TYR 41 N -0.16 0.50 -4.11 3.16 0.05 -1.28 -3.44 116.97 111.69 1o8t h TYR 41 Ca 0.00 -0.08 -0.45 0.00 0.05 0.00 0.00 58.73 58.24 1o8t h TYR 41 Cb 0.80 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 38.41 1o8t h TYR 41 CO 0.11 0.61 0.35 -0.51 -1.05 0.00 0.00 178.16 177.67 1o8t s LEU 42 N -9.50 3.82 -0.37 3.88 1.02 -1.07 -4.98 118.68 111.49 1o8t s LEU 42 Ca -0.14 1.66 0.01 0.00 0.02 0.00 0.00 54.13 55.68 1o8t s LEU 42 Cb 0.08 -4.53 0.36 0.00 0.02 0.00 0.00 46.19 42.12 1o8t s LEU 42 CO 0.75 -0.47 1.83 -0.81 0.02 0.00 0.00 176.35 177.67 1o8t n PRO 43 N -0.99 1.96 0.20 1.29 -0.04 -1.26 -4.54 135.00 131.62 1o8t n PRO 43 Ca 0.07 -2.05 0.14 0.00 -0.04 0.00 0.00 63.50 61.62 1o8t n PRO 43 Cb 0.54 -1.80 0.67 0.00 -0.04 0.00 0.00 33.50 32.86 1o8t n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1o8t h ALA 44 N 1.51 1.00 -0.61 0.55 0.00 -1.94 -3.32 119.26 116.46 1o8t h ALA 44 Ca 0.41 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.37 1o8t h ALA 44 Cb 1.50 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 19.21 1o8t h ALA 44 CO 0.89 0.00 -0.48 0.28 0.00 0.00 0.00 179.25 179.94 1o8t h VAL 45 N 0.00 0.00 0.00 0.00 2.07 -1.87 0.78 116.25 117.23 1o8t h VAL 45 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1o8t h VAL 45 Cb 0.24 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1o8t h VAL 45 CO 0.00 0.00 -0.30 -0.78 0.02 0.00 0.00 177.57 176.51 1o8t h ASP 46 N -0.15 0.00 -0.29 0.57 3.58 -1.98 -3.12 116.42 115.03 1o8t h ASP 46 Ca 0.10 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.48 1o8t h ASP 46 Cb 0.41 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.45 1o8t h ASP 46 CO -0.65 0.30 -0.08 -0.08 -2.88 0.00 0.00 179.24 175.85 1o8t h GLU 47 N 0.00 0.57 -0.25 0.28 4.57 -1.21 -2.89 114.58 115.65 1o8t h GLU 47 Ca -0.00 -0.22 0.07 0.00 -1.18 0.00 0.00 59.36 58.03 1o8t h GLU 47 Cb 0.64 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 1o8t h GLU 47 CO 0.04 0.77 0.24 0.87 -1.18 0.00 0.00 179.01 179.74 1o8t h LYS 48 N 0.33 0.00 0.73 1.92 6.56 -0.87 0.11 116.57 125.35 1o8t h LYS 48 Ca 0.07 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.63 1o8t h LYS 48 Cb 0.56 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.23 1o8t h LYS 48 CO 0.03 0.00 -0.35 -0.07 -2.06 0.00 0.00 179.45 177.00 1o8t h LEU 49 N 0.00 -0.83 -1.59 2.94 -0.00 -1.58 -1.88 115.31 112.38 1o8t h LEU 49 Ca 0.12 0.03 -0.03 0.00 -0.00 0.00 0.00 57.88 58.00 1o8t h LEU 49 Cb 0.59 0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.46 1o8t h LEU 49 CO -0.00 -0.52 -0.09 0.03 -0.00 0.00 0.00 178.44 177.86 1o8t h ARG 50 N -1.12 0.14 0.39 1.13 2.47 -1.51 -2.70 114.38 113.19 1o8t h ARG 50 Ca -0.10 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.59 1o8t h ARG 50 Cb 0.75 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 29.02 1o8t h ARG 50 CO 0.16 0.25 -0.38 -0.44 0.56 0.00 0.00 179.97 180.12 1o8t h ASP 51 N 0.14 -1.03 0.03 7.04 3.32 -0.65 0.19 116.42 125.46 1o8t h ASP 51 Ca 0.03 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1o8t h ASP 51 Cb 0.26 0.34 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1o8t h ASP 51 CO 0.01 -0.53 -0.04 -0.07 -1.72 0.00 0.00 179.24 176.89 1o8t h LEU 52 N -0.79 0.03 -0.27 1.55 -0.00 -1.20 -2.38 115.31 112.25 1o8t h LEU 52 Ca -0.03 -0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.79 1o8t h LEU 52 Cb 0.70 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.35 1o8t h LEU 52 CO -0.06 0.08 -0.07 1.88 -0.00 0.00 0.00 178.44 180.27 1o8t h TYR 53 N 0.03 0.59 0.24 1.13 -1.99 -1.05 -0.84 116.97 115.08 1o8t h TYR 53 Ca 0.01 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 60.60 1o8t h TYR 53 Cb 0.10 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.69 1o8t h TYR 53 CO 0.00 0.73 -0.12 0.77 -0.00 0.00 0.00 178.16 179.55 1o8t h SER 54 N 0.27 -0.28 -0.11 3.88 0.02 -0.50 -2.71 113.55 114.12 1o8t h SER 54 Ca 0.07 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1o8t h SER 54 Cb 0.55 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 1o8t h SER 54 CO 0.03 -0.15 0.02 0.50 -1.14 0.00 0.00 176.83 176.09 1o8t h LYS 55 N -0.38 0.26 0.00 3.45 1.63 -1.48 -2.35 116.57 117.70 1o8t h LYS 55 Ca -0.03 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1o8t h LYS 55 Cb 0.29 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1o8t h LYS 55 CO 0.05 0.27 0.00 0.77 -3.45 0.00 0.00 179.45 177.09 1o8t h SER 56 N 0.26 0.00 0.62 4.20 0.02 -0.81 -1.79 113.55 116.05 1o8t h SER 56 Ca 0.06 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1o8t h SER 56 Cb 0.14 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1o8t h SER 56 CO -0.00 0.00 -0.39 0.71 -1.14 0.00 0.00 176.83 176.01 1o8t h THR 57 N 0.00 0.21 0.12 -2.27 1.35 -1.39 -1.30 112.91 109.63 1o8t h THR 57 Ca 0.00 0.00 -0.32 0.00 -0.55 0.00 0.00 66.41 65.54 1o8t h THR 57 Cb 0.12 0.21 -0.01 0.00 -1.73 0.00 0.00 68.15 66.74 1o8t h THR 57 CO 0.00 0.00 -1.70 0.00 -0.25 0.00 0.00 175.52 173.57 1o8t h ALA 58 N -0.67 0.29 0.89 6.62 0.00 -1.77 -3.26 119.26 121.38 1o8t h ALA 58 Ca -0.08 -1.24 -0.04 0.00 0.00 0.00 0.00 54.91 53.55 1o8t h ALA 58 Cb 0.78 0.61 0.01 0.00 0.00 0.00 0.00 17.79 19.18 1o8t h ALA 58 CO 0.07 1.05 -0.43 0.00 0.00 0.00 0.00 179.25 179.95 1o8t h ALA 59 N -0.02 -1.20 0.00 0.00 0.00 -1.44 -3.09 119.26 113.51 1o8t h ALA 59 Ca -0.37 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1o8t h ALA 59 Cb 1.88 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 20.13 1o8t h ALA 59 CO 0.06 -1.12 -0.07 1.98 0.00 0.00 0.00 179.25 180.10 1o8t h MET 60 N -1.32 0.00 0.00 0.00 4.05 -1.40 -1.16 114.93 115.10 1o8t h MET 60 Ca -0.12 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 1o8t h MET 60 Cb 0.92 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.72 1o8t h MET 60 CO 0.20 0.07 0.00 0.77 0.23 0.00 0.00 176.91 178.18 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.02 -1.51 0.08 113.55 113.54 1o8t h SER 61 Ca -0.00 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.54 1o8t h SER 61 Cb 0.15 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.62 1o8t h SER 61 CO 0.01 0.00 -2.39 0.41 -1.14 0.00 0.00 176.83 173.71 1o8t n THR 62 N -2.93 1.37 0.30 -2.27 -1.04 -0.61 -4.33 114.28 104.77 1o8t n THR 62 Ca -0.00 -0.37 0.19 0.00 -2.04 0.00 0.00 64.05 61.82 1o8t n THR 62 Cb 0.22 -1.77 0.92 0.00 -1.82 0.00 0.00 70.33 67.89 1o8t n THR 62 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1o8t h TYR 63 N -0.77 0.00 0.53 -1.42 -1.99 -1.27 0.18 116.97 112.22 1o8t h TYR 63 Ca -0.62 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.08 1o8t h TYR 63 Cb 1.59 0.00 0.01 0.00 2.00 0.00 0.00 36.73 40.33 1o8t h TYR 63 CO -0.07 0.02 -0.25 1.15 -0.00 0.00 0.00 178.16 179.01 1o8t h THR 64 N 0.00 0.03 -0.53 -2.88 2.02 -1.19 0.44 112.91 110.80 1o8t h THR 64 Ca -0.00 -0.49 -0.05 0.00 0.77 0.00 0.00 66.41 66.64 1o8t h THR 64 Cb 0.27 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 1o8t h THR 64 CO 0.00 0.01 0.11 1.23 0.37 0.00 0.00 175.52 177.24 1o8t h GLY 65 N -1.18 0.88 0.83 2.16 0.00 -1.73 -1.89 103.07 102.14 1o8t h GLY 65 Ca -0.07 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 1o8t h GLY 65 CO 0.12 0.48 -0.28 -2.22 0.00 0.00 0.00 176.54 174.64 1o8t h ILE 66 N 0.79 0.33 -0.27 2.60 1.08 -0.99 0.48 117.51 121.53 1o8t h ILE 66 Ca 0.17 -0.26 0.06 0.00 -0.39 0.00 0.00 64.86 64.45 1o8t h ILE 66 Cb 0.31 0.42 -0.08 0.00 -3.07 0.00 0.00 36.82 34.40 1o8t h ILE 66 CO 0.00 0.03 -0.28 -0.26 -0.69 0.00 0.00 178.15 176.95 1o8t h PHE 67 N -0.98 -0.77 0.00 1.37 -1.00 -0.03 0.83 116.94 116.36 1o8t h PHE 67 Ca -0.08 0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.73 1o8t h PHE 67 Cb 0.66 0.38 -0.00 0.00 3.61 0.00 0.00 35.95 40.60 1o8t h PHE 67 CO -0.00 -0.36 -0.08 1.79 -1.61 0.00 0.00 178.31 178.05 1o8t h THR 68 N -0.28 0.38 0.43 -1.55 1.35 -1.36 -2.84 112.91 109.04 1o8t h THR 68 Ca 0.14 -0.42 -0.01 0.00 -0.55 0.00 0.00 66.41 65.57 1o8t h THR 68 Cb 0.50 1.30 -0.01 0.00 -1.73 0.00 0.00 68.15 68.21 1o8t h THR 68 CO -0.43 0.08 -0.34 -0.78 -0.25 0.00 0.00 175.52 173.80 1o8t h ASP 69 N 0.00 -0.90 0.74 5.36 1.82 0.15 0.98 116.42 124.57 1o8t h ASP 69 Ca -0.00 0.07 -0.05 0.00 -0.39 0.00 0.00 57.03 56.65 1o8t h ASP 69 Cb 0.29 0.29 -0.01 0.00 0.68 0.00 0.00 39.33 40.58 1o8t h ASP 69 CO 0.01 -0.50 -0.25 1.56 -1.61 0.00 0.00 179.24 178.45 1o8t h GLN 70 N -0.77 0.00 0.35 0.28 7.50 -1.42 -2.15 115.11 118.90 1o8t h GLN 70 Ca -0.04 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.09 1o8t h GLN 70 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.20 1o8t h GLN 70 CO -0.01 0.25 -0.17 0.28 -1.50 0.00 0.00 178.83 177.68 1o8t h VAL 71 N 0.00 0.57 -0.60 -0.54 2.07 -1.21 -2.49 116.25 114.04 1o8t h VAL 71 Ca -0.00 -0.62 0.08 0.00 0.82 0.00 0.00 66.70 66.98 1o8t h VAL 71 Cb 0.68 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1o8t h VAL 71 CO 0.03 0.10 0.40 0.17 0.02 0.00 0.00 177.57 178.30 1o8t h LEU 72 N -0.86 0.45 -1.31 2.57 8.10 -0.79 0.27 115.31 123.73 1o8t h LEU 72 Ca -0.05 0.01 0.05 0.00 0.11 0.00 0.00 57.88 58.00 1o8t h LEU 72 Cb 0.53 -0.09 -0.05 0.00 -0.44 0.00 0.00 40.66 40.62 1o8t h LEU 72 CO 0.08 0.28 0.50 -1.28 -4.11 0.00 0.00 178.44 173.92 1o8t h SER 73 N 0.51 0.75 1.09 0.17 0.87 -1.20 0.12 113.55 115.86 1o8t h SER 73 Ca 0.27 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1o8t h SER 73 Cb 0.40 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1o8t h SER 73 CO -0.08 0.49 0.00 0.58 -0.53 0.00 0.00 176.83 177.29 1o8t h VAL 74 N 0.85 0.00 -0.60 2.23 2.07 -0.48 -2.86 116.25 117.46 1o8t h VAL 74 Ca 0.32 -0.52 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 1o8t h VAL 74 Cb 0.18 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1o8t h VAL 74 CO -0.11 0.00 0.11 0.25 0.02 0.00 0.00 177.57 177.84 1o8t h LEU 75 N 0.00 0.90 -0.52 2.57 7.12 -0.60 -2.69 115.31 122.09 1o8t h LEU 75 Ca 0.00 -0.19 -0.16 0.00 0.13 0.00 0.00 57.88 57.66 1o8t h LEU 75 Cb 0.55 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.43 1o8t h LEU 75 CO 0.00 0.90 -0.54 0.11 -0.13 0.00 0.00 178.44 178.78 1o8t h LYS 76 N 0.90 0.55 -0.43 1.25 1.79 -1.49 -0.26 116.57 118.89 1o8t h LYS 76 Ca 0.19 -0.35 0.05 0.00 -2.18 0.00 0.00 60.65 58.36 1o8t h LYS 76 Cb 0.38 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.02 1o8t h LYS 76 CO 0.01 0.95 0.18 0.78 -1.08 0.00 0.00 179.45 180.29 1o8t h GLY 77 N 1.06 0.57 0.00 3.86 0.00 -1.47 -3.28 103.07 103.82 1o8t h GLY 77 Ca 0.01 -0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 1o8t h GLY 77 CO 0.10 0.05 -0.47 0.83 0.00 0.00 0.00 176.54 177.06 1o8t h GLU 78 N 0.36 0.00 -0.02 4.80 3.07 -1.56 -3.52 114.58 117.71 1o8t h GLU 78 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1o8t h GLU 78 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 1o8t h GLU 78 CO -0.18 0.49 0.00 0.39 -1.40 0.00 0.00 179.01 178.31