#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o8t h GLN 2 N 0.00 0.00 -1.74 1.09 1.08 -1.96 -3.38 115.11 110.20 1o8t h GLN 2 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1o8t h GLN 2 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1o8t h GLN 2 CO 0.00 0.38 -0.44 1.04 -0.95 0.00 0.00 178.83 178.86 1o8t n GLN 3 N -4.69 -2.01 0.00 1.46 6.02 -1.26 -4.43 117.38 112.47 1o8t n GLN 3 Ca -0.06 1.53 0.08 0.00 -0.01 0.00 0.00 57.00 58.55 1o8t n GLN 3 Cb 0.22 -1.84 0.46 0.00 1.02 0.00 0.00 30.24 30.10 1o8t n GLN 3 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1o8t n PRO 4 N -1.60 0.43 -1.34 -1.09 -0.04 -1.26 -4.80 135.00 125.31 1o8t n PRO 4 Ca 0.00 0.04 -0.29 0.00 -0.04 0.00 0.00 63.50 63.20 1o8t n PRO 4 Cb 0.14 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.28 1o8t n PRO 4 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1o8t s GLN 5 N -2.15 0.05 -0.00 0.54 1.11 -1.26 -5.01 119.66 112.95 1o8t s GLN 5 Ca 0.22 0.12 -0.23 0.00 0.01 0.00 0.00 55.36 55.48 1o8t s GLN 5 Cb 0.11 -1.73 -0.14 0.00 -1.01 0.00 0.00 33.01 30.24 1o8t s GLN 5 CO 0.20 -2.90 1.02 0.37 0.01 0.00 0.00 175.29 173.99 1o8t h GLN 6 N -2.00 -0.69 -6.37 2.91 -0.00 -1.93 -3.42 115.11 103.60 1o8t h GLN 6 Ca -0.49 0.05 -0.54 0.00 -0.00 0.00 0.00 58.65 57.66 1o8t h GLN 6 Cb 1.31 0.16 -0.00 0.00 0.00 0.00 0.00 27.48 28.94 1o8t h GLN 6 CO 0.48 -0.40 0.81 0.34 0.00 0.00 0.00 178.83 180.06 1o8t s ASP 7 N -4.74 6.87 0.07 -0.69 -1.08 -1.26 -4.93 116.67 110.91 1o8t s ASP 7 Ca -0.13 2.09 -0.17 0.00 -0.52 0.00 0.00 52.55 53.82 1o8t s ASP 7 Cb 0.01 -2.56 -0.12 0.00 -1.46 0.00 0.00 42.92 38.80 1o8t s ASP 7 CO 0.41 -0.70 1.37 -0.08 0.52 0.00 0.00 175.17 176.69 1o8t h GLU 8 N 7.75 0.57 -6.24 4.34 4.57 -1.83 -3.43 114.58 120.31 1o8t h GLU 8 Ca -0.38 -0.32 -0.55 0.00 -1.18 0.00 0.00 59.36 56.93 1o8t h GLU 8 Cb 1.18 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.77 1o8t h GLU 8 CO 0.90 0.92 1.05 -1.64 -1.18 0.00 0.00 179.01 179.06 1o8t s MET 9 N -4.25 4.17 0.11 1.92 -1.94 -1.26 -4.28 119.30 113.77 1o8t s MET 9 Ca -0.13 2.04 -0.18 0.00 -1.71 0.00 0.00 55.69 55.71 1o8t s MET 9 Cb 0.07 -3.94 -0.05 0.00 2.01 0.00 0.00 34.83 32.93 1o8t s MET 9 CO 0.81 -0.84 1.66 -1.00 -0.01 0.00 0.00 175.02 175.63 1o8t h PRO 10 N 9.31 0.44 -6.40 2.03 0.13 -1.84 -3.42 132.00 132.26 1o8t h PRO 10 Ca -0.36 -0.08 -0.54 0.00 -0.87 0.00 0.00 66.00 64.15 1o8t h PRO 10 Cb 1.16 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1o8t h PRO 10 CO 0.96 0.45 0.71 0.45 -0.23 0.00 0.00 178.00 180.34 1o8t s SER 11 N -5.72 6.97 0.01 1.44 0.15 -1.26 -4.95 113.70 110.34 1o8t s SER 11 Ca -0.13 2.01 -0.23 0.00 0.70 0.00 0.00 55.95 58.30 1o8t s SER 11 Cb 0.09 -2.57 -0.17 0.00 -1.71 0.00 0.00 66.02 61.66 1o8t s SER 11 CO 0.73 -0.60 1.35 1.55 1.20 0.00 0.00 173.24 177.46 1o8t h PRO 12 N 7.34 0.14 -6.44 5.44 0.13 -2.04 -3.43 132.00 133.14 1o8t h PRO 12 Ca -0.38 -0.06 -0.54 0.00 -0.87 0.00 0.00 66.00 64.15 1o8t h PRO 12 Cb 1.19 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1o8t h PRO 12 CO 0.87 0.53 0.70 0.95 -0.23 0.00 0.00 178.00 180.82 1o8t s THR 13 N -4.48 3.79 0.40 1.56 -4.23 -1.26 -4.78 115.64 106.64 1o8t s THR 13 Ca -0.15 1.24 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 1o8t s THR 13 Cb 0.03 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 70.08 1o8t s THR 13 CO 0.70 0.05 0.00 0.49 -0.54 0.00 0.00 174.62 175.32 1o8t n PHE 14 N 4.54 -3.93 0.23 3.99 3.72 -1.26 -4.92 117.46 119.84 1o8t n PHE 14 Ca 0.11 1.19 0.06 0.00 -0.05 0.00 0.00 57.45 58.77 1o8t n PHE 14 Cb 0.44 2.83 0.54 0.00 -0.94 0.00 0.00 39.48 42.36 1o8t n PHE 14 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1o8t h LEU 15 N 0.00 0.00 -1.31 4.37 6.46 -1.99 -2.44 115.31 120.40 1o8t h LEU 15 Ca 0.00 0.00 0.06 0.00 -0.12 0.00 0.00 57.88 57.82 1o8t h LEU 15 Cb 0.00 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 39.88 1o8t h LEU 15 CO 0.00 0.13 0.51 0.71 -0.62 0.00 0.00 178.44 179.16 1o8t h THR 16 N 0.00 1.04 0.29 1.05 1.35 -1.95 -2.63 112.91 112.06 1o8t h THR 16 Ca -0.00 -0.29 -0.01 0.00 -0.55 0.00 0.00 66.41 65.56 1o8t h THR 16 Cb 0.23 0.13 0.00 0.00 -1.73 0.00 0.00 68.15 66.78 1o8t h THR 16 CO 0.02 0.15 -0.14 1.56 -0.25 0.00 0.00 175.52 176.86 1o8t h GLN 17 N 0.83 -0.37 -0.51 4.72 7.50 -1.80 -3.18 115.11 122.30 1o8t h GLN 17 Ca 0.33 0.03 0.12 0.00 0.50 0.00 0.00 58.65 59.63 1o8t h GLN 17 Cb 0.23 0.08 -0.10 0.00 0.05 0.00 0.00 27.48 27.75 1o8t h GLN 17 CO -0.11 -0.18 -0.06 0.28 -1.50 0.00 0.00 178.83 177.26 1o8t n VAL 18 N -5.21 -0.21 -0.06 -0.54 0.31 -0.99 0.18 118.33 111.81 1o8t n VAL 18 Ca -0.10 1.14 -0.08 0.00 -0.01 0.00 0.00 64.34 65.29 1o8t n VAL 18 Cb 0.20 -1.61 -0.01 0.00 -0.91 0.00 0.00 33.84 31.51 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 -0.20 0.00 5.55 6.56 -1.65 -0.30 116.57 126.53 1o8t h LYS 19 Ca 0.27 0.01 -0.04 0.00 -1.06 0.00 0.00 60.65 59.84 1o8t h LYS 19 Cb 0.50 0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 32.20 1o8t h LYS 19 CO -0.50 -0.13 -0.17 0.93 -2.06 0.00 0.00 179.45 177.52 1o8t h GLU 20 N -0.21 0.00 -0.44 3.15 5.08 -0.44 -2.23 114.58 119.49 1o8t h GLU 20 Ca 0.15 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1o8t h GLU 20 Cb 0.43 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1o8t h GLU 20 CO -0.39 0.17 0.20 1.03 -1.00 0.00 0.00 179.01 179.02 1o8t h SER 21 N 0.00 0.60 -0.31 1.42 0.87 -0.71 -1.15 113.55 114.26 1o8t h SER 21 Ca -0.00 -0.15 -0.18 0.00 -1.23 0.00 0.00 61.79 60.23 1o8t h SER 21 Cb 0.34 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1o8t h SER 21 CO 0.02 0.58 -0.52 0.25 -0.53 0.00 0.00 176.83 176.63 1o8t h LEU 22 N 0.58 0.99 0.18 2.23 5.85 -1.03 -2.61 115.31 121.50 1o8t h LEU 22 Ca 0.15 -0.52 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 1o8t h LEU 22 Cb 0.15 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1o8t h LEU 22 CO -0.02 1.32 -0.12 -1.28 -0.34 0.00 0.00 178.44 178.01 1o8t h SER 23 N 0.70 -0.30 0.39 1.25 0.87 -1.26 0.38 113.55 115.58 1o8t h SER 23 Ca 0.02 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1o8t h SER 23 Cb 1.13 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1o8t h SER 23 CO 0.12 -0.19 0.00 0.28 -0.53 0.00 0.00 176.83 176.50 1o8t h SER 24 N -0.30 0.00 0.17 6.23 0.02 -1.26 -2.30 113.55 116.11 1o8t h SER 24 Ca -0.01 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.68 1o8t h SER 24 Cb 0.26 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.82 1o8t h SER 24 CO 0.01 0.00 -1.16 0.22 -1.14 0.00 0.00 176.83 174.76 1o8t h TYR 25 N 0.00 0.65 -0.52 3.45 3.20 -0.88 -3.33 116.97 119.54 1o8t h TYR 25 Ca 0.00 -0.48 -0.05 0.00 3.14 0.00 0.00 58.73 61.34 1o8t h TYR 25 Cb 0.19 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1o8t h TYR 25 CO 0.00 1.45 0.11 -1.49 -1.64 0.00 0.00 178.16 176.59 1o8t h TRP 26 N -0.20 0.83 -0.91 -3.82 4.06 -0.48 0.19 115.95 115.63 1o8t h TRP 26 Ca -0.22 -0.08 0.09 0.00 2.06 0.00 0.00 58.89 60.75 1o8t h TRP 26 Cb 1.83 -0.24 -0.12 0.00 -1.00 0.00 0.00 29.16 29.63 1o8t h TRP 26 CO 0.16 0.71 -0.55 0.93 -3.56 0.00 0.00 178.44 176.13 1o8t h GLU 27 N 0.77 -0.05 -0.00 0.49 3.07 -1.54 0.89 114.58 118.20 1o8t h GLU 27 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1o8t h GLU 27 Cb 0.31 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1o8t h GLU 27 CO 0.00 -0.04 -0.51 0.45 -1.40 0.00 0.00 179.01 177.51 1o8t n SER 28 N -5.30 0.69 0.14 1.42 2.88 -1.19 -4.12 113.62 108.13 1o8t n SER 28 Ca 0.02 -0.48 0.06 0.00 -1.33 0.00 0.00 58.87 57.14 1o8t n SER 28 Cb 0.29 0.32 0.52 0.00 -0.75 0.00 0.00 64.21 64.60 1o8t n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o8t h ALA 29 N 3.14 1.81 -0.35 -1.46 0.00 0.13 -2.80 119.26 119.75 1o8t h ALA 29 Ca 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.94 1o8t h ALA 29 Cb 0.51 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1o8t h ALA 29 CO 0.00 0.16 -0.07 0.87 0.00 0.00 0.00 179.25 180.21 1o8t h LYS 30 N 0.24 0.02 -1.03 0.00 1.79 -1.66 0.08 116.57 116.01 1o8t h LYS 30 Ca 0.06 -0.00 0.26 0.00 -2.18 0.00 0.00 60.65 58.80 1o8t h LYS 30 Cb 0.03 -0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 30.57 1o8t h LYS 30 CO -0.01 0.01 0.64 1.15 -1.08 0.00 0.00 179.45 180.17 1o8t h THR 31 N 0.02 0.51 -0.66 -0.16 2.02 -1.78 0.45 112.91 113.30 1o8t h THR 31 Ca 0.17 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1o8t h THR 31 Cb 0.25 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.64 1o8t h THR 31 CO -0.34 0.08 0.31 0.00 0.37 0.00 0.00 175.52 175.94 1o8t h ALA 32 N 1.67 0.85 -0.24 6.16 0.00 -1.08 -0.73 119.26 125.90 1o8t h ALA 32 Ca 0.63 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.45 1o8t h ALA 32 Cb 1.43 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 1o8t h ALA 32 CO -0.38 0.42 -0.41 0.00 0.00 0.00 0.00 179.25 178.88 1o8t h ALA 33 N 1.14 -0.50 -0.53 0.00 0.00 0.24 0.61 119.26 120.23 1o8t h ALA 33 Ca 0.23 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1o8t h ALA 33 Cb 0.12 0.80 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1o8t h ALA 33 CO -0.03 -0.88 0.08 0.37 0.00 0.00 0.00 179.25 178.79 1o8t h GLN 34 N -0.42 0.84 0.00 0.00 4.15 -1.43 -1.85 115.11 116.40 1o8t h GLN 34 Ca 0.10 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 1o8t h GLN 34 Cb 0.60 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.18 1o8t h GLN 34 CO -0.46 0.79 -0.07 -0.97 -1.93 0.00 0.00 178.83 176.18 1o8t h ASN 35 N 0.79 0.00 -0.36 -0.69 -0.73 0.50 -1.54 115.58 113.56 1o8t h ASN 35 Ca 0.17 0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.39 1o8t h ASN 35 Cb 0.36 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.91 1o8t h ASN 35 CO 0.01 0.07 0.09 0.25 -0.37 0.00 0.00 177.43 177.48 1o8t h LEU 36 N 0.00 0.05 -0.88 0.34 5.85 0.10 0.32 115.31 121.09 1o8t h LEU 36 Ca -0.00 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 1o8t h LEU 36 Cb 0.15 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1o8t h LEU 36 CO 0.01 0.06 0.27 1.88 -0.34 0.00 0.00 178.44 180.33 1o8t h TYR 37 N 0.22 1.12 0.64 1.25 0.05 -1.35 -2.87 116.97 116.02 1o8t h TYR 37 Ca 0.17 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 1o8t h TYR 37 Cb 0.18 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 1o8t h TYR 37 CO -0.17 0.86 -0.43 1.49 -1.05 0.00 0.00 178.16 178.85 1o8t h GLU 38 N 1.07 -0.98 0.00 4.88 4.57 -0.30 -2.35 114.58 121.47 1o8t h GLU 38 Ca 0.24 0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.49 1o8t h GLU 38 Cb 0.23 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 1o8t h GLU 38 CO -0.02 -0.66 0.03 1.63 -1.18 0.00 0.00 179.01 178.81 1o8t n LYS 39 N -5.56 0.10 0.21 1.92 5.02 0.91 -2.43 118.16 118.33 1o8t n LYS 39 Ca -0.13 0.59 -0.14 0.00 -2.02 0.00 0.00 58.31 56.61 1o8t n LYS 39 Cb 0.44 -1.85 -0.08 0.00 -0.02 0.00 0.00 35.03 33.52 1o8t n LYS 39 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1o8t h THR 40 N 0.00 0.54 -0.37 -0.18 2.02 -1.19 -3.19 112.91 110.55 1o8t h THR 40 Ca 0.00 -0.47 -0.08 0.00 0.77 0.00 0.00 66.41 66.63 1o8t h THR 40 Cb 0.05 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1o8t h THR 40 CO 0.00 0.08 -0.11 1.88 0.37 0.00 0.00 175.52 177.74 1o8t h TYR 41 N -0.84 0.69 -3.91 3.16 0.05 -1.55 -3.44 116.97 111.14 1o8t h TYR 41 Ca -0.06 -0.11 -0.50 0.00 0.05 0.00 0.00 58.73 58.11 1o8t h TYR 41 Cb 0.55 -0.18 0.04 0.00 1.01 0.00 0.00 36.73 38.14 1o8t h TYR 41 CO 0.01 0.72 0.48 -0.51 -1.05 0.00 0.00 178.16 177.81 1o8t s LEU 42 N -8.95 4.28 -0.17 3.88 1.43 -1.12 -4.95 118.68 113.07 1o8t s LEU 42 Ca -0.08 2.27 0.07 0.00 -1.03 0.00 0.00 54.13 55.36 1o8t s LEU 42 Cb 0.14 -3.94 0.46 0.00 0.03 0.00 0.00 46.19 42.88 1o8t s LEU 42 CO 0.80 -0.49 1.32 -0.81 0.23 0.00 0.00 176.35 177.40 1o8t n PRO 43 N 0.36 2.88 0.20 1.29 -0.04 -1.26 -4.40 135.00 134.03 1o8t n PRO 43 Ca 0.03 -1.84 0.14 0.00 -0.04 0.00 0.00 63.50 61.80 1o8t n PRO 43 Cb 0.46 -1.88 0.67 0.00 -0.04 0.00 0.00 33.50 32.71 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 2.70 1.00 -0.90 0.55 0.00 -1.93 -3.31 119.26 117.37 1o8t h ALA 44 Ca 0.10 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.11 1o8t h ALA 44 Cb 1.58 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.24 1o8t h ALA 44 CO 0.39 0.00 -0.53 0.28 0.00 0.00 0.00 179.25 179.39 1o8t h VAL 45 N 0.00 0.01 0.00 0.00 2.07 -1.87 0.32 116.25 116.78 1o8t h VAL 45 Ca 0.00 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.40 1o8t h VAL 45 Cb 0.24 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 1o8t h VAL 45 CO 0.00 0.00 -0.56 0.44 0.02 0.00 0.00 177.57 177.47 1o8t h ASP 46 N -0.06 0.00 0.17 0.57 5.19 -1.97 -3.27 116.42 117.05 1o8t h ASP 46 Ca 0.19 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.59 1o8t h ASP 46 Cb 0.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.99 1o8t h ASP 46 CO -0.89 0.56 -0.08 -0.08 -3.12 0.00 0.00 179.24 175.63 1o8t h GLU 47 N 0.00 -0.22 -0.37 3.56 4.22 -1.08 -3.03 114.58 117.67 1o8t h GLU 47 Ca -0.01 0.01 0.11 0.00 0.08 0.00 0.00 59.36 59.56 1o8t h GLU 47 Cb 1.11 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1o8t h GLU 47 CO 0.07 0.13 0.40 0.87 -2.18 0.00 0.00 179.01 178.31 1o8t h LYS 48 N -0.60 0.00 0.36 1.92 6.56 -0.55 0.28 116.57 124.53 1o8t h LYS 48 Ca -0.02 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.55 1o8t h LYS 48 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.11 1o8t h LYS 48 CO 0.04 0.00 -0.17 -0.07 -2.06 0.00 0.00 179.45 177.19 1o8t h LEU 49 N 0.00 -0.41 -1.43 2.94 3.38 -1.58 -0.55 115.31 117.66 1o8t h LEU 49 Ca 0.18 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1o8t h LEU 49 Cb 0.98 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1o8t h LEU 49 CO -0.00 -0.26 0.01 0.03 0.09 0.00 0.00 178.44 178.31 1o8t h ARG 50 N -0.55 0.37 0.30 1.13 2.47 -1.50 -0.49 114.38 116.12 1o8t h ARG 50 Ca -0.05 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.61 1o8t h ARG 50 Cb 0.37 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.60 1o8t h ARG 50 CO 0.08 0.40 -0.32 0.22 0.56 0.00 0.00 179.97 180.91 1o8t h ASP 51 N 0.37 -0.88 1.28 7.04 3.58 -0.40 -2.29 116.42 125.12 1o8t h ASP 51 Ca 0.08 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.61 1o8t h ASP 51 Cb 0.24 0.30 0.00 0.00 1.72 0.00 0.00 39.33 41.59 1o8t h ASP 51 CO 0.01 -0.45 0.00 0.18 -2.88 0.00 0.00 179.24 176.09 1o8t n LEU 52 N -5.44 0.68 -0.00 2.28 4.32 -0.22 -3.65 117.00 114.98 1o8t n LEU 52 Ca -0.09 0.58 -0.13 0.00 -0.02 0.00 0.00 56.01 56.35 1o8t n LEU 52 Cb 0.34 -0.38 -0.09 0.00 -1.62 0.00 0.00 43.42 41.66 1o8t n LEU 52 CO 0.28 -0.22 0.69 1.88 -1.22 0.00 0.00 177.39 178.80 1o8t h TYR 53 N 0.00 0.01 -0.28 -1.77 0.05 -0.54 0.61 116.97 115.06 1o8t h TYR 53 Ca 0.00 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 1o8t h TYR 53 Cb 0.64 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.36 1o8t h TYR 53 CO 0.00 0.38 0.16 0.66 -1.05 0.00 0.00 178.16 178.31 1o8t h SER 54 N -0.35 0.34 -0.17 3.88 4.64 -1.54 -0.19 113.55 120.17 1o8t h SER 54 Ca 0.00 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1o8t h SER 54 Cb 0.37 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1o8t h SER 54 CO 0.00 0.30 0.09 0.11 -0.87 0.00 0.00 176.83 176.46 1o8t h LYS 55 N 0.35 0.24 -0.55 4.77 1.57 -1.62 -3.00 116.57 118.33 1o8t h LYS 55 Ca 0.10 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1o8t h LYS 55 Cb 0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1o8t h LYS 55 CO -0.02 0.25 0.24 0.66 -0.57 0.00 0.00 179.45 180.02 1o8t h SER 56 N 0.16 0.74 -0.29 0.86 4.64 -0.73 -0.72 113.55 118.20 1o8t h SER 56 Ca 0.06 -0.15 0.05 0.00 -0.47 0.00 0.00 61.79 61.28 1o8t h SER 56 Cb 0.09 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1o8t h SER 56 CO -0.01 0.69 0.20 0.71 -0.87 0.00 0.00 176.83 177.55 1o8t h THR 57 N 0.74 0.94 0.00 2.95 1.35 -0.97 0.42 112.91 118.34 1o8t h THR 57 Ca 0.19 -0.06 -0.07 0.00 -0.55 0.00 0.00 66.41 65.92 1o8t h THR 57 Cb 0.16 0.75 -0.01 0.00 -1.73 0.00 0.00 68.15 67.33 1o8t h THR 57 CO -0.02 0.03 -0.44 0.00 -0.25 0.00 0.00 175.52 174.84 1o8t h ALA 58 N 1.84 0.08 0.57 6.62 0.00 -1.35 -3.21 119.26 123.80 1o8t h ALA 58 Ca 0.13 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1o8t h ALA 58 Cb 0.30 0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1o8t h ALA 58 CO -0.02 0.29 -0.27 0.00 0.00 0.00 0.00 179.25 179.24 1o8t h ALA 59 N -0.52 -0.76 0.00 0.00 0.00 -1.03 -2.81 119.26 114.14 1o8t h ALA 59 Ca -0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1o8t h ALA 59 Cb 0.79 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1o8t h ALA 59 CO -0.06 -0.86 0.00 -0.12 0.00 0.00 0.00 179.25 178.21 1o8t n MET 60 N -5.37 0.10 0.28 0.00 0.00 0.15 -2.08 117.12 110.20 1o8t n MET 60 Ca -0.12 0.55 0.17 0.00 0.00 0.00 0.00 57.70 58.30 1o8t n MET 60 Cb 0.33 -1.80 0.80 0.00 0.00 0.00 0.00 33.22 32.54 1o8t n MET 60 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1o8t h SER 61 N 0.00 0.00 0.00 6.12 0.87 -1.49 0.53 113.55 119.58 1o8t h SER 61 Ca 0.00 0.00 -0.42 0.00 -1.23 0.00 0.00 61.79 60.14 1o8t h SER 61 Cb 0.06 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.96 1o8t h SER 61 CO 0.00 0.04 -2.35 0.35 -0.53 0.00 0.00 176.83 174.35 1o8t n THR 62 N -3.22 1.53 0.27 2.23 -2.24 -0.88 -4.32 114.28 107.65 1o8t n THR 62 Ca -0.01 -0.33 0.07 0.00 -2.27 0.00 0.00 64.05 61.51 1o8t n THR 62 Cb 0.25 -1.92 0.30 0.00 -2.10 0.00 0.00 70.33 66.86 1o8t n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o8t n TYR 63 N -4.28 0.28 0.25 4.78 9.36 -1.21 -2.11 117.16 124.23 1o8t n TYR 63 Ca -0.51 0.13 -0.11 0.00 3.32 0.00 0.00 57.90 60.73 1o8t n TYR 63 Cb 0.85 -0.71 -0.06 0.00 -0.63 0.00 0.00 39.34 38.80 1o8t n TYR 63 CO 0.00 0.00 0.00 1.15 0.22 0.00 0.00 176.86 178.23 1o8t h THR 64 N 0.00 0.07 -0.55 2.97 2.02 -1.07 0.69 112.91 117.04 1o8t h THR 64 Ca 0.00 -0.50 -0.06 0.00 0.77 0.00 0.00 66.41 66.63 1o8t h THR 64 Cb 0.15 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.64 1o8t h THR 64 CO 0.00 0.01 0.12 1.23 0.37 0.00 0.00 175.52 177.25 1o8t h GLY 65 N -1.16 0.92 0.83 2.16 0.00 -1.75 -1.38 103.07 102.68 1o8t h GLY 65 Ca -0.07 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 46.67 1o8t h GLY 65 CO 0.12 0.51 -0.38 -2.22 0.00 0.00 0.00 176.54 174.56 1o8t h ILE 66 N 0.82 0.04 -0.22 2.60 1.08 -1.45 0.63 117.51 121.01 1o8t h ILE 66 Ca 0.18 -0.20 0.06 0.00 -0.39 0.00 0.00 64.86 64.51 1o8t h ILE 66 Cb 0.32 0.05 -0.07 0.00 -3.07 0.00 0.00 36.82 34.05 1o8t h ILE 66 CO 0.00 0.00 -0.32 0.15 -0.69 0.00 0.00 178.15 177.30 1o8t h PHE 67 N -1.26 -0.88 0.00 1.37 3.57 0.45 0.64 116.94 120.83 1o8t h PHE 67 Ca -0.11 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1o8t h PHE 67 Cb 0.83 0.42 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 1o8t h PHE 67 CO -0.00 -0.39 -0.03 1.79 -2.23 0.00 0.00 178.31 177.45 1o8t h THR 68 N -0.34 0.16 0.12 4.41 1.35 -1.30 -2.96 112.91 114.35 1o8t h THR 68 Ca 0.12 -0.31 0.01 0.00 -0.55 0.00 0.00 66.41 65.68 1o8t h THR 68 Cb 0.54 1.26 -0.02 0.00 -1.73 0.00 0.00 68.15 68.20 1o8t h THR 68 CO -0.41 0.03 -0.17 -0.78 -0.25 0.00 0.00 175.52 173.94 1o8t h ASP 69 N 0.00 -0.46 0.60 5.36 1.82 0.16 0.32 116.42 124.21 1o8t h ASP 69 Ca -0.00 0.05 -0.08 0.00 -0.39 0.00 0.00 57.03 56.61 1o8t h ASP 69 Cb 0.26 0.17 -0.01 0.00 0.68 0.00 0.00 39.33 40.43 1o8t h ASP 69 CO 0.00 -0.25 -0.39 1.56 -1.61 0.00 0.00 179.24 178.56 1o8t h GLN 70 N -0.34 0.00 0.23 0.28 7.50 -1.45 -1.65 115.11 119.68 1o8t h GLN 70 Ca 0.02 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.16 1o8t h GLN 70 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.88 1o8t h GLN 70 CO -0.08 0.39 -0.11 0.28 -1.50 0.00 0.00 178.83 177.81 1o8t h VAL 71 N 0.00 0.83 -0.67 -0.54 2.07 -1.29 -2.46 116.25 114.19 1o8t h VAL 71 Ca -0.00 -0.72 0.08 0.00 0.82 0.00 0.00 66.70 66.87 1o8t h VAL 71 Cb 0.80 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1o8t h VAL 71 CO 0.05 0.15 0.44 0.25 0.02 0.00 0.00 177.57 178.48 1o8t h LEU 72 N -0.70 0.54 -1.16 2.57 5.85 -0.35 0.21 115.31 122.27 1o8t h LEU 72 Ca -0.03 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.75 1o8t h LEU 72 Cb 0.48 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 1o8t h LEU 72 CO 0.05 0.34 0.58 -1.28 -0.34 0.00 0.00 178.44 177.79 1o8t h SER 73 N 0.61 0.91 1.01 1.25 0.87 -1.07 0.14 113.55 117.26 1o8t h SER 73 Ca 0.30 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 1o8t h SER 73 Cb 0.37 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1o8t h SER 73 CO -0.10 0.60 0.00 0.58 -0.53 0.00 0.00 176.83 177.38 1o8t h VAL 74 N 1.04 0.00 -0.61 2.23 2.07 -0.49 -2.92 116.25 117.57 1o8t h VAL 74 Ca 0.37 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1o8t h VAL 74 Cb 0.14 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1o8t h VAL 74 CO -0.13 0.00 0.12 0.25 0.02 0.00 0.00 177.57 177.83 1o8t h LEU 75 N 0.00 0.92 -0.34 2.57 5.85 -0.47 0.20 115.31 124.05 1o8t h LEU 75 Ca 0.00 -0.19 -0.18 0.00 0.84 0.00 0.00 57.88 58.35 1o8t h LEU 75 Cb 0.51 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1o8t h LEU 75 CO 0.00 0.91 -0.54 0.50 -0.34 0.00 0.00 178.44 178.98 1o8t h LYS 76 N 0.93 0.84 0.09 1.25 3.64 -1.50 -2.81 116.57 118.99 1o8t h LYS 76 Ca 0.19 -0.52 -0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1o8t h LYS 76 Cb 0.37 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1o8t h LYS 76 CO 0.00 1.16 -0.04 0.78 -2.27 0.00 0.00 179.45 179.08 1o8t h GLY 77 N 0.75 -0.12 -4.74 5.01 0.00 -1.51 -3.44 103.07 99.03 1o8t h GLY 77 Ca 0.02 0.04 -0.19 0.00 0.00 0.00 0.00 47.33 47.20 1o8t h GLY 77 CO 0.12 -0.04 -0.65 -2.21 0.00 0.00 0.00 176.54 173.75 1o8t n GLU 78 N -2.48 1.28 -0.89 4.80 4.07 -0.46 -5.12 120.64 121.84 1o8t n GLU 78 Ca -0.01 -2.12 0.00 0.00 -0.06 0.00 0.00 57.16 54.96 1o8t n GLU 78 Cb 0.05 -0.37 0.00 0.00 -0.06 0.00 0.00 31.44 31.06 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16