#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 0.18 -2.74 -0.78 4.20 -2.04 -3.39 115.11 110.54 1o8t h GLN 2 Ca 0.00 -0.08 -0.60 0.00 0.06 0.00 0.00 58.65 58.03 1o8t h GLN 2 Cb 0.00 -0.01 -0.40 0.00 0.30 0.00 0.00 27.48 27.38 1o8t h GLN 2 CO 0.00 0.53 -0.80 -1.14 -0.67 0.00 0.00 178.83 176.76 1o8t s GLN 3 N -4.60 1.39 -0.99 1.46 0.74 -1.26 -5.04 119.66 111.36 1o8t s GLN 3 Ca -0.15 -2.35 -0.21 0.00 0.05 0.00 0.00 55.36 52.70 1o8t s GLN 3 Cb 0.04 -2.19 -0.11 0.00 1.10 0.00 0.00 33.01 31.86 1o8t s GLN 3 CO 0.71 -1.29 1.94 -0.35 -0.55 0.00 0.00 175.29 175.75 1o8t n PRO 4 N 2.89 1.76 0.08 1.67 -0.04 -1.26 -4.72 135.00 135.38 1o8t n PRO 4 Ca 0.20 -2.19 -0.04 0.00 -0.04 0.00 0.00 63.50 61.43 1o8t n PRO 4 Cb 0.40 -3.23 -0.02 0.00 -0.04 0.00 0.00 33.50 30.61 1o8t n PRO 4 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1o8t h GLN 5 N 8.25 -0.22 0.61 0.54 1.08 -1.96 -3.40 115.11 120.00 1o8t h GLN 5 Ca 0.38 0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.56 1o8t h GLN 5 Cb 0.76 0.05 0.01 0.00 -0.05 0.00 0.00 27.48 28.25 1o8t h GLN 5 CO 1.70 -0.15 -0.29 0.37 -0.95 0.00 0.00 178.83 179.51 1o8t h GLN 6 N -0.52 -0.79 -7.35 1.46 -0.00 -2.07 -3.45 115.11 102.39 1o8t h GLN 6 Ca -0.02 0.05 -0.49 0.00 -0.00 0.00 0.00 58.65 58.19 1o8t h GLN 6 Cb 0.18 0.18 0.13 0.00 0.00 0.00 0.00 27.48 27.97 1o8t h GLN 6 CO 0.04 -0.52 0.29 -0.51 0.00 0.00 0.00 178.83 178.13 1o8t s ASP 7 N -4.62 3.98 0.45 -0.69 1.01 -1.26 -5.00 116.67 110.53 1o8t s ASP 7 Ca -0.12 1.52 -0.23 0.00 0.71 0.00 0.00 52.55 54.42 1o8t s ASP 7 Cb 0.01 -2.22 -0.08 0.00 1.01 0.00 0.00 42.92 41.65 1o8t s ASP 7 CO 0.37 -2.32 1.16 -0.70 0.21 0.00 0.00 175.17 173.88 1o8t s GLU 8 N -4.98 3.81 -0.00 8.23 -6.30 -1.26 -4.74 118.70 113.46 1o8t s GLU 8 Ca 0.62 1.76 -0.30 0.00 -2.50 0.00 0.00 54.97 54.54 1o8t s GLU 8 Cb -0.17 -2.43 -0.06 0.00 0.00 0.00 0.00 34.13 31.47 1o8t s GLU 8 CO 0.56 -0.50 1.49 1.41 0.02 0.00 0.00 175.26 178.24 1o8t s MET 9 N -2.66 4.25 0.22 4.30 -2.45 -1.26 -4.90 119.30 116.80 1o8t s MET 9 Ca 0.63 2.07 -0.32 0.00 -1.25 0.00 0.00 55.69 56.82 1o8t s MET 9 Cb -0.28 -3.65 -0.12 0.00 1.25 0.00 0.00 34.83 32.03 1o8t s MET 9 CO 0.34 -0.66 1.66 -2.30 1.05 0.00 0.00 175.02 175.11 1o8t n PRO 10 N 5.74 2.63 -2.41 4.11 -0.02 -1.26 -4.96 135.00 138.83 1o8t n PRO 10 Ca 0.14 0.94 -0.40 0.00 -2.02 0.00 0.00 63.50 62.17 1o8t n PRO 10 Cb 0.43 -2.76 -0.04 0.00 -0.02 0.00 0.00 33.50 31.11 1o8t n PRO 10 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1o8t s SER 11 N 0.94 7.15 0.24 2.55 0.15 -1.26 -4.97 113.70 118.50 1o8t s SER 11 Ca 0.73 2.34 -0.31 0.00 0.70 0.00 0.00 55.95 59.41 1o8t s SER 11 Cb -0.54 -2.63 -0.12 0.00 -1.71 0.00 0.00 66.02 61.02 1o8t s SER 11 CO 0.37 -0.24 1.66 -0.81 1.20 0.00 0.00 173.24 175.43 1o8t n PRO 12 N 1.06 2.72 -2.32 5.44 -0.04 -1.26 -4.95 135.00 135.65 1o8t n PRO 12 Ca -0.01 0.97 -0.42 0.00 -0.04 0.00 0.00 63.50 64.01 1o8t n PRO 12 Cb 0.44 -2.79 -0.03 0.00 -0.04 0.00 0.00 33.50 31.08 1o8t n PRO 12 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1o8t s THR 13 N 0.66 3.61 0.00 0.52 -1.32 -1.26 -4.91 115.64 112.93 1o8t s THR 13 Ca 0.71 1.23 0.00 0.00 -1.21 0.00 0.00 61.69 62.42 1o8t s THR 13 Cb -0.51 -3.79 0.00 0.00 -1.51 0.00 0.00 72.50 66.69 1o8t s THR 13 CO 0.39 0.14 0.00 0.49 -2.21 0.00 0.00 174.62 173.43 1o8t n PHE 14 N 3.31 0.00 0.04 9.09 3.72 -1.26 -4.67 117.46 127.69 1o8t n PHE 14 Ca 0.08 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.35 1o8t n PHE 14 Cb 0.44 0.23 -0.08 0.00 -0.94 0.00 0.00 39.48 39.14 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 -0.03 -1.32 4.37 7.12 -2.01 -2.22 115.31 121.21 1o8t h LEU 15 Ca 0.00 -0.12 0.06 0.00 0.13 0.00 0.00 57.88 57.94 1o8t h LEU 15 Cb 0.00 0.01 -0.05 0.00 -0.53 0.00 0.00 40.66 40.09 1o8t h LEU 15 CO 0.00 0.10 0.50 0.74 -0.13 0.00 0.00 178.44 179.65 1o8t h THR 16 N -0.17 1.05 -0.09 1.05 2.02 -1.97 -2.44 112.91 112.35 1o8t h THR 16 Ca -0.00 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 1o8t h THR 16 Cb 0.16 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1o8t h THR 16 CO 0.01 0.15 0.04 -0.61 0.37 0.00 0.00 175.52 175.48 1o8t h GLN 17 N 0.84 0.12 -0.51 6.66 4.15 -1.76 -3.21 115.11 121.40 1o8t h GLN 17 Ca 0.32 -0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.82 1o8t h GLN 17 Cb 0.21 -0.02 -0.09 0.00 0.21 0.00 0.00 27.48 27.79 1o8t h GLN 17 CO -0.11 0.19 -0.17 0.28 -1.93 0.00 0.00 178.83 177.09 1o8t n VAL 18 N -4.97 -0.25 -0.04 2.39 0.31 -0.86 0.30 118.33 115.21 1o8t n VAL 18 Ca -0.06 1.19 -0.08 0.00 -0.01 0.00 0.00 64.34 65.38 1o8t n VAL 18 Cb 0.08 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.39 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 -0.25 -0.12 5.55 1.79 -1.68 -0.16 116.57 121.70 1o8t h LYS 19 Ca 0.20 0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.65 1o8t h LYS 19 Cb 0.33 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1o8t h LYS 19 CO -0.52 -0.16 -0.13 1.49 -1.08 0.00 0.00 179.45 179.05 1o8t h GLU 20 N -0.25 0.19 -0.77 3.15 4.22 -0.31 -2.25 114.58 118.56 1o8t h GLU 20 Ca 0.13 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.49 1o8t h GLU 20 Cb 0.46 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 1o8t h GLU 20 CO -0.38 0.33 0.34 0.77 -2.18 0.00 0.00 179.01 177.89 1o8t h SER 21 N 0.19 1.03 -0.06 1.04 0.02 0.21 -2.21 113.55 113.77 1o8t h SER 21 Ca 0.04 -0.15 -0.16 0.00 -0.84 0.00 0.00 61.79 60.67 1o8t h SER 21 Cb 0.35 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1o8t h SER 21 CO 0.02 0.90 -0.52 0.25 -1.14 0.00 0.00 176.83 176.34 1o8t h LEU 22 N 1.10 0.70 0.31 5.07 7.12 -0.64 -2.57 115.31 126.40 1o8t h LEU 22 Ca 0.26 -0.36 -0.01 0.00 0.13 0.00 0.00 57.88 57.90 1o8t h LEU 22 Cb 0.16 -0.20 -0.00 0.00 -0.53 0.00 0.00 40.66 40.09 1o8t h LEU 22 CO -0.03 1.09 -0.19 -1.28 -0.13 0.00 0.00 178.44 177.90 1o8t h SER 23 N 0.49 -0.48 0.39 1.25 0.87 -1.11 0.02 113.55 114.99 1o8t h SER 23 Ca 0.02 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1o8t h SER 23 Cb 1.07 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1o8t h SER 23 CO 0.10 -0.31 0.00 0.77 -0.53 0.00 0.00 176.83 176.87 1o8t h SER 24 N -0.48 0.00 0.14 6.23 4.64 -1.44 -2.40 113.55 120.24 1o8t h SER 24 Ca -0.03 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.05 1o8t h SER 24 Cb 0.40 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.52 1o8t h SER 24 CO 0.03 0.00 -1.04 0.22 -0.87 0.00 0.00 176.83 175.17 1o8t h TYR 25 N 0.00 0.77 -0.48 4.77 3.20 -0.84 -3.31 116.97 121.08 1o8t h TYR 25 Ca 0.00 -0.52 -0.05 0.00 3.14 0.00 0.00 58.73 61.30 1o8t h TYR 25 Cb 0.20 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1o8t h TYR 25 CO 0.00 1.39 0.09 2.35 -1.64 0.00 0.00 178.16 180.35 1o8t h TRP 26 N -0.06 0.76 -0.89 -3.82 7.01 -0.54 -0.54 115.95 117.87 1o8t h TRP 26 Ca -0.17 -0.07 0.08 0.00 2.11 0.00 0.00 58.89 60.84 1o8t h TRP 26 Cb 1.78 -0.22 -0.11 0.00 -2.10 0.00 0.00 29.16 28.51 1o8t h TRP 26 CO 0.16 0.66 -0.57 1.49 -2.79 0.00 0.00 178.44 177.39 1o8t h GLU 27 N 0.71 -0.05 0.00 2.65 4.22 -1.57 0.18 114.58 120.73 1o8t h GLU 27 Ca 0.16 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.60 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 -0.03 -0.41 0.77 -2.18 0.00 0.00 179.01 177.16 1o8t h SER 28 N -0.05 0.00 -0.19 1.04 0.02 -1.70 -3.32 113.55 109.34 1o8t h SER 28 Ca 0.14 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1o8t h SER 28 Cb 0.42 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1o8t h SER 28 CO -0.87 0.05 0.11 0.00 -1.14 0.00 0.00 176.83 174.98 1o8t h ALA 29 N 2.41 1.79 -0.19 3.77 0.00 0.10 -2.88 119.26 124.26 1o8t h ALA 29 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1o8t h ALA 29 Cb 0.79 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1o8t h ALA 29 CO 0.00 0.18 -0.18 -0.22 0.00 0.00 0.00 179.25 179.03 1o8t h LYS 30 N 0.29 -0.19 -1.04 0.00 3.11 -1.45 -0.13 116.57 117.17 1o8t h LYS 30 Ca 0.08 0.01 0.27 0.00 -2.81 0.00 0.00 60.65 58.20 1o8t h LYS 30 Cb 0.03 0.04 -0.11 0.00 -1.00 0.00 0.00 32.23 31.19 1o8t h LYS 30 CO -0.01 -0.13 0.65 1.15 -2.81 0.00 0.00 179.45 178.30 1o8t h THR 31 N -0.20 0.51 -0.66 1.00 2.02 -1.76 0.45 112.91 114.26 1o8t h THR 31 Ca 0.12 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1o8t h THR 31 Cb 0.37 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.77 1o8t h THR 31 CO -0.30 0.08 0.31 0.00 0.37 0.00 0.00 175.52 175.98 1o8t h ALA 32 N 1.67 0.85 -0.24 6.16 0.00 -1.10 -0.82 119.26 125.77 1o8t h ALA 32 Ca 0.63 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.45 1o8t h ALA 32 Cb 1.44 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 1o8t h ALA 32 CO -0.38 0.42 -0.40 0.00 0.00 0.00 0.00 179.25 178.89 1o8t h ALA 33 N 1.14 -0.47 -0.53 0.00 0.00 0.39 0.63 119.26 120.42 1o8t h ALA 33 Ca 0.23 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1o8t h ALA 33 Cb 0.12 0.79 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1o8t h ALA 33 CO -0.03 -0.87 0.08 0.37 0.00 0.00 0.00 179.25 178.80 1o8t h GLN 34 N -0.41 0.84 0.00 0.00 4.15 -1.43 -1.86 115.11 116.41 1o8t h GLN 34 Ca 0.11 -0.20 -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 28.17 1o8t h GLN 34 CO -0.46 0.79 -0.07 -0.97 -1.93 0.00 0.00 178.83 176.19 1o8t h ASN 35 N 0.80 0.00 -0.44 -0.69 -1.24 0.45 -1.56 115.58 112.90 1o8t h ASN 35 Ca 0.17 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.23 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 0.16 0.25 -1.29 0.00 0.00 177.43 176.63 1o8t h LEU 36 N 0.00 0.17 -0.93 0.34 7.12 0.11 0.16 115.31 122.28 1o8t h LEU 36 Ca -0.00 0.05 -0.05 0.00 0.13 0.00 0.00 57.88 58.01 1o8t h LEU 36 Cb 0.15 0.03 -0.03 0.00 -0.53 0.00 0.00 40.66 40.28 1o8t h LEU 36 CO 0.01 0.13 0.25 0.22 -0.13 0.00 0.00 178.44 178.91 1o8t h TYR 37 N 0.33 1.05 0.63 1.25 3.20 -1.34 -2.84 116.97 119.25 1o8t h TYR 37 Ca 0.20 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 1o8t h TYR 37 Cb 0.19 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1o8t h TYR 37 CO -0.15 0.81 -0.42 1.49 -1.64 0.00 0.00 178.16 178.26 1o8t h GLU 38 N 1.00 -0.96 0.00 1.82 4.22 -0.34 -2.48 114.58 117.85 1o8t h GLU 38 Ca 0.23 0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.73 1o8t h GLU 38 Cb 0.23 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1o8t h GLU 38 CO -0.01 -0.64 0.00 0.36 -2.18 0.00 0.00 179.01 176.54 1o8t n LYS 39 N -5.03 0.03 0.23 1.92 -0.00 0.34 -2.59 118.16 113.05 1o8t n LYS 39 Ca -0.12 0.51 -0.15 0.00 -0.00 0.00 0.00 58.31 58.55 1o8t n LYS 39 Cb 0.42 -1.59 -0.08 0.00 -0.00 0.00 0.00 35.03 33.78 1o8t n LYS 39 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1o8t h THR 40 N 0.00 0.56 -0.53 0.58 2.02 -1.18 -3.14 112.91 111.21 1o8t h THR 40 Ca 0.00 -0.31 -0.09 0.00 0.77 0.00 0.00 66.41 66.78 1o8t h THR 40 Cb 0.02 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1o8t h THR 40 CO 0.00 0.06 -0.02 1.88 0.37 0.00 0.00 175.52 177.80 1o8t h TYR 41 N -0.76 1.00 -3.95 3.16 0.05 -1.59 -3.44 116.97 111.43 1o8t h TYR 41 Ca -0.06 -0.16 -0.52 0.00 0.05 0.00 0.00 58.73 58.04 1o8t h TYR 41 Cb 0.53 -0.26 0.07 0.00 1.01 0.00 0.00 36.73 38.08 1o8t h TYR 41 CO -0.01 0.91 0.56 -0.51 -1.05 0.00 0.00 178.16 178.06 1o8t s LEU 42 N -9.21 4.18 -0.14 3.88 1.02 -1.19 -4.94 118.68 112.29 1o8t s LEU 42 Ca -0.10 2.51 0.07 0.00 0.02 0.00 0.00 54.13 56.63 1o8t s LEU 42 Cb 0.14 -3.98 0.44 0.00 0.02 0.00 0.00 46.19 42.81 1o8t s LEU 42 CO 0.83 -0.81 1.20 -0.81 0.02 0.00 0.00 176.35 176.78 1o8t n PRO 43 N 0.03 3.05 0.20 1.29 -0.04 -1.26 -4.35 135.00 133.92 1o8t n PRO 43 Ca 0.04 -1.71 0.14 0.00 -0.04 0.00 0.00 63.50 61.94 1o8t n PRO 43 Cb 0.45 -1.91 0.65 0.00 -0.04 0.00 0.00 33.50 32.66 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 3.01 1.00 -0.98 0.55 0.00 -1.92 -3.30 119.26 117.62 1o8t h ALA 44 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.06 1o8t h ALA 44 Cb 1.34 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.99 1o8t h ALA 44 CO 0.29 0.00 -0.46 0.28 0.00 0.00 0.00 179.25 179.35 1o8t h VAL 45 N 0.00 0.01 0.00 0.00 2.07 -1.87 0.29 116.25 116.75 1o8t h VAL 45 Ca 0.00 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 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 -0.61 0.44 0.02 0.00 0.00 177.57 177.42 1o8t h ASP 46 N -0.01 0.00 0.37 0.57 5.19 -1.96 -3.16 116.42 117.42 1o8t h ASP 46 Ca 0.27 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.66 1o8t h ASP 46 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 1o8t h ASP 46 CO -0.96 0.61 -0.18 -0.08 -3.12 0.00 0.00 179.24 175.52 1o8t h GLU 47 N 0.00 -0.48 -0.33 3.56 4.22 -0.84 -3.06 114.58 117.65 1o8t h GLU 47 Ca -0.01 0.03 0.09 0.00 0.08 0.00 0.00 59.36 59.56 1o8t h GLU 47 Cb 1.10 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1o8t h GLU 47 CO 0.08 -0.16 0.33 -0.22 -2.18 0.00 0.00 179.01 176.86 1o8t h LYS 48 N -0.87 0.00 0.47 1.92 1.63 -0.67 0.45 116.57 119.50 1o8t h LYS 48 Ca -0.05 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 1o8t h LYS 48 Cb 0.54 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.17 1o8t h LYS 48 CO 0.08 0.00 -0.23 1.25 -3.45 0.00 0.00 179.45 177.11 1o8t h LEU 49 N 0.00 -0.54 -1.67 5.20 5.85 -1.49 -1.28 115.31 121.38 1o8t h LEU 49 Ca 0.16 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1o8t h LEU 49 Cb 0.81 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1o8t h LEU 49 CO -0.00 -0.34 -0.14 0.03 -0.34 0.00 0.00 178.44 177.65 1o8t h ARG 50 N -0.72 0.03 0.52 1.25 2.47 -1.40 -2.11 114.38 114.40 1o8t h ARG 50 Ca -0.06 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1o8t h ARG 50 Cb 0.49 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.78 1o8t h ARG 50 CO 0.11 0.17 -0.45 0.22 0.56 0.00 0.00 179.97 180.57 1o8t h ASP 51 N 0.02 -1.22 0.81 7.04 1.82 0.01 -0.88 116.42 124.02 1o8t h ASP 51 Ca 0.00 0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 1o8t h ASP 51 Cb 0.27 0.39 -0.00 0.00 0.68 0.00 0.00 39.33 40.67 1o8t h ASP 51 CO 0.02 -0.63 -0.11 -0.07 -1.61 0.00 0.00 179.24 176.84 1o8t h LEU 52 N -0.96 0.00 -0.34 2.28 -0.00 -1.13 -3.00 115.31 112.16 1o8t h LEU 52 Ca -0.06 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.75 1o8t h LEU 52 Cb 0.83 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.48 1o8t h LEU 52 CO -0.03 0.11 -0.08 0.22 -0.00 0.00 0.00 178.44 178.66 1o8t h TYR 53 N 0.00 0.73 -0.06 1.13 5.03 -0.79 -0.64 116.97 122.38 1o8t h TYR 53 Ca -0.00 -0.16 -0.00 0.00 2.58 0.00 0.00 58.73 61.15 1o8t h TYR 53 Cb 0.55 -0.18 -0.00 0.00 1.55 0.00 0.00 36.73 38.64 1o8t h TYR 53 CO 0.00 0.82 0.03 1.03 -1.32 0.00 0.00 178.16 178.72 1o8t h SER 54 N 0.44 0.07 -0.50 -2.11 0.87 -1.03 -2.10 113.55 109.18 1o8t h SER 54 Ca 0.09 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1o8t h SER 54 Cb 0.58 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1o8t h SER 54 CO 0.03 0.11 0.27 0.11 -0.53 0.00 0.00 176.83 176.81 1o8t h LYS 55 N 0.03 0.70 0.00 2.24 1.57 -1.54 -2.28 116.57 117.29 1o8t h LYS 55 Ca 0.02 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1o8t h LYS 55 Cb 0.05 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1o8t h LYS 55 CO -0.00 0.56 0.00 0.77 -0.57 0.00 0.00 179.45 180.21 1o8t h SER 56 N 0.66 0.00 0.27 0.86 0.02 -0.91 -1.82 113.55 112.63 1o8t h SER 56 Ca 0.18 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1o8t h SER 56 Cb 0.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1o8t h SER 56 CO -0.03 0.00 -0.21 0.74 -1.14 0.00 0.00 176.83 176.20 1o8t h THR 57 N 0.00 0.56 0.11 -2.27 2.02 -0.76 -0.46 112.91 112.10 1o8t h THR 57 Ca 0.00 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.87 1o8t h THR 57 Cb 0.13 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1o8t h THR 57 CO 0.00 0.00 -1.65 0.00 0.37 0.00 0.00 175.52 174.24 1o8t h ALA 58 N 0.20 0.29 0.73 6.16 0.00 -1.69 -3.26 119.26 121.69 1o8t h ALA 58 Ca -0.02 -1.23 -0.04 0.00 0.00 0.00 0.00 54.91 53.63 1o8t h ALA 58 Cb 0.42 0.60 0.01 0.00 0.00 0.00 0.00 17.79 18.83 1o8t h ALA 58 CO -0.01 1.02 -0.35 0.00 0.00 0.00 0.00 179.25 179.91 1o8t h ALA 59 N -0.05 -1.14 0.00 0.00 0.00 -1.42 -3.03 119.26 113.63 1o8t h ALA 59 Ca -0.36 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1o8t h ALA 59 Cb 1.84 0.38 0.00 0.00 0.00 0.00 0.00 17.79 20.01 1o8t h ALA 59 CO 0.04 -1.06 0.00 1.98 0.00 0.00 0.00 179.25 180.21 1o8t h MET 60 N -1.09 0.00 0.00 0.00 4.05 -1.26 -2.12 114.93 114.50 1o8t h MET 60 Ca -0.10 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 1o8t h MET 60 Cb 0.75 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 1o8t h MET 60 CO 0.17 0.00 0.00 0.77 0.23 0.00 0.00 176.91 178.08 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.02 -1.51 -0.02 113.55 113.42 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 0.09 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.57 1o8t h SER 61 CO 0.00 0.00 -2.28 0.35 -1.14 0.00 0.00 176.83 173.76 1o8t n THR 62 N -2.65 1.53 0.31 -2.27 -2.24 -0.80 -4.21 114.28 103.95 1o8t n THR 62 Ca 0.00 -0.31 0.19 0.00 -2.27 0.00 0.00 64.05 61.67 1o8t n THR 62 Cb 0.20 -1.93 0.89 0.00 -2.10 0.00 0.00 70.33 67.39 1o8t n THR 62 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1o8t h TYR 63 N -1.00 0.00 0.49 4.78 0.05 -1.56 -0.28 116.97 119.45 1o8t h TYR 63 Ca -0.62 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.14 1o8t h TYR 63 Cb 1.53 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.28 1o8t h TYR 63 CO -0.08 0.00 -0.23 1.15 -1.05 0.00 0.00 178.16 177.94 1o8t h THR 64 N 0.00 0.13 -0.60 -2.88 2.02 -1.19 0.59 112.91 110.97 1o8t h THR 64 Ca 0.00 -0.53 -0.05 0.00 0.77 0.00 0.00 66.41 66.59 1o8t h THR 64 Cb 0.26 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.83 1o8t h THR 64 CO 0.00 0.03 0.16 1.23 0.37 0.00 0.00 175.52 177.30 1o8t h GLY 65 N -1.13 1.00 0.83 2.16 0.00 -1.70 -1.43 103.07 102.80 1o8t h GLY 65 Ca -0.07 -0.59 -0.04 0.00 0.00 0.00 0.00 47.33 46.64 1o8t h GLY 65 CO 0.11 0.55 -0.37 -2.22 0.00 0.00 0.00 176.54 174.61 1o8t h ILE 66 N 0.90 0.09 -0.11 2.60 1.08 -1.08 0.84 117.51 121.83 1o8t h ILE 66 Ca 0.20 -0.21 0.04 0.00 -0.39 0.00 0.00 64.86 64.50 1o8t h ILE 66 Cb 0.31 0.12 -0.06 0.00 -3.07 0.00 0.00 36.82 34.11 1o8t h ILE 66 CO -0.00 0.01 -0.41 0.15 -0.69 0.00 0.00 178.15 177.21 1o8t h PHE 67 N -1.21 -1.15 0.00 1.37 3.57 0.25 0.27 116.94 120.04 1o8t h PHE 67 Ca -0.10 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1o8t h PHE 67 Cb 0.80 0.52 0.00 0.00 2.79 0.00 0.00 35.95 40.06 1o8t h PHE 67 CO -0.00 -0.47 0.00 0.00 -2.23 0.00 0.00 178.31 175.61 1o8t h THR 68 N -0.49 0.00 0.37 4.41 1.03 -1.32 -3.05 112.91 113.86 1o8t h THR 68 Ca 0.07 -0.23 -0.01 0.00 -0.01 0.00 0.00 66.41 66.24 1o8t h THR 68 Cb 0.62 1.19 -0.02 0.00 -1.07 0.00 0.00 68.15 68.88 1o8t h THR 68 CO -0.38 0.00 -0.31 -0.78 -0.01 0.00 0.00 175.52 174.04 1o8t h ASP 69 N 0.00 -0.81 0.72 0.00 1.82 0.14 0.18 116.42 118.47 1o8t h ASP 69 Ca 0.00 0.06 -0.05 0.00 -0.39 0.00 0.00 57.03 56.65 1o8t h ASP 69 Cb 0.23 0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.50 1o8t h ASP 69 CO 0.00 -0.45 -0.26 1.56 -1.61 0.00 0.00 179.24 178.48 1o8t h GLN 70 N -0.69 0.00 0.30 0.28 7.50 -1.48 -1.89 115.11 119.12 1o8t h GLN 70 Ca -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.11 1o8t h GLN 70 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.14 1o8t h GLN 70 CO -0.02 0.26 -0.14 0.28 -1.50 0.00 0.00 178.83 177.70 1o8t h VAL 71 N 0.00 0.69 -0.72 -0.54 2.07 -1.35 -2.51 116.25 113.89 1o8t h VAL 71 Ca -0.00 -0.67 0.08 0.00 0.82 0.00 0.00 66.70 66.92 1o8t h VAL 71 Cb 0.69 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1o8t h VAL 71 CO 0.03 0.13 0.48 -0.07 0.02 0.00 0.00 177.57 178.16 1o8t h LEU 72 N -0.79 0.62 -1.31 2.57 4.07 -0.62 -0.10 115.31 119.74 1o8t h LEU 72 Ca -0.04 0.01 0.06 0.00 0.08 0.00 0.00 57.88 57.98 1o8t h LEU 72 Cb 0.51 -0.12 -0.05 0.00 1.08 0.00 0.00 40.66 42.08 1o8t h LEU 72 CO 0.07 0.39 0.50 0.77 -1.08 0.00 0.00 178.44 179.09 1o8t h SER 73 N 0.70 0.74 1.12 -0.43 4.64 -1.17 0.13 113.55 119.28 1o8t h SER 73 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1o8t h SER 73 Cb 0.35 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1o8t h SER 73 CO -0.11 0.49 0.00 0.58 -0.87 0.00 0.00 176.83 176.92 1o8t h VAL 74 N 0.85 0.00 -0.43 0.95 2.07 -0.56 -2.87 116.25 116.26 1o8t h VAL 74 Ca 0.32 -0.55 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 1o8t h VAL 74 Cb 0.19 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1o8t h VAL 74 CO -0.11 0.00 0.02 0.25 0.02 0.00 0.00 177.57 177.75 1o8t h LEU 75 N 0.00 0.65 -0.21 2.57 6.46 -0.54 -2.69 115.31 121.55 1o8t h LEU 75 Ca 0.00 -0.14 -0.12 0.00 -0.12 0.00 0.00 57.88 57.50 1o8t h LEU 75 Cb 0.56 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.32 1o8t h LEU 75 CO 0.00 0.71 -0.36 0.50 -0.62 0.00 0.00 178.44 178.67 1o8t h LYS 76 N 0.65 0.61 -1.80 1.25 3.64 -1.49 -1.25 116.57 118.18 1o8t h LYS 76 Ca 0.13 -0.38 -0.73 0.00 -1.27 0.00 0.00 60.65 58.41 1o8t h LYS 76 Cb 0.38 0.04 -0.27 0.00 -0.41 0.00 0.00 32.23 31.98 1o8t h LYS 76 CO 0.01 0.99 0.98 0.41 -2.27 0.00 0.00 179.45 179.57 1o8t n GLY 77 N 0.36 5.49 0.79 5.01 0.00 -1.10 -4.57 105.19 111.18 1o8t n GLY 77 Ca -0.06 -2.38 0.00 0.00 0.00 0.00 0.00 46.02 43.58 1o8t n GLY 77 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1o8t n GLU 78 N -0.51 0.00 0.00 1.61 0.00 -1.03 -4.96 120.64 115.75 1o8t n GLU 78 Ca 0.55 0.00 0.16 0.00 0.00 0.00 0.00 57.16 57.87 1o8t n GLU 78 Cb 0.34 0.00 0.93 0.00 0.00 0.00 0.00 31.44 32.71 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22