#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o8t s GLN 2 N 0.00 4.19 0.21 -2.82 2.00 -1.26 -5.10 119.66 116.88 1o8t s GLN 2 Ca 0.00 -0.12 0.08 0.00 -2.00 0.00 0.00 55.36 53.32 1o8t s GLN 2 Cb 0.00 -3.45 -0.04 0.00 0.80 0.00 0.00 33.01 30.32 1o8t s GLN 2 CO 0.00 0.22 0.01 -0.65 -0.50 0.00 0.00 175.29 174.37 1o8t s GLN 3 N 0.56 2.40 -1.18 1.67 1.11 -1.26 -5.04 119.66 117.93 1o8t s GLN 3 Ca 0.11 -1.20 -0.19 0.00 0.01 0.00 0.00 55.36 54.09 1o8t s GLN 3 Cb -0.12 -2.31 -0.03 0.00 -1.01 0.00 0.00 33.01 29.54 1o8t s GLN 3 CO 0.01 0.42 1.99 -0.35 0.01 0.00 0.00 175.29 177.38 1o8t n PRO 4 N -0.44 2.33 -2.28 2.91 -0.04 -1.26 -4.94 135.00 131.28 1o8t n PRO 4 Ca -0.09 -2.50 -0.43 0.00 -0.04 0.00 0.00 63.50 60.45 1o8t n PRO 4 Cb 0.57 -3.29 -0.02 0.00 -0.04 0.00 0.00 33.50 30.71 1o8t n PRO 4 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1o8t s GLN 5 N 4.45 4.08 1.11 0.54 2.00 -1.26 -5.01 119.66 125.57 1o8t s GLN 5 Ca 0.55 1.69 -0.15 0.00 -2.00 0.00 0.00 55.36 55.45 1o8t s GLN 5 Cb 0.10 -3.88 0.24 0.00 0.80 0.00 0.00 33.01 30.27 1o8t s GLN 5 CO 0.04 -0.93 1.08 -0.65 -0.50 0.00 0.00 175.29 174.33 1o8t s GLN 6 N 3.96 -0.43 -0.64 1.67 -1.52 -1.26 -4.89 119.66 116.55 1o8t s GLN 6 Ca 0.62 0.40 -0.26 0.00 -1.95 0.00 0.00 55.36 54.16 1o8t s GLN 6 Cb -0.24 -1.65 -0.01 0.00 -0.22 0.00 0.00 33.01 30.89 1o8t s GLN 6 CO 0.22 -3.29 1.78 0.34 -0.25 0.00 0.00 175.29 174.10 1o8t s ASP 7 N -3.37 5.39 -0.01 5.90 2.15 -1.26 -4.87 116.67 120.60 1o8t s ASP 7 Ca 0.67 0.19 -0.07 0.00 0.43 0.00 0.00 52.55 53.78 1o8t s ASP 7 Cb -0.18 -2.53 -0.04 0.00 -0.30 0.00 0.00 42.92 39.87 1o8t s ASP 7 CO 0.59 -2.31 0.59 -0.33 -0.17 0.00 0.00 175.17 173.53 1o8t h GLU 8 N 14.18 -0.24 -6.24 4.34 3.07 -1.98 -3.43 114.58 124.29 1o8t h GLU 8 Ca -0.25 0.02 -0.55 0.00 -0.50 0.00 0.00 59.36 58.07 1o8t h GLU 8 Cb 1.14 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 29.09 1o8t h GLU 8 CO 1.23 -0.16 1.06 1.41 -1.40 0.00 0.00 179.01 181.14 1o8t s MET 9 N -2.63 4.13 0.18 2.33 1.75 -1.26 -4.92 119.30 118.89 1o8t s MET 9 Ca -0.04 2.00 -0.14 0.00 -1.25 0.00 0.00 55.69 56.26 1o8t s MET 9 Cb 0.00 -3.95 0.18 0.00 2.84 0.00 0.00 34.83 33.90 1o8t s MET 9 CO 0.11 -0.89 1.69 -1.35 -0.65 0.00 0.00 175.02 173.92 1o8t h PRO 10 N 9.47 0.12 -7.08 4.11 0.11 -2.03 -3.42 132.00 133.27 1o8t h PRO 10 Ca -0.36 -0.01 -0.48 0.00 0.11 0.00 0.00 66.00 65.26 1o8t h PRO 10 Cb 1.16 -0.03 0.04 0.00 0.11 0.00 0.00 31.00 32.29 1o8t h PRO 10 CO 0.96 0.08 0.40 -1.54 -0.21 0.00 0.00 178.00 177.69 1o8t s SER 11 N -5.26 6.09 1.11 -2.05 1.04 -1.26 -5.05 113.70 108.33 1o8t s SER 11 Ca -0.13 2.02 -0.17 0.00 0.48 0.00 0.00 55.95 58.14 1o8t s SER 11 Cb 0.16 -2.57 0.25 0.00 0.10 0.00 0.00 66.02 63.96 1o8t s SER 11 CO 0.72 -0.96 1.13 -2.16 0.98 0.00 0.00 173.24 172.95 1o8t s PRO 12 N -3.29 -0.52 -0.98 4.02 0.04 -1.26 -4.89 135.00 128.12 1o8t s PRO 12 Ca 0.69 0.06 -0.24 0.00 0.04 0.00 0.00 61.00 61.55 1o8t s PRO 12 Cb -0.19 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 32.65 1o8t s PRO 12 CO 0.23 -3.27 1.85 -0.08 0.04 0.00 0.00 177.00 175.77 1o8t s THR 13 N -3.09 3.57 0.16 1.26 -1.32 -1.26 -4.37 115.64 110.58 1o8t s THR 13 Ca 0.69 -0.58 0.00 0.00 -1.21 0.00 0.00 61.69 60.60 1o8t s THR 13 Cb -0.12 -4.31 0.00 0.00 -1.51 0.00 0.00 72.50 66.56 1o8t s THR 13 CO 0.56 -1.16 0.00 0.49 -2.21 0.00 0.00 174.62 172.30 1o8t n PHE 14 N 12.96 -1.29 -0.21 9.09 3.01 -1.26 -4.74 117.46 135.01 1o8t n PHE 14 Ca 0.40 0.23 -0.07 0.00 1.01 0.00 0.00 57.45 59.02 1o8t n PHE 14 Cb 0.48 0.41 0.03 0.00 -0.01 0.00 0.00 39.48 40.39 1o8t n PHE 14 CO 0.00 0.00 0.00 1.37 1.01 0.00 0.00 176.76 179.14 1o8t h LEU 15 N 0.00 0.80 -0.85 4.37 8.10 -1.98 -2.39 115.31 123.36 1o8t h LEU 15 Ca 0.00 -0.14 0.05 0.00 0.11 0.00 0.00 57.88 57.90 1o8t h LEU 15 Cb 0.09 -0.20 -0.06 0.00 -0.44 0.00 0.00 40.66 40.05 1o8t h LEU 15 CO 0.00 0.71 0.53 0.71 -4.11 0.00 0.00 178.44 176.29 1o8t h THR 16 N 0.82 1.08 -0.15 0.15 1.35 -1.89 -2.69 112.91 111.59 1o8t h THR 16 Ca 0.21 -0.34 -0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1o8t h THR 16 Cb 0.14 -0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 66.54 1o8t h THR 16 CO -0.02 0.18 0.08 1.56 -0.25 0.00 0.00 175.52 177.07 1o8t h GLN 17 N 1.00 0.21 -0.50 4.72 1.08 -1.77 -3.19 115.11 116.67 1o8t h GLN 17 Ca 0.35 -0.03 0.15 0.00 -1.45 0.00 0.00 58.65 57.67 1o8t h GLN 17 Cb 0.09 -0.04 -0.09 0.00 -0.05 0.00 0.00 27.48 27.39 1o8t h GLN 17 CO -0.15 0.25 0.04 0.28 -0.95 0.00 0.00 178.83 178.30 1o8t n VAL 18 N -4.91 -0.21 -0.14 -0.54 0.31 -0.93 0.41 118.33 112.32 1o8t n VAL 18 Ca -0.05 1.09 -0.04 0.00 -0.01 0.00 0.00 64.34 65.34 1o8t n VAL 18 Cb 0.09 -1.61 0.03 0.00 -0.91 0.00 0.00 33.84 31.43 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 0.03 -0.17 5.55 1.79 -1.68 -0.05 116.57 122.04 1o8t h LYS 19 Ca 0.32 -0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.74 1o8t h LYS 19 Cb 0.68 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.31 1o8t h LYS 19 CO -0.46 0.02 -0.11 0.93 -1.08 0.00 0.00 179.45 178.75 1o8t h GLU 20 N 0.03 0.26 -0.60 3.15 3.07 -0.25 -2.38 114.58 117.85 1o8t h GLU 20 Ca 0.22 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 58.98 1o8t h GLU 20 Cb 0.33 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 1o8t h GLU 20 CO -0.43 0.38 0.23 0.66 -1.40 0.00 0.00 179.01 178.45 1o8t h SER 21 N 0.25 0.80 -0.27 1.42 4.64 -0.87 -2.23 113.55 117.29 1o8t h SER 21 Ca 0.05 -0.11 -0.15 0.00 -0.47 0.00 0.00 61.79 61.11 1o8t h SER 21 Cb 0.36 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1o8t h SER 21 CO 0.02 0.73 -0.44 -0.07 -0.87 0.00 0.00 176.83 176.20 1o8t h LEU 22 N 0.86 0.85 0.09 5.97 3.38 -0.84 -2.60 115.31 123.03 1o8t h LEU 22 Ca 0.20 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1o8t h LEU 22 Cb 0.19 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1o8t h LEU 22 CO -0.02 1.21 -0.08 -1.28 0.09 0.00 0.00 178.44 178.36 1o8t h SER 23 N 0.53 -0.21 0.38 -0.43 0.87 -1.24 -1.09 113.55 112.36 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 1.03 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1o8t h SER 23 CO 0.10 -0.13 0.00 0.77 -0.53 0.00 0.00 176.83 177.04 1o8t h SER 24 N -0.19 0.00 0.13 6.23 4.64 -1.46 -2.48 113.55 120.43 1o8t h SER 24 Ca 0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 1o8t h SER 24 Cb 0.18 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.29 1o8t h SER 24 CO -0.01 0.00 -0.94 0.22 -0.87 0.00 0.00 176.83 175.23 1o8t h TYR 25 N 0.00 0.68 -0.47 4.77 5.03 -0.85 -3.31 116.97 122.83 1o8t h TYR 25 Ca 0.00 -0.47 -0.05 0.00 2.58 0.00 0.00 58.73 60.79 1o8t h TYR 25 Cb 0.19 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.41 1o8t h TYR 25 CO 0.00 1.34 0.08 2.35 -1.32 0.00 0.00 178.16 180.61 1o8t h TRP 26 N -0.17 0.74 -0.84 -3.82 -0.00 -0.80 -0.57 115.95 110.50 1o8t h TRP 26 Ca -0.16 -0.07 0.08 0.00 -0.00 0.00 0.00 58.89 58.74 1o8t h TRP 26 Cb 1.71 -0.22 -0.11 0.00 -0.00 0.00 0.00 29.16 30.55 1o8t h TRP 26 CO 0.17 0.66 -0.54 0.93 -0.00 0.00 0.00 178.44 179.65 1o8t h GLU 27 N 0.69 -0.06 -0.02 2.65 5.08 -1.57 0.73 114.58 122.08 1o8t h GLU 27 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1o8t h GLU 27 Cb 0.31 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1o8t h GLU 27 CO 0.00 -0.04 -0.11 0.45 -1.00 0.00 0.00 179.01 178.32 1o8t n SER 28 N -5.10 1.75 -0.06 1.42 2.88 -1.20 -4.23 113.62 109.08 1o8t n SER 28 Ca 0.01 -1.46 0.02 0.00 -1.33 0.00 0.00 58.87 56.11 1o8t n SER 28 Cb 0.25 0.08 0.35 0.00 -0.75 0.00 0.00 64.21 64.15 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 4.22 1.58 -0.23 -1.46 0.00 0.83 -2.87 119.26 121.34 1o8t h ALA 29 Ca 0.00 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1o8t h ALA 29 Cb 0.63 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1o8t h ALA 29 CO 0.00 0.36 -0.15 0.87 0.00 0.00 0.00 179.25 180.33 1o8t h LYS 30 N 0.68 -0.13 -1.02 0.00 1.57 -1.72 -0.11 116.57 115.84 1o8t h LYS 30 Ca 0.18 0.01 0.26 0.00 -1.87 0.00 0.00 60.65 59.22 1o8t h LYS 30 Cb -0.01 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.21 1o8t h LYS 30 CO -0.03 -0.09 0.62 1.15 -0.57 0.00 0.00 179.45 180.53 1o8t h THR 31 N -0.14 0.52 -0.46 -0.16 2.02 -1.81 0.40 112.91 113.28 1o8t h THR 31 Ca 0.13 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1o8t h THR 31 Cb 0.33 -0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.68 1o8t h THR 31 CO -0.32 0.09 0.22 0.00 0.37 0.00 0.00 175.52 175.89 1o8t h ALA 32 N 1.70 0.60 -0.32 6.16 0.00 -1.08 -0.73 119.26 125.59 1o8t h ALA 32 Ca 0.64 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.50 1o8t h ALA 32 Cb 1.33 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1o8t h ALA 32 CO -0.43 0.17 -0.33 0.00 0.00 0.00 0.00 179.25 178.65 1o8t h ALA 33 N 1.06 -0.26 -0.54 0.00 0.00 0.47 0.45 119.26 120.44 1o8t h ALA 33 Ca 0.16 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1o8t h ALA 33 Cb 0.13 0.69 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1o8t h ALA 33 CO -0.02 -0.76 0.08 1.96 0.00 0.00 0.00 179.25 180.51 1o8t h GLN 34 N -0.30 0.85 0.00 0.00 7.50 -1.38 -1.99 115.11 119.79 1o8t h GLN 34 Ca 0.15 -0.20 -0.02 0.00 0.50 0.00 0.00 58.65 59.08 1o8t h GLN 34 Cb 0.54 -0.11 -0.00 0.00 0.05 0.00 0.00 27.48 27.96 1o8t h GLN 34 CO -0.49 0.80 -0.09 -0.97 -1.50 0.00 0.00 178.83 176.59 1o8t h ASN 35 N 0.81 0.00 -0.40 1.46 -0.73 0.54 -1.52 115.58 115.73 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 0.37 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.91 1o8t h ASN 35 CO 0.01 0.09 0.13 0.25 -0.37 0.00 0.00 177.43 177.53 1o8t h LEU 36 N 0.00 0.12 -0.86 0.34 6.46 0.60 0.18 115.31 122.15 1o8t h LEU 36 Ca -0.00 0.05 -0.05 0.00 -0.12 0.00 0.00 57.88 57.76 1o8t h LEU 36 Cb 0.16 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.10 1o8t h LEU 36 CO 0.01 0.10 0.29 0.22 -0.62 0.00 0.00 178.44 178.45 1o8t h TYR 37 N 0.28 1.15 -0.06 1.25 5.03 -1.33 -3.03 116.97 120.26 1o8t h TYR 37 Ca 0.19 -0.09 0.02 0.00 2.58 0.00 0.00 58.73 61.43 1o8t h TYR 37 Cb 0.19 -0.34 -0.02 0.00 1.55 0.00 0.00 36.73 38.10 1o8t h TYR 37 CO -0.16 0.87 -0.06 0.93 -1.32 0.00 0.00 178.16 178.42 1o8t h GLU 38 N 1.10 -0.08 0.00 1.82 4.39 -0.19 -1.93 114.58 119.68 1o8t h GLU 38 Ca 0.25 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1o8t h GLU 38 Cb 0.22 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1o8t h GLU 38 CO -0.02 -0.05 0.00 0.36 -1.16 0.00 0.00 179.01 178.14 1o8t n LYS 39 N -5.19 0.10 0.09 2.33 2.85 0.42 -1.68 118.16 117.08 1o8t n LYS 39 Ca -0.05 0.56 -0.18 0.00 -1.05 0.00 0.00 58.31 57.59 1o8t n LYS 39 Cb 0.12 -1.80 -0.11 0.00 -0.65 0.00 0.00 35.03 32.59 1o8t n LYS 39 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1o8t h THR 40 N 0.00 1.38 0.37 0.58 1.35 -1.32 -3.35 112.91 111.92 1o8t h THR 40 Ca 0.00 -2.64 -0.02 0.00 -0.55 0.00 0.00 66.41 63.20 1o8t h THR 40 Cb 0.05 2.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1o8t h THR 40 CO 0.00 0.79 -0.18 1.88 -0.25 0.00 0.00 175.52 177.76 1o8t h TYR 41 N 0.20 -0.46 -3.79 4.73 0.05 -1.34 -3.45 116.97 112.91 1o8t h TYR 41 Ca -0.15 -0.01 -0.49 0.00 0.05 0.00 0.00 58.73 58.13 1o8t h TYR 41 Cb 1.85 0.15 -0.00 0.00 1.01 0.00 0.00 36.73 39.74 1o8t h TYR 41 CO 0.09 -0.14 0.16 -0.51 -1.05 0.00 0.00 178.16 176.70 1o8t s LEU 42 N -9.59 3.87 -0.38 3.88 1.02 -1.19 -4.99 118.68 111.29 1o8t s LEU 42 Ca -0.14 1.26 -0.01 0.00 0.02 0.00 0.00 54.13 55.25 1o8t s LEU 42 Cb 0.02 -4.12 0.24 0.00 0.02 0.00 0.00 46.19 42.36 1o8t s LEU 42 CO 0.54 -0.37 2.06 -0.81 0.02 0.00 0.00 176.35 177.79 1o8t n PRO 43 N -1.06 1.98 0.20 1.29 -0.04 -1.26 -4.56 135.00 131.55 1o8t n PRO 43 Ca 0.03 -1.89 0.15 0.00 -0.04 0.00 0.00 63.50 61.75 1o8t n PRO 43 Cb 0.54 -1.75 0.68 0.00 -0.04 0.00 0.00 33.50 32.92 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 1.65 1.00 -0.39 0.55 0.00 -1.94 -3.24 119.26 116.88 1o8t h ALA 44 Ca 0.35 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.34 1o8t h ALA 44 Cb 0.88 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.58 1o8t h ALA 44 CO 0.91 0.00 -0.30 0.28 0.00 0.00 0.00 179.25 180.14 1o8t h VAL 45 N 0.00 0.27 -0.14 0.00 2.07 -1.87 0.42 116.25 117.00 1o8t h VAL 45 Ca 0.00 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.37 1o8t h VAL 45 Cb 0.24 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1o8t h VAL 45 CO 0.00 0.00 -0.54 -2.24 0.02 0.00 0.00 177.57 174.81 1o8t h ASP 46 N -0.23 0.45 0.53 0.57 3.04 -1.97 -2.99 116.42 115.81 1o8t h ASP 46 Ca 0.18 -0.24 -0.03 0.00 -3.24 0.00 0.00 57.03 53.71 1o8t h ASP 46 Cb 0.52 -0.13 0.01 0.00 -1.04 0.00 0.00 39.33 38.69 1o8t h ASP 46 CO -0.52 0.90 -0.25 -0.08 -2.04 0.00 0.00 179.24 177.25 1o8t h GLU 47 N 0.31 -0.68 -0.30 4.15 4.22 -1.45 -3.09 114.58 117.74 1o8t h GLU 47 Ca 0.01 0.05 0.09 0.00 0.08 0.00 0.00 59.36 59.58 1o8t h GLU 47 Cb 1.05 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1o8t h GLU 47 CO 0.09 -0.39 0.38 0.87 -2.18 0.00 0.00 179.01 177.78 1o8t h LYS 48 N -1.09 0.00 0.45 1.92 1.79 -0.30 0.34 116.57 119.68 1o8t h LYS 48 Ca -0.07 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1o8t h LYS 48 Cb 0.61 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1o8t h LYS 48 CO 0.12 0.00 -0.22 -0.07 -1.08 0.00 0.00 179.45 178.20 1o8t h LEU 49 N 0.00 -0.52 -1.30 2.94 3.38 -1.44 0.76 115.31 119.13 1o8t h LEU 49 Ca 0.14 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1o8t h LEU 49 Cb 0.89 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1o8t h LEU 49 CO -0.00 -0.33 0.06 0.03 0.09 0.00 0.00 178.44 178.30 1o8t h ARG 50 N -0.70 0.53 0.58 1.13 2.47 -1.40 -0.49 114.38 116.50 1o8t h ARG 50 Ca -0.06 -0.09 -0.02 0.00 -1.26 0.00 0.00 59.98 58.54 1o8t h ARG 50 Cb 0.47 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.69 1o8t h ARG 50 CO 0.10 0.51 -0.47 0.22 0.56 0.00 0.00 179.97 180.89 1o8t h ASP 51 N 0.52 -1.26 0.90 7.04 1.82 -0.28 -2.30 116.42 122.87 1o8t h ASP 51 Ca 0.12 0.09 0.00 0.00 -0.39 0.00 0.00 57.03 56.85 1o8t h ASP 51 Cb 0.24 0.40 0.00 0.00 0.68 0.00 0.00 39.33 40.65 1o8t h ASP 51 CO 0.00 -0.66 0.00 -0.07 -1.61 0.00 0.00 179.24 176.90 1o8t h LEU 52 N -1.02 0.00 -0.11 2.28 4.07 -0.77 -3.17 115.31 116.59 1o8t h LEU 52 Ca -0.08 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 1o8t h LEU 52 Cb 0.86 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.60 1o8t h LEU 52 CO 0.00 0.00 -0.03 0.22 -1.08 0.00 0.00 178.44 177.56 1o8t h TYR 53 N 0.00 0.24 0.07 1.13 5.03 -0.55 0.40 116.97 123.29 1o8t h TYR 53 Ca 0.00 -0.05 -0.00 0.00 2.58 0.00 0.00 58.73 61.25 1o8t h TYR 53 Cb 0.45 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.67 1o8t h TYR 53 CO 0.00 0.52 -0.03 0.77 -1.32 0.00 0.00 178.16 178.09 1o8t h SER 54 N -0.10 -0.08 -0.44 -2.11 0.02 -1.42 0.55 113.55 109.96 1o8t h SER 54 Ca 0.03 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1o8t h SER 54 Cb 0.44 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1o8t h SER 54 CO 0.01 -0.01 0.23 0.11 -1.14 0.00 0.00 176.83 176.03 1o8t h LYS 55 N -0.15 0.62 -0.16 3.45 6.56 -1.61 -2.32 116.57 122.97 1o8t h LYS 55 Ca -0.01 -0.08 -0.01 0.00 -1.06 0.00 0.00 60.65 59.49 1o8t h LYS 55 Cb 0.12 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.66 1o8t h LYS 55 CO 0.02 0.50 0.07 1.03 -2.06 0.00 0.00 179.45 179.01 1o8t h SER 56 N 0.57 0.21 -0.93 0.86 0.87 -0.79 -2.74 113.55 111.60 1o8t h SER 56 Ca 0.15 -0.14 0.05 0.00 -1.23 0.00 0.00 61.79 60.62 1o8t h SER 56 Cb 0.07 -0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 61.92 1o8t h SER 56 CO -0.02 0.29 0.60 0.74 -0.53 0.00 0.00 176.83 177.91 1o8t h THR 57 N 0.11 1.12 0.83 2.23 2.02 -0.81 0.26 112.91 118.67 1o8t h THR 57 Ca 0.05 -0.39 -0.04 0.00 0.77 0.00 0.00 66.41 66.81 1o8t h THR 57 Cb 0.15 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.45 1o8t h THR 57 CO -0.01 0.21 -0.48 0.00 0.37 0.00 0.00 175.52 175.61 1o8t h ALA 58 N 1.40 -1.29 -0.07 6.16 0.00 -1.28 -2.76 119.26 121.41 1o8t h ALA 58 Ca 0.38 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1o8t h ALA 58 Cb 0.06 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1o8t h ALA 58 CO -0.14 -1.24 -0.09 0.00 0.00 0.00 0.00 179.25 177.79 1o8t h ALA 59 N -1.25 1.72 0.00 0.00 0.00 -1.36 -2.28 119.26 116.09 1o8t h ALA 59 Ca -0.11 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1o8t h ALA 59 Cb 0.96 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1o8t h ALA 59 CO 0.13 0.21 -0.01 0.52 0.00 0.00 0.00 179.25 180.11 1o8t h MET 60 N 0.11 0.00 0.00 0.00 2.86 -0.21 -1.63 114.93 116.05 1o8t h MET 60 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1o8t h MET 60 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1o8t h MET 60 CO 0.01 0.01 0.00 1.03 1.06 0.00 0.00 176.91 179.02 1o8t h SER 61 N 0.00 0.00 0.00 1.22 0.87 -1.16 -0.68 113.55 113.80 1o8t h SER 61 Ca -0.00 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.28 1o8t h SER 61 Cb 0.10 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 1o8t h SER 61 CO 0.00 0.00 -1.95 0.41 -0.53 0.00 0.00 176.83 174.76 1o8t n THR 62 N -3.06 0.94 0.30 2.23 -1.04 -0.69 -4.54 114.28 108.42 1o8t n THR 62 Ca -0.01 -0.27 0.16 0.00 -2.04 0.00 0.00 64.05 61.90 1o8t n THR 62 Cb 0.23 -1.57 0.75 0.00 -1.82 0.00 0.00 70.33 67.92 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 -0.47 0.00 0.39 -1.42 0.05 -1.41 -0.87 116.97 113.24 1o8t h TYR 63 Ca -0.42 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.34 1o8t h TYR 63 Cb 1.42 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.17 1o8t h TYR 63 CO -0.04 0.00 -0.19 1.15 -1.05 0.00 0.00 178.16 178.04 1o8t h THR 64 N 0.00 0.39 -0.41 -2.88 2.02 -1.35 0.59 112.91 111.26 1o8t h THR 64 Ca 0.00 -0.65 -0.08 0.00 0.77 0.00 0.00 66.41 66.45 1o8t h THR 64 Cb 0.23 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1o8t h THR 64 CO 0.00 0.08 -0.09 1.23 0.37 0.00 0.00 175.52 177.11 1o8t h GLY 65 N -0.99 0.77 0.83 2.16 0.00 -1.77 -2.11 103.07 101.96 1o8t h GLY 65 Ca -0.05 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 46.68 1o8t h GLY 65 CO 0.09 0.51 -0.34 -2.22 0.00 0.00 0.00 176.54 174.58 1o8t h ILE 66 N 0.65 0.16 -0.16 2.60 1.08 -1.17 0.90 117.51 121.58 1o8t h ILE 66 Ca 0.12 -0.22 0.05 0.00 -0.39 0.00 0.00 64.86 64.42 1o8t h ILE 66 Cb 0.54 0.20 -0.07 0.00 -3.07 0.00 0.00 36.82 34.42 1o8t h ILE 66 CO 0.03 0.02 -0.37 -0.26 -0.69 0.00 0.00 178.15 176.88 1o8t h PHE 67 N -1.15 -1.04 0.00 1.37 0.04 0.21 0.37 116.94 116.74 1o8t h PHE 67 Ca -0.10 0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.71 1o8t h PHE 67 Cb 0.76 0.48 -0.00 0.00 2.20 0.00 0.00 35.95 39.39 1o8t h PHE 67 CO -0.00 -0.43 -0.02 1.79 -0.60 0.00 0.00 178.31 179.05 1o8t h THR 68 N -0.43 0.08 0.50 -1.55 1.35 -1.43 -3.01 112.91 108.42 1o8t h THR 68 Ca 0.09 -0.27 -0.01 0.00 -0.55 0.00 0.00 66.41 65.67 1o8t h THR 68 Cb 0.59 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.24 1o8t h THR 68 CO -0.39 0.01 -0.38 -0.78 -0.25 0.00 0.00 175.52 173.73 1o8t h ASP 69 N 0.00 -0.98 0.74 5.36 1.82 0.14 0.16 116.42 123.66 1o8t h ASP 69 Ca -0.00 0.07 -0.05 0.00 -0.39 0.00 0.00 57.03 56.66 1o8t h ASP 69 Cb 0.25 0.31 -0.01 0.00 0.68 0.00 0.00 39.33 40.56 1o8t h ASP 69 CO 0.00 -0.56 -0.25 1.56 -1.61 0.00 0.00 179.24 178.39 1o8t h GLN 70 N -0.86 0.00 0.31 0.28 1.08 -1.47 -1.84 115.11 112.61 1o8t h GLN 70 Ca -0.05 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 1o8t h GLN 70 Cb 0.73 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.16 1o8t h GLN 70 CO 0.01 0.25 -0.15 0.28 -0.95 0.00 0.00 178.83 178.27 1o8t h VAL 71 N 0.00 0.65 -0.63 -0.54 2.07 -1.33 -2.35 116.25 114.12 1o8t h VAL 71 Ca -0.00 -0.65 0.08 0.00 0.82 0.00 0.00 66.70 66.95 1o8t h VAL 71 Cb 0.69 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1o8t h VAL 71 CO 0.03 0.12 0.42 0.25 0.02 0.00 0.00 177.57 178.41 1o8t h LEU 72 N -0.81 0.49 -0.94 2.57 5.85 -0.64 -0.87 115.31 120.95 1o8t h LEU 72 Ca -0.04 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.73 1o8t h LEU 72 Cb 0.52 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 1o8t h LEU 72 CO 0.07 0.31 0.60 -1.28 -0.34 0.00 0.00 178.44 177.80 1o8t h SER 73 N 0.55 0.98 0.97 1.25 0.87 -1.10 0.34 113.55 117.40 1o8t h SER 73 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1o8t h SER 73 Cb 0.38 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1o8t h SER 73 CO -0.09 0.64 0.00 -0.37 -0.53 0.00 0.00 176.83 176.49 1o8t h VAL 74 N 1.12 0.00 -0.62 2.23 -1.51 -0.62 -2.92 116.25 113.94 1o8t h VAL 74 Ca 0.39 -0.39 -0.07 0.00 -1.23 0.00 0.00 66.70 65.40 1o8t h VAL 74 Cb 0.10 1.26 -0.03 0.00 -2.13 0.00 0.00 31.29 30.49 1o8t h VAL 74 CO -0.15 0.00 0.12 0.25 -1.23 0.00 0.00 177.57 176.56 1o8t h LEU 75 N 0.00 0.94 -0.30 4.19 6.46 -0.72 0.13 115.31 126.01 1o8t h LEU 75 Ca 0.00 -0.20 -0.19 0.00 -0.12 0.00 0.00 57.88 57.38 1o8t h LEU 75 Cb 0.48 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 1o8t h LEU 75 CO 0.00 0.93 -0.54 0.11 -0.62 0.00 0.00 178.44 178.32 1o8t h LYS 76 N 0.94 0.89 0.06 1.25 6.56 -1.50 -2.57 116.57 122.21 1o8t h LYS 76 Ca 0.20 -0.56 -0.00 0.00 -1.06 0.00 0.00 60.65 59.22 1o8t h LYS 76 Cb 0.37 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 1o8t h LYS 76 CO 0.01 1.20 -0.03 0.78 -2.06 0.00 0.00 179.45 179.35 1o8t h GLY 77 N 0.69 -0.08 -5.00 3.86 0.00 -1.52 -3.43 103.07 97.58 1o8t h GLY 77 Ca 0.02 0.03 -0.21 0.00 0.00 0.00 0.00 47.33 47.17 1o8t h GLY 77 CO 0.12 -0.03 -0.82 -2.21 0.00 0.00 0.00 176.54 173.60 1o8t n GLU 78 N -2.33 1.43 -0.93 4.80 0.00 -0.51 -5.13 120.64 117.98 1o8t n GLU 78 Ca -0.01 -2.60 0.00 0.00 0.00 0.00 0.00 57.16 54.55 1o8t n GLU 78 Cb 0.03 -0.79 0.00 0.00 0.00 0.00 0.00 31.44 30.68 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22