#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 -5.09 0.10 1.09 1.13 -1.26 -4.74 117.38 108.62 1o8t n GLN 2 Ca 0.00 0.67 0.00 0.00 -1.94 0.00 0.00 57.00 55.73 1o8t n GLN 2 Cb 0.00 -5.32 0.00 0.00 0.11 0.00 0.00 30.24 25.03 1o8t n GLN 2 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1o8t n GLN 3 N -4.20 0.00 -2.34 -1.09 0.00 -1.26 -5.06 117.38 103.43 1o8t n GLN 3 Ca -0.29 0.00 -0.36 0.00 -0.00 0.00 0.00 57.00 56.36 1o8t n GLN 3 Cb 0.67 0.00 -0.03 0.00 0.00 0.00 0.00 30.24 30.88 1o8t n GLN 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1o8t s PRO 4 N -1.89 3.27 -0.21 3.69 0.04 -1.26 -4.95 135.00 133.69 1o8t s PRO 4 Ca 0.00 -1.42 -0.29 0.00 0.04 0.00 0.00 61.00 59.33 1o8t s PRO 4 Cb 0.00 -5.36 -0.02 0.00 0.04 0.00 0.00 34.50 29.16 1o8t s PRO 4 CO 0.00 -2.97 1.44 -1.14 0.04 0.00 0.00 177.00 174.38 1o8t s GLN 5 N 5.40 3.97 1.08 4.56 -0.44 -1.26 -5.01 119.66 127.96 1o8t s GLN 5 Ca 0.60 1.59 -0.14 0.00 -2.50 0.00 0.00 55.36 54.91 1o8t s GLN 5 Cb 0.01 -3.92 0.23 0.00 -1.64 0.00 0.00 33.01 27.69 1o8t s GLN 5 CO 0.06 -1.06 1.08 -0.65 0.50 0.00 0.00 175.29 175.22 1o8t s GLN 6 N 4.19 -0.21 -0.35 1.67 1.11 -1.26 -4.92 119.66 119.88 1o8t s GLN 6 Ca 0.63 0.48 -0.29 0.00 0.01 0.00 0.00 55.36 56.19 1o8t s GLN 6 Cb -0.23 -1.67 -0.01 0.00 -1.01 0.00 0.00 33.01 30.10 1o8t s GLN 6 CO 0.24 -3.16 1.61 0.34 0.01 0.00 0.00 175.29 174.33 1o8t s ASP 7 N -3.30 6.14 0.75 5.90 2.15 -1.26 -4.99 116.67 122.06 1o8t s ASP 7 Ca 0.67 1.13 -0.11 0.00 0.43 0.00 0.00 52.55 54.67 1o8t s ASP 7 Cb -0.19 -2.53 0.05 0.00 -0.30 0.00 0.00 42.92 39.95 1o8t s ASP 7 CO 0.59 -1.54 1.09 -1.61 -0.17 0.00 0.00 175.17 173.53 1o8t s GLU 8 N 5.23 2.37 -0.01 4.34 8.01 -1.26 -5.00 118.70 132.37 1o8t s GLU 8 Ca 0.71 1.17 -0.23 0.00 0.01 0.00 0.00 54.97 56.63 1o8t s GLU 8 Cb -0.19 -1.91 -0.14 0.00 -4.31 0.00 0.00 34.13 27.58 1o8t s GLU 8 CO 0.33 -1.56 1.01 0.52 0.01 0.00 0.00 175.26 175.57 1o8t h MET 9 N -0.98 -0.48 0.00 1.61 2.86 -2.06 -3.46 114.93 112.41 1o8t h MET 9 Ca -0.44 0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.20 1o8t h MET 9 Cb 1.23 0.11 0.01 0.00 0.06 0.00 0.00 31.60 33.01 1o8t h MET 9 CO 0.52 -0.16 0.03 -0.35 1.06 0.00 0.00 176.91 178.01 1o8t n PRO 10 N -5.14 -0.16 -2.32 -0.22 -0.04 -1.26 -4.99 135.00 120.87 1o8t n PRO 10 Ca -0.09 -0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 62.79 1o8t n PRO 10 Cb 0.27 -0.11 -0.03 0.00 -0.04 0.00 0.00 33.50 33.60 1o8t n PRO 10 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1o8t s SER 11 N -1.40 6.91 0.38 3.54 0.01 -1.26 -4.99 113.70 116.89 1o8t s SER 11 Ca 0.06 1.91 -0.27 0.00 1.31 0.00 0.00 55.95 58.96 1o8t s SER 11 Cb -0.00 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.59 1o8t s SER 11 CO 0.04 -0.73 1.29 -2.16 0.41 0.00 0.00 173.24 172.09 1o8t s PRO 12 N 2.99 4.08 -1.06 12.44 0.04 -1.26 -4.91 135.00 147.33 1o8t s PRO 12 Ca 0.60 2.14 -0.23 0.00 0.04 0.00 0.00 61.00 63.55 1o8t s PRO 12 Cb -0.27 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 1o8t s PRO 12 CO 0.21 -0.39 1.86 0.95 0.04 0.00 0.00 177.00 179.67 1o8t s THR 13 N -1.25 3.61 -0.11 1.26 -4.23 -1.26 -4.56 115.64 109.11 1o8t s THR 13 Ca 0.55 -0.77 0.02 0.00 -1.18 0.00 0.00 61.69 60.31 1o8t s THR 13 Cb -0.38 -4.46 -0.08 0.00 1.34 0.00 0.00 72.50 68.93 1o8t s THR 13 CO 0.49 -1.20 -0.08 2.22 -0.54 0.00 0.00 174.62 175.51 1o8t n PHE 14 N 12.91 0.00 -0.18 3.99 1.16 -1.26 -4.49 117.46 129.59 1o8t n PHE 14 Ca 0.42 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.92 1o8t n PHE 14 Cb 0.47 -0.42 0.01 0.00 -1.61 0.00 0.00 39.48 37.93 1o8t n PHE 14 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 1o8t h LEU 15 N 0.00 0.67 -1.22 5.98 7.12 -2.01 -2.63 115.31 123.23 1o8t h LEU 15 Ca -0.24 -0.14 0.06 0.00 0.13 0.00 0.00 57.88 57.69 1o8t h LEU 15 Cb 1.41 -0.17 -0.05 0.00 -0.53 0.00 0.00 40.66 41.31 1o8t h LEU 15 CO -0.03 0.62 0.55 0.00 -0.13 0.00 0.00 178.44 179.45 1o8t h THR 16 N 0.68 1.07 0.26 1.05 1.03 -1.94 -2.66 112.91 112.39 1o8t h THR 16 Ca 0.17 -0.33 -0.01 0.00 -0.01 0.00 0.00 66.41 66.24 1o8t h THR 16 Cb 0.13 0.03 0.00 0.00 -1.07 0.00 0.00 68.15 67.25 1o8t h THR 16 CO -0.02 0.17 -0.12 -0.61 -0.01 0.00 0.00 175.52 174.93 1o8t h GLN 17 N 0.95 -0.33 -0.51 0.00 5.75 -1.70 -3.20 115.11 116.07 1o8t h GLN 17 Ca 0.36 0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.97 1o8t h GLN 17 Cb 0.18 0.08 -0.09 0.00 1.07 0.00 0.00 27.48 28.72 1o8t h GLN 17 CO -0.13 -0.15 -0.16 0.28 -2.65 0.00 0.00 178.83 176.02 1o8t n VAL 18 N -5.20 -0.24 -0.03 2.39 0.31 -1.00 0.26 118.33 114.82 1o8t n VAL 18 Ca -0.10 1.18 -0.09 0.00 -0.01 0.00 0.00 64.34 65.33 1o8t n VAL 18 Cb 0.19 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 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 -0.27 0.00 5.55 6.56 -1.65 -0.47 116.57 126.30 1o8t h LYS 19 Ca 0.21 0.02 -0.04 0.00 -1.06 0.00 0.00 60.65 59.78 1o8t h LYS 19 Cb 0.34 0.06 -0.01 0.00 -0.57 0.00 0.00 32.23 32.06 1o8t h LYS 19 CO -0.52 -0.18 -0.18 0.93 -2.06 0.00 0.00 179.45 177.44 1o8t h GLU 20 N -0.28 0.00 -0.83 3.15 3.07 -0.34 -2.46 114.58 116.89 1o8t h GLU 20 Ca 0.13 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.95 1o8t h GLU 20 Cb 0.47 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.35 1o8t h GLU 20 CO -0.37 0.18 0.36 0.77 -1.40 0.00 0.00 179.01 178.55 1o8t h SER 21 N 0.00 1.11 -0.03 1.42 0.02 -0.15 -2.47 113.55 113.46 1o8t h SER 21 Ca -0.00 -0.16 -0.16 0.00 -0.84 0.00 0.00 61.79 60.63 1o8t h SER 21 Cb 0.36 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1o8t h SER 21 CO 0.02 0.96 -0.53 0.25 -1.14 0.00 0.00 176.83 176.40 1o8t h LEU 22 N 1.19 0.67 -0.57 5.07 7.12 -0.91 -3.13 115.31 124.75 1o8t h LEU 22 Ca 0.28 -0.35 0.02 0.00 0.13 0.00 0.00 57.88 57.96 1o8t h LEU 22 Cb 0.18 -0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 40.08 1o8t h LEU 22 CO -0.03 1.07 0.36 -1.28 -0.13 0.00 0.00 178.44 178.43 1o8t h SER 23 N 0.47 0.60 0.39 1.25 0.87 -1.23 -0.75 113.55 115.15 1o8t h SER 23 Ca 0.01 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1o8t h SER 23 Cb 1.07 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.90 1o8t h SER 23 CO 0.10 0.43 -0.02 0.28 -0.53 0.00 0.00 176.83 177.08 1o8t h SER 24 N 0.72 0.00 0.15 6.23 0.02 -1.43 -2.37 113.55 116.87 1o8t h SER 24 Ca 0.22 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.92 1o8t h SER 24 Cb -0.02 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.55 1o8t h SER 24 CO -0.08 0.02 -1.07 0.22 -1.14 0.00 0.00 176.83 174.79 1o8t h TYR 25 N 0.00 0.79 -0.53 3.45 3.20 -1.11 -3.31 116.97 119.47 1o8t h TYR 25 Ca -0.00 -0.54 -0.05 0.00 3.14 0.00 0.00 58.73 61.28 1o8t h TYR 25 Cb 0.22 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1o8t h TYR 25 CO 0.00 1.40 0.11 -1.49 -1.64 0.00 0.00 178.16 176.54 1o8t h TRP 26 N -0.04 0.84 -0.88 -3.82 4.06 -0.89 0.46 115.95 115.67 1o8t h TRP 26 Ca -0.17 -0.08 0.08 0.00 2.06 0.00 0.00 58.89 60.78 1o8t h TRP 26 Cb 1.80 -0.24 -0.11 0.00 -1.00 0.00 0.00 29.16 29.61 1o8t h TRP 26 CO 0.15 0.71 -0.57 0.93 -3.56 0.00 0.00 178.44 176.11 1o8t h GLU 27 N 0.78 -0.06 -0.66 0.49 3.07 -1.53 -0.02 114.58 116.65 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 0.00 0.43 -1.40 0.00 0.00 179.01 178.00 1o8t n SER 28 N -5.20 3.84 0.10 1.42 7.64 -1.20 -4.45 113.62 115.77 1o8t n SER 28 Ca 0.01 -2.00 0.05 0.00 1.01 0.00 0.00 58.87 57.94 1o8t n SER 28 Cb 0.26 -0.44 0.49 0.00 -1.01 0.00 0.00 64.21 63.52 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 4.26 1.77 -0.16 -0.43 0.00 0.11 -2.91 119.26 121.90 1o8t h ALA 29 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1o8t h ALA 29 Cb 0.98 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1o8t h ALA 29 CO 0.00 0.19 -0.20 0.87 0.00 0.00 0.00 179.25 180.11 1o8t h LYS 30 N 0.33 -0.23 -1.02 0.00 1.57 -1.78 -0.25 116.57 115.19 1o8t h LYS 30 Ca 0.09 0.02 0.26 0.00 -1.87 0.00 0.00 60.65 59.14 1o8t h LYS 30 Cb 0.02 0.05 -0.12 0.00 0.08 0.00 0.00 32.23 32.26 1o8t h LYS 30 CO -0.01 -0.16 0.62 1.15 -0.57 0.00 0.00 179.45 180.48 1o8t h THR 31 N -0.24 0.52 -0.41 -0.16 2.02 -1.86 0.40 112.91 113.18 1o8t h THR 31 Ca 0.11 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1o8t h THR 31 Cb 0.40 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 1o8t h THR 31 CO -0.30 0.10 0.19 0.00 0.37 0.00 0.00 175.52 175.88 1o8t h ALA 32 N 1.71 0.53 -0.39 6.16 0.00 -1.14 -0.76 119.26 125.36 1o8t h ALA 32 Ca 0.64 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.52 1o8t h ALA 32 Cb 1.33 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 18.87 1o8t h ALA 32 CO -0.43 0.09 -0.27 0.00 0.00 0.00 0.00 179.25 178.64 1o8t h ALA 33 N 1.04 -0.05 -0.66 0.00 0.00 0.62 0.47 119.26 120.68 1o8t h ALA 33 Ca 0.14 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 1o8t h ALA 33 Cb 0.12 0.60 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1o8t h ALA 33 CO -0.02 -0.65 0.15 1.96 0.00 0.00 0.00 179.25 180.69 1o8t h GLN 34 N -0.20 1.04 0.00 0.00 7.50 -1.34 -1.96 115.11 120.15 1o8t h GLN 34 Ca 0.18 -0.25 -0.01 0.00 0.50 0.00 0.00 58.65 59.08 1o8t h GLN 34 Cb 0.49 -0.14 -0.00 0.00 0.05 0.00 0.00 27.48 27.88 1o8t h GLN 34 CO -0.51 0.93 -0.07 -0.91 -1.50 0.00 0.00 178.83 176.77 1o8t h ASN 35 N 0.99 0.00 -0.46 1.46 2.35 0.55 -1.72 115.58 118.75 1o8t h ASN 35 Ca 0.21 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 56.01 1o8t h ASN 35 Cb 0.37 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.69 1o8t h ASN 35 CO 0.00 0.07 0.19 0.25 -1.65 0.00 0.00 177.43 176.29 1o8t h LEU 36 N 0.00 0.22 -1.20 1.61 6.46 0.66 0.17 115.31 123.22 1o8t h LEU 36 Ca -0.00 0.05 -0.04 0.00 -0.12 0.00 0.00 57.88 57.76 1o8t h LEU 36 Cb 0.14 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 1o8t h LEU 36 CO 0.01 0.16 0.10 1.88 -0.62 0.00 0.00 178.44 179.97 1o8t h TYR 37 N 0.37 0.67 -0.56 1.25 0.05 -1.36 -2.26 116.97 115.14 1o8t h TYR 37 Ca 0.22 -0.05 0.04 0.00 0.05 0.00 0.00 58.73 58.98 1o8t h TYR 37 Cb 0.19 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.69 1o8t h TYR 37 CO -0.14 0.58 0.31 0.93 -1.05 0.00 0.00 178.16 178.79 1o8t h GLU 38 N 0.64 0.59 0.00 4.88 3.07 -0.43 -0.22 114.58 123.11 1o8t h GLU 38 Ca 0.15 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.97 1o8t h GLU 38 Cb 0.25 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1o8t h GLU 38 CO -0.00 0.39 -0.00 -0.22 -1.40 0.00 0.00 179.01 177.77 1o8t h LYS 39 N 0.60 0.00 -0.00 2.33 1.63 -0.38 0.24 116.57 120.99 1o8t h LYS 39 Ca 0.24 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.04 1o8t h LYS 39 Cb 0.10 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1o8t h LYS 39 CO -0.14 0.00 -0.37 2.41 -3.45 0.00 0.00 179.45 177.90 1o8t n THR 40 N -3.17 0.00 0.00 1.00 -1.04 -0.12 -4.47 114.28 106.48 1o8t n THR 40 Ca -0.03 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1o8t n THR 40 Cb 0.08 0.08 0.00 0.00 -1.82 0.00 0.00 70.33 68.67 1o8t n THR 40 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1o8t n TYR 41 N -1.45 0.00 0.00 -1.42 9.36 0.83 -5.05 117.16 119.43 1o8t n TYR 41 Ca 0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.28 1o8t n TYR 41 Cb 0.33 -0.02 0.00 0.00 -0.63 0.00 0.00 39.34 39.03 1o8t n TYR 41 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1o8t n LEU 42 N -0.55 0.00 -0.18 2.98 4.77 -1.26 -5.04 117.00 117.72 1o8t n LEU 42 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 1o8t n LEU 42 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1o8t n LEU 42 CO 0.00 0.00 0.49 -0.65 -1.33 0.00 0.00 177.39 175.90 1o8t h PRO 43 N 0.00 -0.12 0.00 3.23 0.11 -1.93 -1.02 132.00 132.27 1o8t h PRO 43 Ca 0.00 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1o8t h PRO 43 Cb 0.00 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.14 1o8t h PRO 43 CO 0.00 -0.08 0.00 0.00 -0.21 0.00 0.00 178.00 177.71 1o8t h ALA 44 N -0.27 1.00 -2.10 -0.75 0.00 -1.91 -3.32 119.26 111.91 1o8t h ALA 44 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1o8t h ALA 44 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1o8t h ALA 44 CO -0.49 0.00 0.00 0.28 0.00 0.00 0.00 179.25 179.04 1o8t n VAL 45 N -2.55 0.00 0.21 0.00 0.31 -0.38 -0.39 118.33 115.54 1o8t n VAL 45 Ca 0.00 1.15 0.11 0.00 -0.01 0.00 0.00 64.34 65.59 1o8t n VAL 45 Cb 0.17 -1.72 0.22 0.00 -0.91 0.00 0.00 33.84 31.60 1o8t n VAL 45 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1o8t h ASP 46 N 0.00 0.00 -0.16 4.52 3.58 -1.74 -3.31 116.42 119.31 1o8t h ASP 46 Ca 0.00 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 1o8t h ASP 46 Cb 0.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 1o8t h ASP 46 CO 0.00 0.09 -0.04 -0.33 -2.88 0.00 0.00 179.24 176.08 1o8t h GLU 47 N 0.00 0.31 -0.15 0.28 5.08 -1.61 -2.97 114.58 115.52 1o8t h GLU 47 Ca -0.00 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1o8t h GLU 47 Cb 1.00 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1o8t h GLU 47 CO 0.01 0.59 0.11 -0.22 -1.00 0.00 0.00 179.01 178.50 1o8t h LYS 48 N 0.01 0.05 0.42 2.33 3.64 -0.81 0.32 116.57 122.53 1o8t h LYS 48 Ca 0.04 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 1o8t h LYS 48 Cb 0.48 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1o8t h LYS 48 CO 0.02 0.03 -0.20 1.25 -2.27 0.00 0.00 179.45 178.28 1o8t h LEU 49 N 0.05 -0.47 -1.95 5.20 6.46 -1.63 -2.58 115.31 120.38 1o8t h LEU 49 Ca 0.07 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.82 1o8t h LEU 49 Cb 0.21 0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.26 1o8t h LEU 49 CO -0.01 -0.30 -0.11 0.03 -0.62 0.00 0.00 178.44 177.44 1o8t h ARG 50 N -0.64 0.00 0.14 1.25 2.47 -1.43 -2.89 114.38 113.27 1o8t h ARG 50 Ca -0.06 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.68 1o8t h ARG 50 Cb 0.43 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.72 1o8t h ARG 50 CO 0.09 0.11 -0.23 0.22 0.56 0.00 0.00 179.97 180.72 1o8t h ASP 51 N 0.00 -0.65 0.32 7.04 3.58 -0.27 -0.06 116.42 126.38 1o8t h ASP 51 Ca -0.00 0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.47 1o8t h ASP 51 Cb 0.23 0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1o8t h ASP 51 CO 0.01 -0.33 -0.24 -0.07 -2.88 0.00 0.00 179.24 175.74 1o8t h LEU 52 N -0.45 0.00 -0.02 2.28 3.38 -1.26 -2.37 115.31 116.87 1o8t h LEU 52 Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1o8t h LEU 52 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1o8t h LEU 52 CO -0.12 0.24 -0.01 1.88 0.09 0.00 0.00 178.44 180.53 1o8t h TYR 53 N 0.00 0.04 -0.25 1.13 0.05 -1.20 -0.11 116.97 116.64 1o8t h TYR 53 Ca -0.00 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 1o8t h TYR 53 Cb 0.46 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 1o8t h TYR 53 CO 0.00 0.40 0.15 1.03 -1.05 0.00 0.00 178.16 178.69 1o8t h SER 54 N -0.33 0.30 -0.46 3.88 0.87 -0.89 -2.51 113.55 114.41 1o8t h SER 54 Ca 0.01 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1o8t h SER 54 Cb 0.39 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 1o8t h SER 54 CO 0.00 0.27 0.25 0.50 -0.53 0.00 0.00 176.83 177.32 1o8t h LYS 55 N 0.30 0.65 0.00 2.24 3.64 -1.45 -2.38 116.57 119.57 1o8t h LYS 55 Ca 0.09 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1o8t h LYS 55 Cb 0.03 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1o8t h LYS 55 CO -0.02 0.52 0.00 0.77 -2.27 0.00 0.00 179.45 178.46 1o8t h SER 56 N 0.61 0.00 0.81 4.20 0.02 -0.81 -1.62 113.55 116.76 1o8t h SER 56 Ca 0.16 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 1o8t h SER 56 Cb 0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1o8t h SER 56 CO -0.02 0.00 -0.49 0.74 -1.14 0.00 0.00 176.83 175.92 1o8t h THR 57 N 0.00 0.02 0.11 -2.27 2.02 -0.98 -1.68 112.91 110.13 1o8t h THR 57 Ca 0.00 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 66.86 1o8t h THR 57 Cb 0.12 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 1o8t h THR 57 CO 0.00 0.00 -1.67 0.00 0.37 0.00 0.00 175.52 174.22 1o8t h ALA 58 N -1.13 0.29 0.72 6.16 0.00 -1.71 -3.26 119.26 120.32 1o8t h ALA 58 Ca -0.11 -1.24 -0.04 0.00 0.00 0.00 0.00 54.91 53.53 1o8t h ALA 58 Cb 0.97 0.61 0.01 0.00 0.00 0.00 0.00 17.79 19.37 1o8t h ALA 58 CO 0.11 1.03 -0.34 0.00 0.00 0.00 0.00 179.25 180.05 1o8t h ALA 59 N -0.04 -1.13 0.00 0.00 0.00 -1.42 -3.07 119.26 113.60 1o8t h ALA 59 Ca -0.36 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 1o8t h ALA 59 Cb 1.85 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 20.01 1o8t h ALA 59 CO 0.05 -1.06 -0.01 1.98 0.00 0.00 0.00 179.25 180.20 1o8t h MET 60 N -1.07 0.00 0.00 0.00 4.05 -1.45 -1.88 114.93 114.58 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 0.74 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.54 1o8t h MET 60 CO 0.16 0.01 0.00 0.43 0.23 0.00 0.00 176.91 177.75 1o8t n SER 61 N -3.30 0.58 -0.12 1.39 7.64 -1.16 -1.17 113.62 117.47 1o8t n SER 61 Ca -0.02 0.68 -0.24 0.00 1.01 0.00 0.00 58.87 60.30 1o8t n SER 61 Cb 0.12 -0.79 -0.09 0.00 -1.01 0.00 0.00 64.21 62.45 1o8t n SER 61 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1o8t n THR 62 N -2.18 1.52 0.27 0.44 -1.04 -0.71 -4.32 114.28 108.26 1o8t n THR 62 Ca 0.01 -0.20 0.07 0.00 -2.04 0.00 0.00 64.05 61.89 1o8t n THR 62 Cb 0.17 -2.02 0.34 0.00 -1.82 0.00 0.00 70.33 67.00 1o8t n THR 62 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1o8t n TYR 63 N -4.34 0.37 0.26 -1.42 9.36 -1.20 -1.88 117.16 118.31 1o8t n TYR 63 Ca -0.41 0.17 -0.11 0.00 3.32 0.00 0.00 57.90 60.87 1o8t n TYR 63 Cb 0.76 -0.77 -0.05 0.00 -0.63 0.00 0.00 39.34 38.64 1o8t n TYR 63 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 1o8t h THR 64 N 0.00 0.00 -0.46 2.97 1.35 -1.34 0.61 112.91 116.05 1o8t h THR 64 Ca 0.00 -0.46 -0.08 0.00 -0.55 0.00 0.00 66.41 65.32 1o8t h THR 64 Cb 0.16 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 66.56 1o8t h THR 64 CO 0.00 0.00 -0.02 1.23 -0.25 0.00 0.00 175.52 176.48 1o8t h GLY 65 N -1.17 0.84 0.83 5.82 0.00 -1.75 -1.78 103.07 105.86 1o8t h GLY 65 Ca -0.07 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.65 1o8t h GLY 65 CO 0.12 0.53 -0.34 -2.22 0.00 0.00 0.00 176.54 174.63 1o8t h ILE 66 N 0.72 0.17 -0.24 2.60 5.03 -1.42 0.11 117.51 124.49 1o8t h ILE 66 Ca 0.14 -0.22 0.06 0.00 -0.12 0.00 0.00 64.86 64.72 1o8t h ILE 66 Cb 0.47 0.22 -0.07 0.00 -3.03 0.00 0.00 36.82 34.41 1o8t h ILE 66 CO 0.02 0.02 -0.30 0.15 -0.68 0.00 0.00 178.15 177.36 1o8t h PHE 67 N -1.13 -0.82 0.00 1.37 3.57 0.28 0.55 116.94 120.75 1o8t h PHE 67 Ca -0.10 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 1o8t h PHE 67 Cb 0.76 0.39 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 1o8t h PHE 67 CO -0.00 -0.37 -0.08 1.15 -2.23 0.00 0.00 178.31 176.78 1o8t h THR 68 N -0.31 0.37 0.38 4.41 2.02 -1.36 -2.78 112.91 115.64 1o8t h THR 68 Ca 0.13 -0.42 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1o8t h THR 68 Cb 0.52 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 1o8t h THR 68 CO -0.42 0.07 -0.31 -0.78 0.37 0.00 0.00 175.52 174.46 1o8t h ASP 69 N 0.00 -0.82 0.68 4.18 3.58 0.16 0.28 116.42 124.48 1o8t h ASP 69 Ca -0.00 0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 1o8t h ASP 69 Cb 0.30 0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 1o8t h ASP 69 CO 0.01 -0.46 -0.32 1.56 -2.88 0.00 0.00 179.24 177.15 1o8t h GLN 70 N -0.70 0.00 0.28 0.28 7.50 -1.41 -1.65 115.11 119.41 1o8t h GLN 70 Ca -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.10 1o8t h GLN 70 Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.14 1o8t h GLN 70 CO -0.02 0.32 -0.14 0.28 -1.50 0.00 0.00 178.83 177.78 1o8t h VAL 71 N 0.00 0.72 -0.74 -0.54 2.07 -1.17 -2.38 116.25 114.21 1o8t h VAL 71 Ca -0.00 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 66.91 1o8t h VAL 71 Cb 0.75 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 1o8t h VAL 71 CO 0.04 0.13 0.49 0.25 0.02 0.00 0.00 177.57 178.50 1o8t h LEU 72 N -0.77 0.64 -1.17 2.57 5.85 -0.41 -0.18 115.31 121.85 1o8t h LEU 72 Ca -0.04 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1o8t h LEU 72 Cb 0.50 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 1o8t h LEU 72 CO 0.06 0.40 0.57 0.77 -0.34 0.00 0.00 178.44 179.91 1o8t h SER 73 N 0.72 0.90 1.05 1.25 4.64 -1.11 0.94 113.55 121.94 1o8t h SER 73 Ca 0.33 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1o8t h SER 73 Cb 0.35 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1o8t h SER 73 CO -0.12 0.59 0.00 0.58 -0.87 0.00 0.00 176.83 177.02 1o8t h VAL 74 N 1.03 0.00 -0.61 0.95 2.07 -0.50 -2.94 116.25 116.25 1o8t h VAL 74 Ca 0.37 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 1o8t h VAL 74 Cb 0.14 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 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 -0.38 2.57 6.46 -0.51 0.18 115.31 124.55 1o8t h LEU 75 Ca 0.00 -0.19 -0.18 0.00 -0.12 0.00 0.00 57.88 57.39 1o8t h LEU 75 Cb 0.52 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1o8t h LEU 75 CO 0.00 0.91 -0.52 0.50 -0.62 0.00 0.00 178.44 178.71 1o8t h LYS 76 N 0.92 0.79 0.00 1.25 3.64 -1.51 -2.85 116.57 118.82 1o8t h LYS 76 Ca 0.19 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1o8t h LYS 76 Cb 0.37 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1o8t h LYS 76 CO 0.01 1.12 0.00 0.41 -2.27 0.00 0.00 179.45 178.71 1o8t n GLY 77 N 0.30 -0.95 2.02 5.01 0.00 -1.07 -4.73 105.19 105.77 1o8t n GLY 77 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1o8t n GLY 77 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1o8t n GLU 78 N -0.88 1.16 -0.86 1.61 -0.58 -0.71 -5.12 120.64 115.25 1o8t n GLU 78 Ca 0.00 -2.92 0.00 0.00 -0.42 0.00 0.00 57.16 53.82 1o8t n GLU 78 Cb 0.00 -1.00 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74