#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 3.22 -3.72 -2.82 10.64 -1.26 -4.98 117.38 118.47 1o8t n GLN 2 Ca 0.00 -4.20 -0.14 0.00 -1.83 0.00 0.00 57.00 50.83 1o8t n GLN 2 Cb 0.00 -2.26 -0.14 0.00 -0.86 0.00 0.00 30.24 26.98 1o8t n GLN 2 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 1o8t s GLN 3 N -3.71 0.10 -1.21 2.61 -0.44 -1.26 -5.09 119.66 110.66 1o8t s GLN 3 Ca 0.49 0.48 -0.20 0.00 -2.50 0.00 0.00 55.36 53.63 1o8t s GLN 3 Cb 0.41 -0.19 0.02 0.00 -1.64 0.00 0.00 33.01 31.62 1o8t s GLN 3 CO -0.26 -0.21 1.76 -1.25 0.50 0.00 0.00 175.29 175.82 1o8t s PRO 4 N 1.59 3.51 -0.04 1.67 0.04 -1.26 -4.96 135.00 135.55 1o8t s PRO 4 Ca -0.05 -1.60 -0.30 0.00 0.04 0.00 0.00 61.00 59.09 1o8t s PRO 4 Cb -0.12 -5.42 -0.04 0.00 0.04 0.00 0.00 34.50 28.96 1o8t s PRO 4 CO -0.07 -2.72 1.33 -0.65 0.04 0.00 0.00 177.00 174.94 1o8t s GLN 5 N 5.00 4.30 1.15 4.56 -0.21 -1.26 -5.02 119.66 128.18 1o8t s GLN 5 Ca 0.57 1.85 -0.16 0.00 0.02 0.00 0.00 55.36 57.64 1o8t s GLN 5 Cb 0.02 -3.60 0.26 0.00 1.00 0.00 0.00 33.01 30.68 1o8t s GLN 5 CO 0.06 -0.56 1.07 1.14 -2.12 0.00 0.00 175.29 174.89 1o8t s GLN 6 N 2.52 -0.77 -0.29 2.91 1.03 -1.26 -4.92 119.66 118.87 1o8t s GLN 6 Ca 0.61 0.28 -0.29 0.00 0.04 0.00 0.00 55.36 56.00 1o8t s GLN 6 Cb -0.28 -1.62 -0.01 0.00 0.03 0.00 0.00 33.01 31.13 1o8t s GLN 6 CO 0.24 -3.49 1.58 0.34 -2.54 0.00 0.00 175.29 171.42 1o8t s ASP 7 N -3.46 6.30 -0.76 12.60 -1.08 -1.26 -4.93 116.67 124.08 1o8t s ASP 7 Ca 0.68 1.33 -0.26 0.00 -0.52 0.00 0.00 52.55 53.79 1o8t s ASP 7 Cb -0.16 -2.53 -0.03 0.00 -1.46 0.00 0.00 42.92 38.74 1o8t s ASP 7 CO 0.58 -1.37 1.88 -0.70 0.52 0.00 0.00 175.17 176.07 1o8t s GLU 8 N 4.89 2.63 -0.01 4.34 -6.30 -1.26 -4.85 118.70 118.13 1o8t s GLU 8 Ca 0.69 0.15 -0.20 0.00 -2.50 0.00 0.00 54.97 53.11 1o8t s GLU 8 Cb -0.21 -4.71 -0.11 0.00 0.00 0.00 0.00 34.13 29.10 1o8t s GLU 8 CO 0.30 -3.00 0.85 0.52 0.02 0.00 0.00 175.26 173.95 1o8t h MET 9 N 13.08 -0.70 -3.02 4.30 2.86 -2.03 -3.33 114.93 126.09 1o8t h MET 9 Ca -0.09 0.05 -0.64 0.00 -2.06 0.00 0.00 59.70 56.96 1o8t h MET 9 Cb 1.09 0.16 0.03 0.00 0.06 0.00 0.00 31.60 32.93 1o8t h MET 9 CO 1.22 -0.47 3.72 -0.35 1.06 0.00 0.00 176.91 182.09 1o8t n PRO 10 N -5.19 3.56 0.15 -0.22 -0.04 -1.26 -4.63 135.00 127.37 1o8t n PRO 10 Ca -0.09 -2.13 -0.08 0.00 -0.04 0.00 0.00 63.50 61.17 1o8t n PRO 10 Cb 0.29 -2.76 -0.04 0.00 -0.04 0.00 0.00 33.50 30.95 1o8t n PRO 10 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1o8t h SER 11 N 5.08 -0.40 -0.50 3.54 0.02 -1.99 -3.36 113.55 115.94 1o8t h SER 11 Ca 0.84 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.74 1o8t h SER 11 Cb 0.29 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 1o8t h SER 11 CO 1.74 0.05 0.12 1.55 -1.14 0.00 0.00 176.83 179.15 1o8t h PRO 12 N -1.12 0.79 -6.19 3.45 0.13 -1.93 -3.40 132.00 123.74 1o8t h PRO 12 Ca -0.05 -0.19 -0.53 0.00 -0.87 0.00 0.00 66.00 64.36 1o8t h PRO 12 Cb 0.38 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.36 1o8t h PRO 12 CO 0.08 0.76 1.25 0.95 -0.23 0.00 0.00 178.00 180.81 1o8t s THR 13 N -5.31 3.53 -0.13 1.56 -4.23 -1.26 -4.82 115.64 104.99 1o8t s THR 13 Ca -0.13 0.42 0.03 0.00 -1.18 0.00 0.00 61.69 60.83 1o8t s THR 13 Cb 0.11 -4.08 -0.24 0.00 1.34 0.00 0.00 72.50 69.63 1o8t s THR 13 CO 0.79 -0.93 0.33 0.33 -0.54 0.00 0.00 174.62 174.60 1o8t n PHE 14 N 11.13 0.85 0.00 3.99 7.35 -1.26 -4.22 117.46 135.29 1o8t n PHE 14 Ca 0.18 0.23 0.02 0.00 -0.76 0.00 0.00 57.45 57.11 1o8t n PHE 14 Cb 0.50 -1.13 0.35 0.00 0.35 0.00 0.00 39.48 39.55 1o8t n PHE 14 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1o8t h LEU 15 N 0.03 0.48 -0.19 -2.13 5.85 -1.97 -2.46 115.31 114.91 1o8t h LEU 15 Ca -0.42 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.27 1o8t h LEU 15 Cb 2.03 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.92 1o8t h LEU 15 CO 0.05 0.47 0.03 0.71 -0.34 0.00 0.00 178.44 179.36 1o8t h THR 16 N 0.52 0.90 0.30 1.05 1.35 -1.97 -2.98 112.91 112.08 1o8t h THR 16 Ca 0.12 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.93 1o8t h THR 16 Cb 0.18 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 67.39 1o8t h THR 16 CO -0.01 0.02 -0.14 -0.61 -0.25 0.00 0.00 175.52 174.53 1o8t h GLN 17 N 0.10 -0.38 -0.49 4.72 -0.00 -1.68 -3.21 115.11 114.16 1o8t h GLN 17 Ca 0.09 0.03 0.09 0.00 -0.00 0.00 0.00 58.65 58.86 1o8t h GLN 17 Cb 0.09 0.09 -0.09 0.00 0.00 0.00 0.00 27.48 27.57 1o8t h GLN 17 CO -0.12 -0.19 -0.14 0.28 0.00 0.00 0.00 178.83 178.66 1o8t n VAL 18 N -5.22 -0.22 0.07 2.39 0.31 -0.95 0.03 118.33 114.74 1o8t n VAL 18 Ca -0.10 1.13 -0.14 0.00 -0.01 0.00 0.00 64.34 65.22 1o8t n VAL 18 Cb 0.21 -1.54 -0.07 0.00 -0.91 0.00 0.00 33.84 31.53 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 -0.57 0.00 5.55 6.56 -1.56 -0.80 116.57 125.75 1o8t h LYS 19 Ca 0.22 0.04 -0.04 0.00 -1.06 0.00 0.00 60.65 59.81 1o8t h LYS 19 Cb 0.34 0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.13 1o8t h LYS 19 CO -0.50 -0.38 -0.18 1.49 -2.06 0.00 0.00 179.45 177.82 1o8t h GLU 20 N -0.59 0.00 -0.44 3.15 4.22 -0.55 -2.36 114.58 118.01 1o8t h GLU 20 Ca 0.04 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.45 1o8t h GLU 20 Cb 0.66 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1o8t h GLU 20 CO -0.31 0.18 0.12 0.66 -2.18 0.00 0.00 179.01 177.49 1o8t h SER 21 N 0.00 0.59 -0.02 1.04 4.64 0.25 -1.54 113.55 118.51 1o8t h SER 21 Ca -0.00 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 1o8t h SER 21 Cb 0.35 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1o8t h SER 21 CO 0.02 0.58 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.46 1o8t h LEU 22 N 0.63 0.06 -0.38 5.97 4.07 -0.73 -2.44 115.31 122.48 1o8t h LEU 22 Ca 0.15 -0.54 0.01 0.00 0.08 0.00 0.00 57.88 57.58 1o8t h LEU 22 Cb 0.21 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.91 1o8t h LEU 22 CO -0.01 0.58 0.23 0.77 -1.08 0.00 0.00 178.44 178.93 1o8t h SER 23 N -0.47 0.37 0.38 -0.43 4.64 -1.46 -0.34 113.55 116.25 1o8t h SER 23 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1o8t h SER 23 Cb 0.57 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1o8t h SER 23 CO 0.01 0.27 -0.02 0.28 -0.87 0.00 0.00 176.83 176.49 1o8t h SER 24 N 0.46 0.00 0.15 4.97 0.02 -1.34 -1.86 113.55 115.94 1o8t h SER 24 Ca 0.15 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.86 1o8t h SER 24 Cb -0.00 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.55 1o8t h SER 24 CO -0.06 0.02 -1.13 0.22 -1.14 0.00 0.00 176.83 174.73 1o8t h TYR 25 N 0.00 0.60 -0.45 3.45 3.20 -0.68 -3.33 116.97 119.75 1o8t h TYR 25 Ca -0.00 -0.43 -0.05 0.00 3.14 0.00 0.00 58.73 61.39 1o8t h TYR 25 Cb 0.22 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1o8t h TYR 25 CO 0.00 1.44 0.07 2.35 -1.64 0.00 0.00 178.16 180.38 1o8t h TRP 26 N -0.25 0.71 -0.92 -3.82 -0.00 -0.71 -0.16 115.95 110.80 1o8t h TRP 26 Ca -0.22 -0.07 0.10 0.00 -0.00 0.00 0.00 58.89 58.70 1o8t h TRP 26 Cb 1.78 -0.21 -0.12 0.00 -0.00 0.00 0.00 29.16 30.61 1o8t h TRP 26 CO 0.16 0.63 -0.55 0.93 -0.00 0.00 0.00 178.44 179.62 1o8t h GLU 27 N 0.66 -0.05 -0.01 2.65 5.08 -1.46 0.78 114.58 122.22 1o8t h GLU 27 Ca 0.14 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 29.57 1o8t h GLU 27 CO 0.00 -0.03 -0.28 0.45 -1.00 0.00 0.00 179.01 178.15 1o8t n SER 28 N -5.31 1.66 -0.13 1.42 2.88 -1.19 -4.27 113.62 108.67 1o8t n SER 28 Ca 0.03 -1.31 0.01 0.00 -1.33 0.00 0.00 58.87 56.27 1o8t n SER 28 Cb 0.30 0.23 0.30 0.00 -0.75 0.00 0.00 64.21 64.28 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 3.95 1.50 -0.19 -1.46 0.00 0.11 -2.92 119.26 120.26 1o8t h ALA 29 Ca 0.00 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1o8t h ALA 29 Cb 0.65 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1o8t h ALA 29 CO 0.00 0.43 -0.18 0.87 0.00 0.00 0.00 179.25 180.37 1o8t h LYS 30 N 0.82 -0.19 -1.02 0.00 1.57 -1.72 -0.24 116.57 115.79 1o8t h LYS 30 Ca 0.22 0.01 0.26 0.00 -1.87 0.00 0.00 60.65 59.27 1o8t h LYS 30 Cb -0.03 0.04 -0.12 0.00 0.08 0.00 0.00 32.23 32.21 1o8t h LYS 30 CO -0.04 -0.13 0.62 1.15 -0.57 0.00 0.00 179.45 180.48 1o8t h THR 31 N -0.20 0.52 -0.61 -0.16 2.02 -1.81 0.39 112.91 113.06 1o8t h THR 31 Ca 0.12 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1o8t h THR 31 Cb 0.38 -0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 66.72 1o8t h THR 31 CO -0.31 0.09 0.29 0.00 0.37 0.00 0.00 175.52 175.96 1o8t h ALA 32 N 1.70 0.79 -0.17 6.16 0.00 -1.09 -0.71 119.26 125.93 1o8t h ALA 32 Ca 0.64 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.45 1o8t h ALA 32 Cb 1.34 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 1o8t h ALA 32 CO -0.42 0.36 -0.47 0.00 0.00 0.00 0.00 179.25 178.71 1o8t h ALA 33 N 1.12 -0.69 -0.45 0.00 0.00 0.42 0.54 119.26 120.19 1o8t h ALA 33 Ca 0.21 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1o8t h ALA 33 Cb 0.13 0.90 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1o8t h ALA 33 CO -0.03 -0.99 0.04 0.37 0.00 0.00 0.00 179.25 178.65 1o8t h GLN 34 N -0.51 0.72 0.00 0.00 4.15 -1.46 -1.91 115.11 116.10 1o8t h GLN 34 Ca 0.07 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.30 1o8t h GLN 34 Cb 0.64 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.24 1o8t h GLN 34 CO -0.44 0.71 -0.08 -0.97 -1.93 0.00 0.00 178.83 176.12 1o8t h ASN 35 N 0.68 0.00 -0.38 -0.69 -1.24 0.45 -1.43 115.58 112.97 1o8t h ASN 35 Ca 0.14 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.20 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 0.08 0.11 0.25 -1.29 0.00 0.00 177.43 176.59 1o8t h LEU 36 N 0.00 0.10 -0.95 0.34 6.46 0.85 0.21 115.31 122.31 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 0.15 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.10 1o8t h LEU 36 CO 0.01 0.09 0.23 1.88 -0.62 0.00 0.00 178.44 180.03 1o8t h TYR 37 N 0.26 1.01 0.54 1.25 0.05 -1.33 -2.87 116.97 115.88 1o8t h TYR 37 Ca 0.18 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 1o8t h TYR 37 Cb 0.18 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.61 1o8t h TYR 37 CO -0.16 0.79 -0.35 0.93 -1.05 0.00 0.00 178.16 178.32 1o8t h GLU 38 N 0.96 -0.81 0.00 4.88 3.07 -0.09 -2.62 114.58 119.97 1o8t h GLU 38 Ca 0.22 0.06 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 1o8t h GLU 38 Cb 0.24 0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1o8t h GLU 38 CO -0.01 -0.54 0.03 0.36 -1.40 0.00 0.00 179.01 177.44 1o8t n LYS 39 N -4.59 0.05 0.02 2.33 -0.00 0.49 -2.16 118.16 114.30 1o8t n LYS 39 Ca -0.10 0.53 -0.13 0.00 -0.00 0.00 0.00 58.31 58.61 1o8t n LYS 39 Cb 0.36 -1.69 -0.09 0.00 -0.00 0.00 0.00 35.03 33.61 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 1.19 -0.55 0.58 2.02 -1.23 -3.16 112.91 111.75 1o8t h THR 40 Ca 0.00 -0.65 -0.08 0.00 0.77 0.00 0.00 66.41 66.45 1o8t h THR 40 Cb 0.05 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 1o8t h THR 40 CO 0.00 0.17 0.02 1.88 0.37 0.00 0.00 175.52 177.96 1o8t h TYR 41 N -0.31 1.03 -4.01 3.16 0.05 -1.51 -3.44 116.97 111.93 1o8t h TYR 41 Ca -0.00 -0.17 -0.51 0.00 0.05 0.00 0.00 58.73 58.10 1o8t h TYR 41 Cb 0.30 -0.27 0.07 0.00 1.01 0.00 0.00 36.73 37.84 1o8t h TYR 41 CO 0.02 0.93 0.49 -0.51 -1.05 0.00 0.00 178.16 178.05 1o8t s LEU 42 N -9.40 3.97 -0.40 3.88 1.02 -1.20 -4.95 118.68 111.60 1o8t s LEU 42 Ca -0.12 2.35 -0.00 0.00 0.02 0.00 0.00 54.13 56.38 1o8t s LEU 42 Cb 0.12 -4.27 0.33 0.00 0.02 0.00 0.00 46.19 42.39 1o8t s LEU 42 CO 0.83 -1.02 1.92 -0.81 0.02 0.00 0.00 176.35 177.29 1o8t n PRO 43 N -0.62 2.03 0.20 1.29 -0.04 -1.26 -4.56 135.00 132.03 1o8t n PRO 43 Ca 0.08 -2.09 0.14 0.00 -0.04 0.00 0.00 63.50 61.59 1o8t n PRO 43 Cb 0.48 -1.82 0.66 0.00 -0.04 0.00 0.00 33.50 32.78 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 1.58 1.00 -0.98 0.55 0.00 -1.92 -3.31 119.26 116.17 1o8t h ALA 44 Ca 0.40 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.43 1o8t h ALA 44 Cb 1.21 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1o8t h ALA 44 CO 0.96 0.00 -0.49 0.28 0.00 0.00 0.00 179.25 180.00 1o8t n VAL 45 N -2.52 -0.60 0.08 0.00 0.31 -1.26 0.40 118.33 114.74 1o8t n VAL 45 Ca 0.00 2.33 -0.04 0.00 -0.01 0.00 0.00 64.34 66.62 1o8t n VAL 45 Cb 0.17 -2.96 0.16 0.00 -0.91 0.00 0.00 33.84 30.29 1o8t n VAL 45 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1o8t h ASP 46 N 0.00 0.31 0.36 4.52 3.32 -1.99 -2.88 116.42 120.06 1o8t h ASP 46 Ca 0.24 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1o8t h ASP 46 Cb 0.48 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1o8t h ASP 46 CO -0.94 0.76 -0.17 -0.33 -1.72 0.00 0.00 179.24 176.84 1o8t h GLU 47 N 0.22 -0.47 -0.39 3.56 3.07 -0.92 -2.97 114.58 116.68 1o8t h GLU 47 Ca 0.01 0.03 0.11 0.00 -0.50 0.00 0.00 59.36 59.01 1o8t h GLU 47 Cb 0.97 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.97 1o8t h GLU 47 CO 0.08 -0.15 0.29 -0.22 -1.40 0.00 0.00 179.01 177.61 1o8t h LYS 48 N -0.87 0.00 0.64 2.33 3.64 -0.13 0.29 116.57 122.48 1o8t h LYS 48 Ca -0.05 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1o8t h LYS 48 Cb 0.54 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.36 1o8t h LYS 48 CO 0.08 0.00 -0.31 -0.07 -2.27 0.00 0.00 179.45 176.88 1o8t h LEU 49 N 0.00 -0.73 -1.77 5.20 -0.00 -1.44 -2.22 115.31 114.35 1o8t h LEU 49 Ca 0.19 0.03 -0.03 0.00 -0.00 0.00 0.00 57.88 58.06 1o8t h LEU 49 Cb 0.77 0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 41.61 1o8t h LEU 49 CO -0.00 -0.46 -0.14 -0.09 -0.00 0.00 0.00 178.44 177.75 1o8t h ARG 50 N -0.99 0.00 0.02 1.13 2.43 -1.32 -2.88 114.38 112.77 1o8t h ARG 50 Ca -0.09 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1o8t h ARG 50 Cb 0.66 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.18 1o8t h ARG 50 CO 0.15 0.14 -0.17 -0.44 -1.51 0.00 0.00 179.97 178.14 1o8t h ASP 51 N 0.00 -0.48 -0.08 -3.80 3.32 -0.29 -0.77 116.42 114.32 1o8t h ASP 51 Ca -0.00 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1o8t h ASP 51 Cb 0.26 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1o8t h ASP 51 CO 0.02 -0.23 0.01 -0.07 -1.72 0.00 0.00 179.24 177.25 1o8t h LEU 52 N -0.28 0.18 -0.25 1.55 4.07 -1.18 -2.19 115.31 117.21 1o8t h LEU 52 Ca 0.05 -0.02 -0.06 0.00 0.08 0.00 0.00 57.88 57.94 1o8t h LEU 52 Cb 0.34 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.03 1o8t h LEU 52 CO -0.15 0.21 -0.07 1.88 -1.08 0.00 0.00 178.44 179.24 1o8t h TYR 53 N 0.20 0.55 0.03 1.13 0.05 -1.25 0.02 116.97 117.69 1o8t h TYR 53 Ca 0.05 -0.12 -0.00 0.00 0.05 0.00 0.00 58.73 58.71 1o8t h TYR 53 Cb 0.12 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.73 1o8t h TYR 53 CO 0.00 0.71 -0.01 0.77 -1.05 0.00 0.00 178.16 178.58 1o8t h SER 54 N 0.23 -0.03 -0.76 3.88 0.02 -0.77 -2.59 113.55 113.52 1o8t h SER 54 Ca 0.06 -0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1o8t h SER 54 Cb 0.54 0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.05 1o8t h SER 54 CO 0.03 0.03 0.41 0.50 -1.14 0.00 0.00 176.83 176.65 1o8t h LYS 55 N -0.09 1.07 0.00 3.45 3.64 -1.42 -2.28 116.57 120.94 1o8t h LYS 55 Ca -0.00 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1o8t h LYS 55 Cb 0.08 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1o8t h LYS 55 CO 0.01 0.80 0.00 0.77 -2.27 0.00 0.00 179.45 178.76 1o8t h SER 56 N 1.06 0.00 0.66 4.20 0.02 -0.76 -1.77 113.55 116.97 1o8t h SER 56 Ca 0.27 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 1o8t h SER 56 Cb 0.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 1o8t h SER 56 CO -0.04 0.00 -0.41 0.74 -1.14 0.00 0.00 176.83 175.98 1o8t h THR 57 N 0.00 0.17 0.11 -2.27 2.02 -1.02 -1.27 112.91 110.64 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 0.12 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 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 -0.77 0.29 0.87 6.16 0.00 -1.72 -3.27 119.26 120.82 1o8t h ALA 58 Ca -0.08 -1.23 -0.04 0.00 0.00 0.00 0.00 54.91 53.55 1o8t h ALA 58 Cb 0.82 0.61 0.01 0.00 0.00 0.00 0.00 17.79 19.22 1o8t h ALA 58 CO 0.08 1.01 -0.42 0.00 0.00 0.00 0.00 179.25 179.93 1o8t h ALA 59 N -0.06 -1.18 0.00 0.00 0.00 -1.44 -3.08 119.26 113.50 1o8t h ALA 59 Ca -0.36 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1o8t h ALA 59 Cb 1.83 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 20.07 1o8t h ALA 59 CO 0.04 -1.10 -0.04 1.98 0.00 0.00 0.00 179.25 180.13 1o8t h MET 60 N -1.29 0.00 0.00 0.00 4.05 -1.39 -1.51 114.93 114.79 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 0.89 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.69 1o8t h MET 60 CO 0.20 0.04 0.00 1.03 0.23 0.00 0.00 176.91 178.41 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.87 -1.49 0.52 113.55 114.85 1o8t h SER 61 Ca -0.00 0.00 -0.44 0.00 -1.23 0.00 0.00 61.79 60.12 1o8t h SER 61 Cb 0.12 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.02 1o8t h SER 61 CO 0.01 0.00 -2.49 0.41 -0.53 0.00 0.00 176.83 174.22 1o8t n THR 62 N -2.89 1.47 0.30 2.23 -1.04 -0.61 -4.28 114.28 109.46 1o8t n THR 62 Ca -0.00 -0.39 0.19 0.00 -2.04 0.00 0.00 64.05 61.80 1o8t n THR 62 Cb 0.22 -1.81 0.92 0.00 -1.82 0.00 0.00 70.33 67.83 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 -0.86 0.00 0.47 -1.42 -1.99 -1.44 -0.03 116.97 111.70 1o8t h TYR 63 Ca -0.67 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.04 1o8t h TYR 63 Cb 1.63 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.36 1o8t h TYR 63 CO -0.07 0.02 -0.23 1.15 -0.00 0.00 0.00 178.16 179.03 1o8t h THR 64 N 0.00 0.17 -0.57 -2.88 2.02 -1.10 0.49 112.91 111.05 1o8t h THR 64 Ca -0.00 -0.55 -0.05 0.00 0.77 0.00 0.00 66.41 66.57 1o8t h THR 64 Cb 0.28 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 1o8t h THR 64 CO 0.00 0.04 0.14 1.23 0.37 0.00 0.00 175.52 177.30 1o8t h GLY 65 N -1.10 0.95 0.83 2.16 0.00 -1.71 -1.80 103.07 102.39 1o8t h GLY 65 Ca -0.06 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.68 1o8t h GLY 65 CO 0.11 0.52 -0.29 -2.22 0.00 0.00 0.00 176.54 174.66 1o8t h ILE 66 N 0.85 0.32 -0.29 2.60 1.08 -1.03 0.11 117.51 121.14 1o8t h ILE 66 Ca 0.18 -0.25 0.07 0.00 -0.39 0.00 0.00 64.86 64.47 1o8t h ILE 66 Cb 0.31 0.40 -0.08 0.00 -3.07 0.00 0.00 36.82 34.38 1o8t h ILE 66 CO -0.00 0.03 -0.27 -0.26 -0.69 0.00 0.00 178.15 176.96 1o8t h PHE 67 N -0.99 -0.72 0.00 1.37 -1.00 0.07 0.71 116.94 116.38 1o8t h PHE 67 Ca -0.08 0.04 -0.03 0.00 2.81 0.00 0.00 57.97 60.71 1o8t h PHE 67 Cb 0.67 0.36 -0.00 0.00 3.61 0.00 0.00 35.95 40.59 1o8t h PHE 67 CO -0.00 -0.34 -0.14 1.79 -1.61 0.00 0.00 178.31 178.00 1o8t h THR 68 N -0.25 0.72 0.22 -1.55 1.35 -1.34 -2.62 112.91 109.44 1o8t h THR 68 Ca 0.15 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1o8t h THR 68 Cb 0.49 1.36 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 1o8t h THR 68 CO -0.44 0.14 -0.23 -0.78 -0.25 0.00 0.00 175.52 173.97 1o8t h ASP 69 N 0.00 -0.61 0.65 5.36 3.58 0.17 0.22 116.42 125.79 1o8t h ASP 69 Ca -0.00 0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.43 1o8t h ASP 69 Cb 0.34 0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.59 1o8t h ASP 69 CO 0.02 -0.33 -0.35 1.56 -2.88 0.00 0.00 179.24 177.26 1o8t h GLN 70 N -0.49 0.00 0.21 0.28 7.50 -1.34 -1.83 115.11 119.44 1o8t h GLN 70 Ca -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 1o8t h GLN 70 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.99 1o8t h GLN 70 CO -0.05 0.35 -0.10 0.28 -1.50 0.00 0.00 178.83 177.80 1o8t h VAL 71 N 0.00 0.88 -0.72 -0.54 2.07 -1.05 -2.27 116.25 114.61 1o8t h VAL 71 Ca -0.00 -0.74 0.08 0.00 0.82 0.00 0.00 66.70 66.85 1o8t h VAL 71 Cb 0.76 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.78 1o8t h VAL 71 CO 0.04 0.16 0.47 -0.07 0.02 0.00 0.00 177.57 178.20 1o8t h LEU 72 N -0.66 0.62 -1.03 2.57 -0.00 -0.53 -0.04 115.31 116.24 1o8t h LEU 72 Ca -0.03 0.01 0.05 0.00 -0.00 0.00 0.00 57.88 57.91 1o8t h LEU 72 Cb 0.47 -0.13 -0.06 0.00 -0.00 0.00 0.00 40.66 40.94 1o8t h LEU 72 CO 0.05 0.39 0.65 -1.28 -0.00 0.00 0.00 178.44 178.25 1o8t h SER 73 N 0.70 1.05 1.02 -0.43 0.87 -1.10 0.12 113.55 115.79 1o8t h SER 73 Ca 0.32 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 1o8t h SER 73 Cb 0.34 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1o8t h SER 73 CO -0.11 0.69 0.00 0.58 -0.53 0.00 0.00 176.83 177.46 1o8t h VAL 74 N 1.20 0.00 -0.41 2.23 2.07 -0.42 -2.84 116.25 118.08 1o8t h VAL 74 Ca 0.41 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 1o8t h VAL 74 Cb 0.10 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1o8t h VAL 74 CO -0.15 0.00 0.02 0.25 0.02 0.00 0.00 177.57 177.71 1o8t h LEU 75 N 0.00 0.62 -0.18 2.57 5.85 -0.31 0.35 115.31 124.21 1o8t h LEU 75 Ca 0.00 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.49 1o8t h LEU 75 Cb 0.51 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1o8t h LEU 75 CO 0.00 0.68 -0.31 0.11 -0.34 0.00 0.00 178.44 178.57 1o8t h LYS 76 N 0.62 0.53 0.33 1.25 6.56 -1.47 -3.37 116.57 121.02 1o8t h LYS 76 Ca 0.13 -0.33 -0.02 0.00 -1.06 0.00 0.00 60.65 59.37 1o8t h LYS 76 Cb 0.37 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.07 1o8t h LYS 76 CO 0.01 0.93 -0.16 0.78 -2.06 0.00 0.00 179.45 178.96 1o8t h GLY 77 N 0.18 -0.46 0.00 3.86 0.00 -1.53 -3.47 103.07 101.65 1o8t h GLY 77 Ca 0.01 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1o8t h GLY 77 CO 0.07 -0.17 0.00 1.18 0.00 0.00 0.00 176.54 177.62 1o8t n GLU 78 N -4.23 0.00 0.00 4.80 4.71 0.68 -5.12 120.64 121.48 1o8t n GLU 78 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 1o8t n GLU 78 Cb 0.17 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.60 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31