#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 -0.07 -5.05 -2.82 7.50 -2.07 -3.43 115.11 109.17 1o8t h GLN 2 Ca 0.00 0.01 -0.62 0.00 0.50 0.00 0.00 58.65 58.53 1o8t h GLN 2 Cb 0.00 0.02 -0.15 0.00 0.05 0.00 0.00 27.48 27.39 1o8t h GLN 2 CO 0.00 0.45 -0.51 -0.65 -1.50 0.00 0.00 178.83 176.62 1o8t s GLN 3 N -3.82 4.03 0.00 1.46 -1.52 -1.26 -4.97 119.66 113.58 1o8t s GLN 3 Ca -0.15 -0.29 0.11 0.00 -1.95 0.00 0.00 55.36 53.08 1o8t s GLN 3 Cb 0.01 -3.55 0.64 0.00 -0.22 0.00 0.00 33.01 29.89 1o8t s GLN 3 CO 0.62 0.01 1.40 -0.35 -0.25 0.00 0.00 175.29 176.72 1o8t n PRO 4 N 4.45 0.98 -0.04 2.91 -0.04 -1.26 -3.80 135.00 138.20 1o8t n PRO 4 Ca -0.15 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.16 1o8t n PRO 4 Cb 0.52 -1.17 -0.08 0.00 -0.04 0.00 0.00 33.50 32.72 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 0.00 0.42 -0.17 0.54 1.08 -1.99 -3.22 115.11 111.77 1o8t h GLN 5 Ca 0.00 -0.31 -0.10 0.00 -1.45 0.00 0.00 58.65 56.79 1o8t h GLN 5 Cb 0.00 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 1o8t h GLN 5 CO 0.00 0.94 -0.32 -0.56 -0.95 0.00 0.00 178.83 177.94 1o8t h GLN 6 N -0.01 0.34 -6.22 1.46 -0.00 -2.02 -3.43 115.11 105.23 1o8t h GLN 6 Ca -0.01 -0.14 -0.56 0.00 -0.00 0.00 0.00 58.65 57.94 1o8t h GLN 6 Cb 0.97 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.48 28.42 1o8t h GLN 6 CO 0.07 0.63 0.97 -0.51 -0.00 0.00 0.00 178.83 179.99 1o8t s ASP 7 N -6.85 6.82 -0.66 0.06 1.01 -1.22 -4.93 116.67 110.90 1o8t s ASP 7 Ca -0.06 1.97 -0.26 0.00 0.71 0.00 0.00 52.55 54.91 1o8t s ASP 7 Cb 0.14 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.51 1o8t s ASP 7 CO 0.78 -0.82 1.84 -1.61 0.21 0.00 0.00 175.17 175.57 1o8t s GLU 8 N 3.57 2.65 0.88 8.23 0.41 -1.26 -4.97 118.70 128.20 1o8t s GLU 8 Ca 0.64 0.45 -0.11 0.00 -0.41 0.00 0.00 54.97 55.53 1o8t s GLU 8 Cb -0.28 -4.47 0.12 0.00 -1.78 0.00 0.00 34.13 27.72 1o8t s GLU 8 CO 0.22 -2.79 1.09 -1.64 -0.49 0.00 0.00 175.26 171.66 1o8t s MET 9 N 6.97 1.40 0.44 1.61 -1.94 -1.26 -4.80 119.30 121.72 1o8t s MET 9 Ca 0.66 0.93 0.10 0.00 -1.71 0.00 0.00 55.69 55.67 1o8t s MET 9 Cb -0.12 -1.82 0.98 0.00 2.01 0.00 0.00 34.83 35.89 1o8t s MET 9 CO 0.17 -2.17 2.08 -1.00 -0.01 0.00 0.00 175.02 174.09 1o8t h PRO 10 N -1.50 0.38 0.34 2.03 0.13 -1.93 -1.86 132.00 129.59 1o8t h PRO 10 Ca -0.48 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1o8t h PRO 10 Cb 1.27 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1o8t h PRO 10 CO 0.53 0.25 -0.16 0.77 -0.23 0.00 0.00 178.00 179.16 1o8t h SER 11 N 0.39 -0.39 -0.62 1.44 0.02 -1.99 -3.34 113.55 109.06 1o8t h SER 11 Ca 0.12 -0.02 0.12 0.00 -0.84 0.00 0.00 61.79 61.16 1o8t h SER 11 Cb -0.00 0.10 -0.09 0.00 0.14 0.00 0.00 62.40 62.55 1o8t h SER 11 CO -0.03 0.07 0.16 -0.65 -1.14 0.00 0.00 176.83 175.23 1o8t h PRO 12 N -1.10 0.28 -6.62 3.45 0.11 -1.93 -3.40 132.00 122.79 1o8t h PRO 12 Ca -0.05 -0.02 -0.52 0.00 0.11 0.00 0.00 66.00 65.52 1o8t h PRO 12 Cb 0.38 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 31.45 1o8t h PRO 12 CO 0.08 0.19 0.60 0.99 -0.21 0.00 0.00 178.00 179.64 1o8t s THR 13 N -6.09 3.55 -0.03 -1.15 2.01 -0.70 -4.95 115.64 108.27 1o8t s THR 13 Ca -0.13 1.23 -0.01 0.00 0.31 0.00 0.00 61.69 63.08 1o8t s THR 13 Cb 0.18 -3.79 -0.27 0.00 0.01 0.00 0.00 72.50 68.64 1o8t s THR 13 CO 0.74 0.16 0.71 -0.26 -0.69 0.00 0.00 174.62 175.29 1o8t h PHE 14 N 5.76 0.39 -0.68 4.92 -1.00 -1.83 -3.34 116.94 121.15 1o8t h PHE 14 Ca -0.44 -0.29 -0.03 0.00 2.81 0.00 0.00 57.97 60.03 1o8t h PHE 14 Cb 1.21 -0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.73 1o8t h PHE 14 CO 0.63 1.42 0.32 1.25 -1.61 0.00 0.00 178.31 180.32 1o8t h LEU 15 N 0.06 0.90 -0.79 1.54 5.85 -1.92 -2.73 115.31 118.22 1o8t h LEU 15 Ca -0.29 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.34 1o8t h LEU 15 Cb 2.02 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.77 1o8t h LEU 15 CO 0.13 0.79 0.49 0.71 -0.34 0.00 0.00 178.44 180.22 1o8t h THR 16 N 0.96 1.07 -0.42 1.05 1.35 -1.85 -2.61 112.91 112.45 1o8t h THR 16 Ca 0.23 -0.32 -0.01 0.00 -0.55 0.00 0.00 66.41 65.77 1o8t h THR 16 Cb 0.13 0.06 -0.02 0.00 -1.73 0.00 0.00 68.15 66.59 1o8t h THR 16 CO -0.03 0.17 0.21 1.56 -0.25 0.00 0.00 175.52 177.18 1o8t h GLN 17 N 0.92 0.59 -0.51 4.72 1.08 -1.62 -3.20 115.11 117.09 1o8t h GLN 17 Ca 0.33 -0.08 0.14 0.00 -1.45 0.00 0.00 58.65 57.59 1o8t h GLN 17 Cb 0.10 -0.11 -0.09 0.00 -0.05 0.00 0.00 27.48 27.32 1o8t h GLN 17 CO -0.15 0.50 -0.00 0.28 -0.95 0.00 0.00 178.83 178.51 1o8t n VAL 18 N -4.70 -0.21 -0.10 -0.54 0.31 -0.98 0.33 118.33 112.44 1o8t n VAL 18 Ca 0.00 1.12 -0.06 0.00 -0.01 0.00 0.00 64.34 65.40 1o8t n VAL 18 Cb 0.10 -1.63 0.01 0.00 -0.91 0.00 0.00 33.84 31.41 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 -0.07 -0.05 5.55 1.79 -1.69 -0.04 116.57 122.06 1o8t h LYS 19 Ca 0.30 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.73 1o8t h LYS 19 Cb 0.61 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.27 1o8t h LYS 19 CO -0.48 -0.05 -0.18 0.93 -1.08 0.00 0.00 179.45 178.59 1o8t h GLU 20 N -0.07 0.08 -0.32 3.15 3.07 -0.34 -2.25 114.58 117.90 1o8t h GLU 20 Ca 0.18 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.99 1o8t h GLU 20 Cb 0.35 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.23 1o8t h GLU 20 CO -0.42 0.26 0.05 1.03 -1.40 0.00 0.00 179.01 178.54 1o8t h SER 21 N 0.07 0.43 0.01 1.42 0.87 -0.77 -1.61 113.55 113.98 1o8t h SER 21 Ca 0.01 -0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1o8t h SER 21 Cb 0.37 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1o8t h SER 21 CO 0.03 0.46 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.71 1o8t h LEU 22 N 0.46 -0.01 -0.33 2.23 3.38 -0.77 -2.38 115.31 117.89 1o8t h LEU 22 Ca 0.11 -0.54 0.02 0.00 0.09 0.00 0.00 57.88 57.56 1o8t h LEU 22 Cb 0.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1o8t h LEU 22 CO 0.00 0.53 0.19 0.77 0.09 0.00 0.00 178.44 180.02 1o8t h SER 23 N -0.57 0.30 0.41 -0.43 4.64 -1.43 -0.80 113.55 115.67 1o8t h SER 23 Ca -0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1o8t h SER 23 Cb 0.55 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1o8t h SER 23 CO 0.00 0.22 -0.01 0.28 -0.87 0.00 0.00 176.83 176.45 1o8t h SER 24 N 0.38 0.00 0.11 4.97 0.02 -1.36 -1.97 113.55 115.69 1o8t h SER 24 Ca 0.13 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.93 1o8t h SER 24 Cb 0.01 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.56 1o8t h SER 24 CO -0.07 0.01 -0.69 0.22 -1.14 0.00 0.00 176.83 175.16 1o8t h TYR 25 N 0.00 0.41 -0.30 3.45 5.03 -0.64 -3.33 116.97 121.59 1o8t h TYR 25 Ca -0.00 -0.30 -0.05 0.00 2.58 0.00 0.00 58.73 60.97 1o8t h TYR 25 Cb 0.21 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.46 1o8t h TYR 25 CO 0.00 1.27 -0.02 -1.49 -1.32 0.00 0.00 178.16 176.60 1o8t h TRP 26 N -0.52 0.47 -0.92 -3.82 -0.00 -0.87 -0.34 115.95 109.95 1o8t h TRP 26 Ca -0.13 -0.04 0.09 0.00 -0.00 0.00 0.00 58.89 58.80 1o8t h TRP 26 Cb 1.50 -0.14 -0.12 0.00 -0.00 0.00 0.00 29.16 30.41 1o8t h TRP 26 CO 0.21 0.48 -0.58 0.93 -0.00 0.00 0.00 178.44 179.48 1o8t h GLU 27 N 0.44 -0.05 -0.11 0.49 5.08 -1.47 -0.35 114.58 118.61 1o8t h GLU 27 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 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 0.01 -0.03 0.00 0.43 -1.00 0.00 0.00 179.01 178.42 1o8t n SER 28 N -5.27 2.96 -0.34 1.42 7.64 -1.20 -4.42 113.62 114.42 1o8t n SER 28 Ca 0.01 -1.96 -0.03 0.00 1.01 0.00 0.00 58.87 57.91 1o8t n SER 28 Cb 0.27 -0.06 0.09 0.00 -1.01 0.00 0.00 64.21 63.51 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 4.63 1.16 -0.08 -0.43 0.00 0.77 -2.99 119.26 122.31 1o8t h ALA 29 Ca 0.00 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1o8t h ALA 29 Cb 0.95 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1o8t h ALA 29 CO 0.00 0.60 -0.25 -0.22 0.00 0.00 0.00 179.25 179.39 1o8t h LYS 30 N 1.25 -0.33 -1.01 0.00 3.64 -1.76 -0.29 116.57 118.08 1o8t h LYS 30 Ca 0.33 0.02 0.25 0.00 -1.27 0.00 0.00 60.65 59.98 1o8t h LYS 30 Cb -0.08 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 31.69 1o8t h LYS 30 CO -0.06 -0.22 0.61 1.15 -2.27 0.00 0.00 179.45 178.66 1o8t h THR 31 N -0.34 0.53 -0.44 1.00 2.02 -1.83 0.36 112.91 114.21 1o8t h THR 31 Ca 0.09 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 1o8t h THR 31 Cb 0.46 -0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1o8t h THR 31 CO -0.28 0.10 0.20 0.00 0.37 0.00 0.00 175.52 175.92 1o8t h ALA 32 N 1.71 0.57 -0.29 6.16 0.00 -1.02 -0.75 119.26 125.64 1o8t h ALA 32 Ca 0.64 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.49 1o8t h ALA 32 Cb 1.28 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 1o8t h ALA 32 CO -0.44 0.14 -0.36 0.00 0.00 0.00 0.00 179.25 178.58 1o8t h ALA 33 N 1.05 -0.35 -0.53 0.00 0.00 0.77 0.44 119.26 120.64 1o8t h ALA 33 Ca 0.15 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1o8t h ALA 33 Cb 0.13 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1o8t h ALA 33 CO -0.02 -0.80 0.08 1.96 0.00 0.00 0.00 179.25 180.47 1o8t h GLN 34 N -0.34 0.85 0.00 0.00 4.20 -1.40 -1.95 115.11 116.47 1o8t h GLN 34 Ca 0.13 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 1o8t h GLN 34 Cb 0.56 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 1o8t h GLN 34 CO -0.48 0.80 -0.07 -0.97 -0.67 0.00 0.00 178.83 177.44 1o8t h ASN 35 N 0.80 0.00 -0.43 1.46 -1.24 0.50 -1.52 115.58 115.16 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 39.38 1o8t h ASN 35 CO 0.01 0.07 0.15 0.25 -1.29 0.00 0.00 177.43 176.63 1o8t h LEU 36 N 0.00 0.16 -0.97 0.34 6.46 0.62 0.16 115.31 122.08 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 0.14 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.07 1o8t h LEU 36 CO 0.01 0.13 0.21 0.22 -0.62 0.00 0.00 178.44 178.38 1o8t h TYR 37 N 0.32 0.97 0.75 1.25 3.20 -1.33 -2.76 116.97 119.37 1o8t h TYR 37 Ca 0.20 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 1o8t h TYR 37 Cb 0.19 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 1o8t h TYR 37 CO -0.15 0.77 -0.49 1.49 -1.64 0.00 0.00 178.16 178.14 1o8t h GLU 38 N 0.92 -1.13 0.00 1.82 4.22 -0.23 -2.39 114.58 117.80 1o8t h GLU 38 Ca 0.21 0.08 0.00 0.00 0.08 0.00 0.00 59.36 59.73 1o8t h GLU 38 Cb 0.25 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1o8t h GLU 38 CO -0.01 -0.75 0.00 0.36 -2.18 0.00 0.00 179.01 176.43 1o8t n LYS 39 N -5.62 0.02 0.23 1.92 2.85 0.32 -2.87 118.16 115.01 1o8t n LYS 39 Ca -0.14 0.38 -0.14 0.00 -1.05 0.00 0.00 58.31 57.35 1o8t n LYS 39 Cb 0.50 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 33.30 1o8t n LYS 39 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1o8t h THR 40 N 0.00 0.47 -0.57 0.58 2.02 -1.12 -3.23 112.91 111.06 1o8t h THR 40 Ca 0.00 -0.43 -0.09 0.00 0.77 0.00 0.00 66.41 66.66 1o8t h THR 40 Cb 0.06 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1o8t h THR 40 CO 0.00 0.07 -0.01 1.88 0.37 0.00 0.00 175.52 177.83 1o8t h TYR 41 N -0.89 1.08 -3.61 3.16 0.05 -1.62 -3.44 116.97 111.70 1o8t h TYR 41 Ca -0.06 -0.18 -0.52 0.00 0.05 0.00 0.00 58.73 58.02 1o8t h TYR 41 Cb 0.57 -0.28 0.04 0.00 1.01 0.00 0.00 36.73 38.07 1o8t h TYR 41 CO 0.01 0.96 0.61 -0.51 -1.05 0.00 0.00 178.16 178.18 1o8t s LEU 42 N -9.27 4.45 -0.36 3.88 1.02 -1.20 -4.94 118.68 112.26 1o8t s LEU 42 Ca -0.11 2.46 -0.01 0.00 0.02 0.00 0.00 54.13 56.49 1o8t s LEU 42 Cb 0.14 -3.62 0.27 0.00 0.02 0.00 0.00 46.19 42.99 1o8t s LEU 42 CO 0.85 -0.46 1.95 -0.81 0.02 0.00 0.00 176.35 177.90 1o8t n PRO 43 N 1.81 1.91 0.20 1.29 -0.04 -1.26 -4.55 135.00 134.35 1o8t n PRO 43 Ca 0.03 -1.81 0.14 0.00 -0.04 0.00 0.00 63.50 61.82 1o8t n PRO 43 Cb 0.43 -1.71 0.67 0.00 -0.04 0.00 0.00 33.50 32.84 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 1.54 1.00 -0.95 0.55 0.00 -1.92 -3.28 119.26 116.20 1o8t h ALA 44 Ca 0.34 0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.47 1o8t h ALA 44 Cb 1.06 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.67 1o8t h ALA 44 CO 0.85 0.00 -0.10 -0.39 0.00 0.00 0.00 179.25 179.61 1o8t h VAL 45 N 0.00 0.06 0.12 0.00 -1.51 -1.92 0.65 116.25 113.66 1o8t h VAL 45 Ca 0.00 -0.00 -0.27 0.00 -1.23 0.00 0.00 66.70 65.19 1o8t h VAL 45 Cb 0.23 0.05 0.01 0.00 -2.13 0.00 0.00 31.29 29.45 1o8t h VAL 45 CO 0.00 0.00 -1.23 0.44 -1.23 0.00 0.00 177.57 175.55 1o8t h ASP 46 N 0.01 0.46 0.42 4.19 3.32 -1.98 -3.09 116.42 119.75 1o8t h ASP 46 Ca 0.51 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 1o8t h ASP 46 Cb 0.92 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1o8t h ASP 46 CO -0.93 1.36 -0.20 -0.33 -1.72 0.00 0.00 179.24 177.43 1o8t h GLU 47 N 0.09 -0.54 -0.13 3.56 3.07 -0.96 -2.93 114.58 116.74 1o8t h GLU 47 Ca -0.14 0.04 0.04 0.00 -0.50 0.00 0.00 59.36 58.80 1o8t h GLU 47 Cb 1.95 0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 29.97 1o8t h GLU 47 CO 0.20 -0.23 0.12 -0.22 -1.40 0.00 0.00 179.01 177.48 1o8t h LYS 48 N -0.94 0.00 0.69 2.33 3.64 0.00 0.23 116.57 122.52 1o8t h LYS 48 Ca -0.06 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1o8t h LYS 48 Cb 0.56 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1o8t h LYS 48 CO 0.09 0.00 -0.33 1.25 -2.27 0.00 0.00 179.45 178.19 1o8t h LEU 49 N 0.00 -0.78 -1.49 5.20 5.85 -1.47 -0.98 115.31 121.63 1o8t h LEU 49 Ca 0.06 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1o8t h LEU 49 Cb 0.29 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1o8t h LEU 49 CO -0.00 -0.49 -0.04 -0.09 -0.34 0.00 0.00 178.44 177.48 1o8t h ARG 50 N -1.06 0.28 0.44 1.25 9.65 -1.31 -1.91 114.38 121.72 1o8t h ARG 50 Ca -0.09 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.72 1o8t h ARG 50 Cb 0.71 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 1o8t h ARG 50 CO 0.15 0.34 -0.35 0.22 2.80 0.00 0.00 179.97 183.13 1o8t h ASP 51 N 0.27 -0.94 0.52 -3.80 3.58 -0.40 -1.55 116.42 114.10 1o8t h ASP 51 Ca 0.06 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 1o8t h ASP 51 Cb 0.25 0.30 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 1o8t h ASP 51 CO 0.01 -0.50 -0.04 0.17 -2.88 0.00 0.00 179.24 176.00 1o8t h LEU 52 N -0.77 0.00 -0.01 2.28 8.10 -1.13 -2.97 115.31 120.82 1o8t h LEU 52 Ca -0.06 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.93 1o8t h LEU 52 Cb 0.64 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.86 1o8t h LEU 52 CO 0.00 0.04 -0.00 0.22 -4.11 0.00 0.00 178.44 174.60 1o8t h TYR 53 N 0.00 0.02 -0.44 0.17 5.03 -0.90 -0.24 116.97 120.60 1o8t h TYR 53 Ca -0.00 -0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 1o8t h TYR 53 Cb 0.32 -0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.57 1o8t h TYR 53 CO 0.00 0.39 0.26 0.66 -1.32 0.00 0.00 178.16 178.14 1o8t h SER 54 N -0.36 0.54 -0.28 -2.11 4.64 -1.14 -2.19 113.55 112.65 1o8t h SER 54 Ca 0.00 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 1o8t h SER 54 Cb 0.38 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 1o8t h SER 54 CO 0.00 0.45 0.15 0.11 -0.87 0.00 0.00 176.83 176.67 1o8t h LYS 55 N 0.58 0.39 0.00 4.77 6.56 -1.54 -2.40 116.57 124.93 1o8t h LYS 55 Ca 0.16 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.70 1o8t h LYS 55 Cb 0.02 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 31.60 1o8t h LYS 55 CO -0.03 0.35 0.00 0.77 -2.06 0.00 0.00 179.45 178.48 1o8t h SER 56 N 0.33 0.00 0.35 0.86 0.02 -0.80 -2.04 113.55 112.27 1o8t h SER 56 Ca 0.10 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1o8t h SER 56 Cb 0.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1o8t h SER 56 CO -0.01 0.00 -0.24 0.74 -1.14 0.00 0.00 176.83 176.17 1o8t h THR 57 N 0.00 0.49 0.11 -2.27 2.02 -0.86 -0.62 112.91 111.77 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 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1o8t h THR 57 CO 0.00 0.00 -1.63 0.00 0.37 0.00 0.00 175.52 174.26 1o8t h ALA 58 N 0.01 0.28 0.78 6.16 0.00 -1.69 -3.26 119.26 121.55 1o8t h ALA 58 Ca -0.03 -1.23 -0.04 0.00 0.00 0.00 0.00 54.91 53.61 1o8t h ALA 58 Cb 0.50 0.61 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1o8t h ALA 58 CO 0.01 1.00 -0.38 0.00 0.00 0.00 0.00 179.25 179.89 1o8t h ALA 59 N -0.07 -1.15 0.00 0.00 0.00 -1.46 -3.06 119.26 113.52 1o8t h ALA 59 Ca -0.36 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 1o8t h ALA 59 Cb 1.81 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 20.01 1o8t h ALA 59 CO 0.03 -1.08 -0.02 1.98 0.00 0.00 0.00 179.25 180.17 1o8t h MET 60 N -1.16 0.00 0.00 0.00 4.05 -1.29 -1.86 114.93 114.67 1o8t h MET 60 Ca -0.11 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.31 1o8t h MET 60 Cb 0.80 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 1o8t h MET 60 CO 0.18 0.02 0.00 0.77 0.23 0.00 0.00 176.91 178.10 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.02 -1.50 0.33 113.55 113.79 1o8t h SER 61 Ca -0.00 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.65 1o8t h SER 61 Cb 0.10 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 1o8t h SER 61 CO 0.00 0.00 -1.83 0.41 -1.14 0.00 0.00 176.83 174.27 1o8t n THR 62 N -2.33 1.52 0.31 -2.27 -1.04 -0.70 -4.13 114.28 105.64 1o8t n THR 62 Ca 0.01 -0.17 0.20 0.00 -2.04 0.00 0.00 64.05 62.05 1o8t n THR 62 Cb 0.18 -2.03 0.94 0.00 -1.82 0.00 0.00 70.33 67.60 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 -1.00 0.00 0.50 -1.42 0.05 -1.53 -0.59 116.97 112.98 1o8t h TYR 63 Ca -0.46 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.30 1o8t h TYR 63 Cb 1.36 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.11 1o8t h TYR 63 CO -0.10 0.00 -0.24 1.15 -1.05 0.00 0.00 178.16 177.92 1o8t h THR 64 N 0.00 0.08 -0.68 -2.88 2.02 -1.12 0.59 112.91 110.93 1o8t h THR 64 Ca 0.00 -0.52 -0.05 0.00 0.77 0.00 0.00 66.41 66.62 1o8t h THR 64 Cb 0.26 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.77 1o8t h THR 64 CO 0.00 0.02 0.24 1.23 0.37 0.00 0.00 175.52 177.38 1o8t h GLY 65 N -1.15 1.09 0.83 2.16 0.00 -1.69 -1.14 103.07 103.17 1o8t h GLY 65 Ca -0.07 -0.60 -0.04 0.00 0.00 0.00 0.00 47.33 46.62 1o8t h GLY 65 CO 0.11 0.57 -0.37 -2.22 0.00 0.00 0.00 176.54 174.63 1o8t h ILE 66 N 0.99 0.10 -0.16 2.60 1.08 -1.14 0.12 117.51 121.09 1o8t h ILE 66 Ca 0.23 -0.21 0.05 0.00 -0.39 0.00 0.00 64.86 64.54 1o8t h ILE 66 Cb 0.24 0.12 -0.07 0.00 -3.07 0.00 0.00 36.82 34.04 1o8t h ILE 66 CO -0.01 0.01 -0.36 0.15 -0.69 0.00 0.00 178.15 177.25 1o8t h PHE 67 N -1.21 -1.01 0.00 1.37 3.57 0.24 0.30 116.94 120.20 1o8t h PHE 67 Ca -0.10 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1o8t h PHE 67 Cb 0.80 0.47 -0.00 0.00 2.79 0.00 0.00 35.95 40.01 1o8t h PHE 67 CO -0.00 -0.43 -0.03 1.15 -2.23 0.00 0.00 178.31 176.77 1o8t h THR 68 N -0.42 0.14 0.58 4.41 2.02 -1.26 -2.89 112.91 115.49 1o8t h THR 68 Ca 0.10 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 1o8t h THR 68 Cb 0.58 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 1o8t h THR 68 CO -0.39 0.03 -0.42 -0.78 0.37 0.00 0.00 175.52 174.33 1o8t h ASP 69 N 0.00 -1.08 0.75 4.18 1.82 0.14 0.20 116.42 122.43 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 0.26 0.33 -0.01 0.00 0.68 0.00 0.00 39.33 40.60 1o8t h ASP 69 CO 0.00 -0.62 -0.24 1.56 -1.61 0.00 0.00 179.24 178.33 1o8t h GLN 70 N -0.96 0.00 0.30 0.28 4.20 -1.46 -1.96 115.11 115.52 1o8t h GLN 70 Ca -0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 1o8t h GLN 70 Cb 0.80 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 1o8t h GLN 70 CO 0.03 0.24 -0.15 0.28 -0.67 0.00 0.00 178.83 178.57 1o8t h VAL 71 N 0.00 0.67 -0.68 -0.54 2.07 -1.25 -2.40 116.25 114.11 1o8t h VAL 71 Ca -0.00 -0.66 0.08 0.00 0.82 0.00 0.00 66.70 66.94 1o8t h VAL 71 Cb 0.68 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1o8t h VAL 71 CO 0.03 0.12 0.45 0.25 0.02 0.00 0.00 177.57 178.44 1o8t h LEU 72 N -0.80 0.56 -1.33 2.57 5.85 -0.57 0.16 115.31 121.76 1o8t h LEU 72 Ca -0.04 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.74 1o8t h LEU 72 Cb 0.51 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1o8t h LEU 72 CO 0.07 0.35 0.50 -1.28 -0.34 0.00 0.00 178.44 177.74 1o8t h SER 73 N 0.63 0.73 1.12 1.25 0.87 -1.15 0.12 113.55 117.13 1o8t h SER 73 Ca 0.30 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1o8t h SER 73 Cb 0.37 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 1o8t h SER 73 CO -0.10 0.48 0.00 0.58 -0.53 0.00 0.00 176.83 177.26 1o8t h VAL 74 N 0.83 0.00 -0.53 2.23 2.07 -0.45 -2.87 116.25 117.53 1o8t h VAL 74 Ca 0.32 -0.55 -0.06 0.00 0.82 0.00 0.00 66.70 67.22 1o8t h VAL 74 Cb 0.20 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1o8t h VAL 74 CO -0.11 0.00 0.07 0.25 0.02 0.00 0.00 177.57 177.81 1o8t h LEU 75 N 0.00 0.79 -0.34 2.57 5.85 -0.56 -2.18 115.31 121.45 1o8t h LEU 75 Ca 0.00 -0.17 -0.18 0.00 0.84 0.00 0.00 57.88 58.37 1o8t h LEU 75 Cb 0.56 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1o8t h LEU 75 CO 0.00 0.82 -0.54 0.11 -0.34 0.00 0.00 178.44 178.49 1o8t h LYS 76 N 0.80 0.84 0.00 1.25 1.79 -1.48 -1.98 116.57 117.79 1o8t h LYS 76 Ca 0.17 -0.53 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 1o8t h LYS 76 Cb 0.37 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1o8t h LYS 76 CO 0.01 1.16 0.00 0.41 -1.08 0.00 0.00 179.45 179.95 1o8t n GLY 77 N 0.33 -2.40 0.89 3.86 0.00 -1.08 -4.63 105.19 102.16 1o8t n GLY 77 Ca -0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.02 1o8t n GLY 77 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1o8t n GLU 78 N -0.97 0.45 -0.76 1.61 -0.00 -1.06 -5.13 120.64 114.78 1o8t n GLU 78 Ca 0.00 -2.04 0.00 0.00 -0.00 0.00 0.00 57.16 55.12 1o8t n GLU 78 Cb 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 31.44 30.82 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22