#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 -0.38 -2.49 -2.82 -0.00 -2.10 -3.39 115.11 103.92 1o8t h GLN 2 Ca 0.00 0.03 -0.59 0.00 -0.00 0.00 0.00 58.65 58.08 1o8t h GLN 2 Cb 0.00 0.09 -0.40 0.00 0.00 0.00 0.00 27.48 27.17 1o8t h GLN 2 CO 0.00 -0.05 -0.84 0.94 0.00 0.00 0.00 178.83 178.88 1o8t n GLN 3 N -5.11 1.00 0.00 1.69 -0.06 -1.26 -4.95 117.38 108.69 1o8t n GLN 3 Ca -0.09 -3.72 0.00 0.00 -2.00 0.00 0.00 57.00 51.18 1o8t n GLN 3 Cb 0.26 -1.84 0.00 0.00 -4.06 0.00 0.00 30.24 24.61 1o8t n GLN 3 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1o8t n PRO 4 N 2.14 0.83 -1.39 3.69 -0.04 -1.26 -4.88 135.00 134.10 1o8t n PRO 4 Ca 0.26 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.42 1o8t n PRO 4 Cb 0.44 -1.05 0.11 0.00 -0.04 0.00 0.00 33.50 32.97 1o8t n PRO 4 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1o8t s GLN 5 N -1.89 1.68 1.24 0.54 1.11 -1.26 -5.04 119.66 116.03 1o8t s GLN 5 Ca 0.00 0.72 -0.19 0.00 0.01 0.00 0.00 55.36 55.90 1o8t s GLN 5 Cb 0.00 -1.87 0.30 0.00 -1.01 0.00 0.00 33.01 30.43 1o8t s GLN 5 CO 0.00 -1.92 1.07 1.14 0.01 0.00 0.00 175.29 175.59 1o8t s GLN 6 N -5.05 -1.49 0.86 2.91 -2.07 -1.26 -5.02 119.66 108.54 1o8t s GLN 6 Ca 0.62 0.04 -0.11 0.00 -1.82 0.00 0.00 55.36 54.08 1o8t s GLN 6 Cb -0.16 -1.56 0.11 0.00 -1.09 0.00 0.00 33.01 30.31 1o8t s GLN 6 CO 0.55 -3.91 1.09 0.34 -1.32 0.00 0.00 175.29 172.05 1o8t s ASP 7 N -3.66 3.80 0.37 12.60 2.15 -1.26 -5.00 116.67 125.66 1o8t s ASP 7 Ca 0.70 1.46 -0.27 0.00 0.43 0.00 0.00 52.55 54.87 1o8t s ASP 7 Cb -0.11 -2.15 -0.09 0.00 -0.30 0.00 0.00 42.92 40.26 1o8t s ASP 7 CO 0.57 -2.43 1.19 -1.61 -0.17 0.00 0.00 175.17 172.72 1o8t s GLU 8 N -4.99 4.21 0.05 4.34 8.01 -1.26 -4.97 118.70 124.09 1o8t s GLU 8 Ca 0.63 1.92 -0.31 0.00 0.01 0.00 0.00 54.97 57.22 1o8t s GLU 8 Cb -0.17 -2.85 -0.07 0.00 -4.31 0.00 0.00 34.13 26.74 1o8t s GLU 8 CO 0.56 -0.21 1.45 1.41 0.01 0.00 0.00 175.26 178.48 1o8t s MET 9 N -2.05 4.27 0.00 1.61 1.75 -1.26 -5.02 119.30 118.60 1o8t s MET 9 Ca 0.53 2.07 0.00 0.00 -1.25 0.00 0.00 55.69 57.04 1o8t s MET 9 Cb -0.33 -3.49 0.00 0.00 2.84 0.00 0.00 34.83 33.85 1o8t s MET 9 CO 0.42 -0.57 0.00 -0.35 -0.65 0.00 0.00 175.02 173.87 1o8t n PRO 10 N 5.02 -0.36 -2.30 4.11 -0.04 -1.26 -4.95 135.00 135.23 1o8t n PRO 10 Ca 0.13 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.17 1o8t n PRO 10 Cb 0.43 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.86 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 -1.37 6.78 1.38 3.54 0.01 -1.26 -5.01 113.70 117.76 1o8t s SER 11 Ca 0.00 1.73 -0.23 0.00 1.31 0.00 0.00 55.95 58.76 1o8t s SER 11 Cb 0.00 -2.54 0.35 0.00 0.21 0.00 0.00 66.02 64.05 1o8t s SER 11 CO 0.00 -0.90 0.99 -2.84 0.41 0.00 0.00 173.24 170.90 1o8t s PRO 12 N 3.86 -2.61 -1.17 12.44 0.02 -1.26 -4.77 135.00 141.50 1o8t s PRO 12 Ca 0.61 -0.06 -0.22 0.00 0.02 0.00 0.00 61.00 61.35 1o8t s PRO 12 Cb -0.24 -1.43 -0.07 0.00 0.02 0.00 0.00 34.50 32.79 1o8t s PRO 12 CO 0.21 -4.63 1.90 0.25 -0.33 0.00 0.00 177.00 174.40 1o8t n THR 13 N -5.42 2.31 0.07 0.99 -2.24 -1.26 -3.69 114.28 105.04 1o8t n THR 13 Ca 0.15 -2.36 0.00 0.00 -2.27 0.00 0.00 64.05 59.56 1o8t n THR 13 Cb 0.60 -2.23 0.00 0.00 -2.10 0.00 0.00 70.33 66.61 1o8t n THR 13 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1o8t n PHE 14 N 12.39 -2.55 0.19 4.78 7.35 -1.26 -4.92 117.46 133.45 1o8t n PHE 14 Ca 0.46 0.45 -0.15 0.00 -0.76 0.00 0.00 57.45 57.46 1o8t n PHE 14 Cb 0.46 1.36 -0.08 0.00 0.35 0.00 0.00 39.48 41.57 1o8t n PHE 14 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1o8t h LEU 15 N 0.00 -0.38 -1.20 -2.13 -0.00 -1.91 -1.83 115.31 107.85 1o8t h LEU 15 Ca 0.00 -0.07 0.06 0.00 -0.00 0.00 0.00 57.88 57.87 1o8t h LEU 15 Cb 0.00 0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 40.71 1o8t h LEU 15 CO 0.00 -0.17 0.56 0.74 -0.00 0.00 0.00 178.44 179.57 1o8t h THR 16 N -0.58 1.07 -0.30 0.22 2.02 -1.86 -2.45 112.91 111.03 1o8t h THR 16 Ca -0.05 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.79 1o8t h THR 16 Cb 0.42 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1o8t h THR 16 CO 0.08 0.18 0.16 1.56 0.37 0.00 0.00 175.52 177.86 1o8t h GLN 17 N 0.98 0.43 -0.48 6.66 7.50 -1.80 -3.24 115.11 125.17 1o8t h GLN 17 Ca 0.36 -0.06 0.07 0.00 0.50 0.00 0.00 58.65 59.52 1o8t h GLN 17 Cb 0.18 -0.08 -0.07 0.00 0.05 0.00 0.00 27.48 27.55 1o8t h GLN 17 CO -0.13 0.39 -0.21 0.28 -1.50 0.00 0.00 178.83 177.66 1o8t n VAL 18 N -4.79 -0.27 0.02 -0.54 0.31 -0.71 0.29 118.33 112.64 1o8t n VAL 18 Ca -0.02 1.12 -0.11 0.00 -0.01 0.00 0.00 64.34 65.33 1o8t n VAL 18 Cb 0.09 -1.46 -0.05 0.00 -0.91 0.00 0.00 33.84 31.51 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 -0.42 0.00 5.55 6.56 -1.70 -0.61 116.57 125.95 1o8t h LYS 19 Ca 0.15 0.03 -0.04 0.00 -1.06 0.00 0.00 60.65 59.73 1o8t h LYS 19 Cb 0.26 0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.02 1o8t h LYS 19 CO -0.47 -0.28 -0.18 0.93 -2.06 0.00 0.00 179.45 177.39 1o8t h GLU 20 N -0.44 0.00 -0.28 3.15 3.07 -0.33 -1.99 114.58 117.76 1o8t h GLU 20 Ca 0.08 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.93 1o8t h GLU 20 Cb 0.57 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1o8t h GLU 20 CO -0.34 0.18 0.13 1.03 -1.40 0.00 0.00 179.01 178.61 1o8t h SER 21 N 0.00 0.38 -0.30 1.42 0.87 0.68 -0.68 113.55 115.92 1o8t h SER 21 Ca -0.00 -0.14 -0.18 0.00 -1.23 0.00 0.00 61.79 60.24 1o8t h SER 21 Cb 0.35 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1o8t h SER 21 CO 0.02 0.42 -0.50 -0.07 -0.53 0.00 0.00 176.83 176.18 1o8t h LEU 22 N 0.32 0.96 0.27 2.23 4.07 -0.97 -2.43 115.31 119.76 1o8t h LEU 22 Ca 0.10 -0.52 -0.01 0.00 0.08 0.00 0.00 57.88 57.53 1o8t h LEU 22 Cb 0.15 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.61 1o8t h LEU 22 CO -0.01 1.30 -0.17 0.28 -1.08 0.00 0.00 178.44 178.76 1o8t h SER 23 N 0.66 -0.43 0.39 -0.43 0.02 -1.26 -1.29 113.55 111.21 1o8t h SER 23 Ca 0.02 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1o8t h SER 23 Cb 1.10 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.77 1o8t h SER 23 CO 0.11 -0.27 0.00 0.28 -1.14 0.00 0.00 176.83 175.81 1o8t h SER 24 N -0.43 0.00 0.03 3.07 0.02 -1.17 -2.48 113.55 112.59 1o8t h SER 24 Ca -0.03 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.72 1o8t h SER 24 Cb 0.36 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.92 1o8t h SER 24 CO 0.02 0.00 -0.81 0.22 -1.14 0.00 0.00 176.83 175.12 1o8t h TYR 25 N 0.00 0.76 -0.53 3.45 5.03 -0.76 -3.29 116.97 121.63 1o8t h TYR 25 Ca 0.00 -0.43 -0.05 0.00 2.58 0.00 0.00 58.73 60.82 1o8t h TYR 25 Cb 0.19 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.37 1o8t h TYR 25 CO 0.00 1.27 0.12 2.35 -1.32 0.00 0.00 178.16 180.58 1o8t h TRP 26 N 0.04 0.85 -0.85 -3.82 7.01 -0.82 -0.14 115.95 118.20 1o8t h TRP 26 Ca -0.11 -0.08 0.08 0.00 2.11 0.00 0.00 58.89 60.89 1o8t h TRP 26 Cb 1.51 -0.25 -0.11 0.00 -2.10 0.00 0.00 29.16 28.22 1o8t h TRP 26 CO 0.14 0.72 -0.55 1.49 -2.79 0.00 0.00 178.44 177.45 1o8t h GLU 27 N 0.79 -0.05 -0.00 2.65 4.22 -1.57 0.11 114.58 120.72 1o8t h GLU 27 Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.62 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 -0.04 -0.42 0.43 -2.18 0.00 0.00 179.01 176.81 1o8t n SER 28 N -5.12 0.55 0.27 1.04 7.64 -1.20 -4.02 113.62 112.77 1o8t n SER 28 Ca 0.01 -0.31 0.10 0.00 1.01 0.00 0.00 58.87 59.68 1o8t n SER 28 Cb 0.26 0.17 0.71 0.00 -1.01 0.00 0.00 64.21 64.34 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 3.12 1.79 -0.22 -0.43 0.00 0.12 -2.85 119.26 120.78 1o8t h ALA 29 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1o8t h ALA 29 Cb 0.50 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1o8t h ALA 29 CO 0.00 0.03 -0.15 -0.22 0.00 0.00 0.00 179.25 178.91 1o8t h LYS 30 N 0.00 -0.14 -1.01 0.00 3.11 -1.65 0.11 116.57 117.00 1o8t h LYS 30 Ca -0.00 0.01 0.25 0.00 -2.81 0.00 0.00 60.65 58.10 1o8t h LYS 30 Cb 0.05 0.03 -0.12 0.00 -1.00 0.00 0.00 32.23 31.19 1o8t h LYS 30 CO 0.00 -0.09 0.60 1.15 -2.81 0.00 0.00 179.45 178.30 1o8t h THR 31 N -0.15 0.54 -0.47 1.00 2.02 -1.80 0.40 112.91 114.45 1o8t h THR 31 Ca 0.13 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1o8t h THR 31 Cb 0.34 -0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.63 1o8t h THR 31 CO -0.31 0.11 0.22 0.00 0.37 0.00 0.00 175.52 175.90 1o8t h ALA 32 N 1.73 0.61 -0.34 6.16 0.00 -1.11 -0.91 119.26 125.39 1o8t h ALA 32 Ca 0.64 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.51 1o8t h ALA 32 Cb 1.23 -0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 1o8t h ALA 32 CO -0.47 0.17 -0.32 0.00 0.00 0.00 0.00 179.25 178.63 1o8t h ALA 33 N 1.07 -0.22 -0.58 0.00 0.00 0.76 0.49 119.26 120.77 1o8t h ALA 33 Ca 0.16 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1o8t h ALA 33 Cb 0.13 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1o8t h ALA 33 CO -0.02 -0.74 0.11 1.96 0.00 0.00 0.00 179.25 180.56 1o8t h GLN 34 N -0.28 0.93 0.00 0.00 4.20 -1.36 -1.88 115.11 116.71 1o8t h GLN 34 Ca 0.16 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 1o8t h GLN 34 Cb 0.54 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 1o8t h GLN 34 CO -0.50 0.85 -0.07 -0.97 -0.67 0.00 0.00 178.83 177.47 1o8t h ASN 35 N 0.88 0.00 -0.46 1.46 -0.73 0.43 -1.40 115.58 115.76 1o8t h ASN 35 Ca 0.18 0.00 0.06 0.00 1.87 0.00 0.00 56.30 58.41 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 0.07 0.17 0.25 -0.37 0.00 0.00 177.43 177.56 1o8t h LEU 36 N 0.00 0.19 -0.76 0.34 6.46 0.74 0.31 115.31 122.58 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 0.14 0.29 0.22 -0.62 0.00 0.00 178.44 178.48 1o8t h TYR 37 N 0.35 1.17 0.30 1.25 5.03 -1.29 -2.85 116.97 120.92 1o8t h TYR 37 Ca 0.21 -0.09 -0.00 0.00 2.58 0.00 0.00 58.73 61.43 1o8t h TYR 37 Cb 0.20 -0.35 -0.02 0.00 1.55 0.00 0.00 36.73 38.12 1o8t h TYR 37 CO -0.15 0.90 -0.26 0.93 -1.32 0.00 0.00 178.16 178.26 1o8t h GLU 38 N 1.11 -0.56 0.00 1.82 3.07 -0.33 -1.97 114.58 117.73 1o8t h GLU 38 Ca 0.25 0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1o8t h GLU 38 Cb 0.23 0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1o8t h GLU 38 CO -0.02 -0.37 0.00 1.63 -1.40 0.00 0.00 179.01 178.85 1o8t n LYS 39 N -5.39 0.07 0.19 2.33 5.02 0.86 -2.65 118.16 118.59 1o8t n LYS 39 Ca -0.09 0.53 -0.13 0.00 -2.02 0.00 0.00 58.31 56.60 1o8t n LYS 39 Cb 0.29 -1.71 -0.08 0.00 -0.02 0.00 0.00 35.03 33.51 1o8t n LYS 39 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1o8t h THR 40 N 0.00 0.54 -0.45 -0.18 2.02 -1.12 -3.24 112.91 110.49 1o8t h THR 40 Ca 0.00 -0.58 -0.08 0.00 0.77 0.00 0.00 66.41 66.51 1o8t h THR 40 Cb 0.05 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1o8t h THR 40 CO 0.00 0.10 -0.06 0.22 0.37 0.00 0.00 175.52 176.15 1o8t h TYR 41 N -0.87 0.83 -3.84 3.16 3.20 -1.57 -3.44 116.97 114.43 1o8t h TYR 41 Ca -0.05 -0.13 -0.51 0.00 3.14 0.00 0.00 58.73 61.18 1o8t h TYR 41 Cb 0.54 -0.22 0.03 0.00 1.54 0.00 0.00 36.73 38.62 1o8t h TYR 41 CO 0.02 0.80 0.50 -0.51 -1.64 0.00 0.00 178.16 177.33 1o8t s LEU 42 N -9.08 4.47 -0.19 2.82 1.43 -1.13 -4.95 118.68 112.05 1o8t s LEU 42 Ca -0.09 2.33 0.04 0.00 -1.03 0.00 0.00 54.13 55.38 1o8t s LEU 42 Cb 0.14 -3.71 0.38 0.00 0.03 0.00 0.00 46.19 43.04 1o8t s LEU 42 CO 0.81 -0.28 1.34 -0.81 0.23 0.00 0.00 176.35 177.64 1o8t n PRO 43 N 0.93 2.23 0.20 1.29 -0.04 -1.26 -4.41 135.00 133.94 1o8t n PRO 43 Ca -0.00 -1.59 0.14 0.00 -0.04 0.00 0.00 63.50 62.01 1o8t n PRO 43 Cb 0.45 -1.73 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 2.14 1.00 -0.96 0.55 0.00 -1.92 -3.29 119.26 116.78 1o8t h ALA 44 Ca 0.19 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.29 1o8t h ALA 44 Cb 1.68 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 19.29 1o8t h ALA 44 CO 0.44 0.00 -0.23 -0.39 0.00 0.00 0.00 179.25 179.07 1o8t h VAL 45 N 0.00 0.04 0.08 0.00 -1.51 -1.88 0.52 116.25 113.51 1o8t h VAL 45 Ca 0.00 -0.00 -0.26 0.00 -1.23 0.00 0.00 66.70 65.21 1o8t h VAL 45 Cb 0.24 0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.43 1o8t h VAL 45 CO 0.00 0.00 -1.25 0.44 -1.23 0.00 0.00 177.57 175.53 1o8t h ASP 46 N 0.00 0.27 0.57 4.19 3.32 -1.97 -3.17 116.42 119.63 1o8t h ASP 46 Ca 0.46 -0.31 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1o8t h ASP 46 Cb 0.71 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 40.18 1o8t h ASP 46 CO -0.99 1.25 -0.27 -0.08 -1.72 0.00 0.00 179.24 177.43 1o8t h GLU 47 N 0.05 -0.74 -0.33 3.56 4.57 -1.06 -2.86 114.58 117.77 1o8t h GLU 47 Ca -0.12 0.05 0.10 0.00 -1.18 0.00 0.00 59.36 58.20 1o8t h GLU 47 Cb 1.92 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 30.67 1o8t h GLU 47 CO 0.17 -0.46 0.27 -0.22 -1.18 0.00 0.00 179.01 177.59 1o8t h LYS 48 N -1.15 0.00 0.69 1.92 3.64 -0.26 0.37 116.57 121.79 1o8t h LYS 48 Ca -0.08 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1o8t h LYS 48 Cb 0.62 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.45 1o8t h LYS 48 CO 0.13 0.00 -0.33 1.25 -2.27 0.00 0.00 179.45 178.23 1o8t h LEU 49 N 0.00 -0.79 -1.52 5.20 7.12 -1.52 -1.15 115.31 122.65 1o8t h LEU 49 Ca 0.16 0.03 -0.04 0.00 0.13 0.00 0.00 57.88 58.16 1o8t h LEU 49 Cb 0.69 0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 41.02 1o8t h LEU 49 CO -0.00 -0.49 -0.07 -0.09 -0.13 0.00 0.00 178.44 177.66 1o8t h ARG 50 N -1.07 0.22 0.02 1.25 2.43 -1.22 -1.55 114.38 114.47 1o8t h ARG 50 Ca -0.10 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1o8t h ARG 50 Cb 0.71 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 1o8t h ARG 50 CO 0.16 0.31 -0.17 0.22 -1.51 0.00 0.00 179.97 178.97 1o8t h ASP 51 N 0.22 -0.50 1.38 -3.80 3.58 -0.13 -1.68 116.42 115.50 1o8t h ASP 51 Ca 0.05 0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1o8t h ASP 51 Cb 0.27 0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.52 1o8t h ASP 51 CO 0.01 -0.24 -0.01 -0.07 -2.88 0.00 0.00 179.24 176.05 1o8t h LEU 52 N -0.29 0.00 -0.45 2.28 3.38 -0.95 -3.18 115.31 116.10 1o8t h LEU 52 Ca 0.05 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1o8t h LEU 52 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1o8t h LEU 52 CO -0.15 0.01 -0.11 1.88 0.09 0.00 0.00 178.44 180.16 1o8t h TYR 53 N 0.00 0.98 -0.02 1.13 0.05 -0.40 -0.38 116.97 118.33 1o8t h TYR 53 Ca -0.00 -0.21 -0.00 0.00 0.05 0.00 0.00 58.73 58.57 1o8t h TYR 53 Cb 0.71 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.21 1o8t h TYR 53 CO 0.00 0.97 0.01 0.66 -1.05 0.00 0.00 178.16 178.75 1o8t h SER 54 N 0.71 0.02 -0.62 3.88 4.64 -1.36 -2.24 113.55 118.59 1o8t h SER 54 Ca 0.11 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1o8t h SER 54 Cb 0.66 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.71 1o8t h SER 54 CO 0.05 0.07 0.33 0.11 -0.87 0.00 0.00 176.83 176.51 1o8t h LYS 55 N -0.02 0.87 0.00 4.77 1.57 -1.62 -2.33 116.57 119.81 1o8t h LYS 55 Ca 0.01 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1o8t h LYS 55 Cb 0.05 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.19 1o8t h LYS 55 CO -0.00 0.67 0.00 0.77 -0.57 0.00 0.00 179.45 180.32 1o8t h SER 56 N 0.84 0.00 0.49 0.86 0.02 -0.82 -2.08 113.55 112.86 1o8t h SER 56 Ca 0.22 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 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 -0.32 0.74 -1.14 0.00 0.00 176.83 176.07 1o8t h THR 57 N 0.00 0.33 0.11 -2.27 2.02 -0.82 -1.07 112.91 111.21 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 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1o8t h THR 57 CO 0.00 0.00 -1.68 0.00 0.37 0.00 0.00 175.52 174.21 1o8t h ALA 58 N -0.35 0.29 0.80 6.16 0.00 -1.72 -3.26 119.26 121.18 1o8t h ALA 58 Ca -0.05 -1.24 -0.04 0.00 0.00 0.00 0.00 54.91 53.58 1o8t h ALA 58 Cb 0.65 0.61 0.01 0.00 0.00 0.00 0.00 17.79 19.06 1o8t h ALA 58 CO 0.04 1.03 -0.38 0.00 0.00 0.00 0.00 179.25 179.94 1o8t h ALA 59 N -0.04 -1.16 -0.10 0.00 0.00 -1.48 -3.16 119.26 113.32 1o8t h ALA 59 Ca -0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 1o8t h ALA 59 Cb 1.85 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 20.05 1o8t h ALA 59 CO 0.05 -1.08 -0.03 1.98 0.00 0.00 0.00 179.25 180.17 1o8t h MET 60 N -1.19 0.14 0.00 0.00 4.05 -1.37 -1.87 114.93 114.70 1o8t h MET 60 Ca -0.11 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.29 1o8t h MET 60 Cb 0.82 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.59 1o8t h MET 60 CO 0.18 0.19 0.00 -1.13 0.23 0.00 0.00 176.91 176.38 1o8t n SER 61 N -4.42 0.49 -0.09 1.39 3.41 -1.17 -0.62 113.62 112.61 1o8t n SER 61 Ca -0.01 0.65 -0.16 0.00 -0.26 0.00 0.00 58.87 59.08 1o8t n SER 61 Cb 0.16 -0.74 -0.08 0.00 -0.26 0.00 0.00 64.21 63.29 1o8t n SER 61 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1o8t n THR 62 N -2.07 1.49 0.28 6.66 -1.04 -0.71 -3.62 114.28 115.27 1o8t n THR 62 Ca 0.01 0.04 0.15 0.00 -2.04 0.00 0.00 64.05 62.22 1o8t n THR 62 Cb 0.16 -2.16 0.79 0.00 -1.82 0.00 0.00 70.33 67.30 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 -1.47 0.22 116.97 113.86 1o8t h TYR 63 Ca -0.24 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.51 1o8t h TYR 63 Cb 1.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.79 1o8t h TYR 63 CO -0.04 0.08 -0.24 1.15 -1.05 0.00 0.00 178.16 178.06 1o8t h THR 64 N 0.00 0.00 -0.92 -2.88 2.02 -1.03 0.51 112.91 110.61 1o8t h THR 64 Ca -0.00 -0.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 1o8t h THR 64 Cb 0.33 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.69 1o8t h THR 64 CO 0.01 0.00 0.55 1.23 0.37 0.00 0.00 175.52 177.69 1o8t h GLY 65 N -1.12 1.34 0.83 2.16 0.00 -1.60 -0.97 103.07 103.71 1o8t h GLY 65 Ca -0.07 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.67 1o8t h GLY 65 CO 0.11 0.54 -0.31 -2.22 0.00 0.00 0.00 176.54 174.66 1o8t h ILE 66 N 1.27 0.26 -0.15 2.60 1.08 -1.00 0.94 117.51 122.52 1o8t h ILE 66 Ca 0.33 -0.24 0.05 0.00 -0.39 0.00 0.00 64.86 64.61 1o8t h ILE 66 Cb -0.05 0.33 -0.07 0.00 -3.07 0.00 0.00 36.82 33.96 1o8t h ILE 66 CO -0.06 0.03 -0.38 0.15 -0.69 0.00 0.00 178.15 177.20 1o8t h PHE 67 N -1.05 -1.07 0.00 1.37 3.57 0.16 0.29 116.94 120.23 1o8t h PHE 67 Ca -0.09 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1o8t h PHE 67 Cb 0.71 0.49 -0.00 0.00 2.79 0.00 0.00 35.95 39.93 1o8t h PHE 67 CO -0.00 -0.44 -0.04 1.79 -2.23 0.00 0.00 178.31 177.38 1o8t h THR 68 N -0.44 0.22 0.32 4.41 1.35 -1.22 -2.89 112.91 114.66 1o8t h THR 68 Ca 0.09 -0.35 -0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1o8t h THR 68 Cb 0.59 1.28 -0.02 0.00 -1.73 0.00 0.00 68.15 68.27 1o8t h THR 68 CO -0.39 0.04 -0.28 -0.78 -0.25 0.00 0.00 175.52 173.86 1o8t h ASP 69 N 0.00 -0.75 0.64 5.36 1.82 0.14 0.33 116.42 123.96 1o8t h ASP 69 Ca -0.00 0.06 -0.07 0.00 -0.39 0.00 0.00 57.03 56.63 1o8t h ASP 69 Cb 0.27 0.25 -0.01 0.00 0.68 0.00 0.00 39.33 40.52 1o8t h ASP 69 CO 0.01 -0.42 -0.35 1.56 -1.61 0.00 0.00 179.24 178.42 1o8t h GLN 70 N -0.62 0.00 0.20 0.28 7.50 -1.40 -1.75 115.11 119.32 1o8t h GLN 70 Ca -0.02 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.12 1o8t h GLN 70 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.09 1o8t h GLN 70 CO -0.03 0.35 -0.10 0.28 -1.50 0.00 0.00 178.83 177.84 1o8t h VAL 71 N 0.00 0.89 -0.77 -0.54 2.07 -1.23 -2.02 116.25 114.65 1o8t h VAL 71 Ca -0.00 -0.76 0.08 0.00 0.82 0.00 0.00 66.70 66.84 1o8t h VAL 71 Cb 0.77 1.32 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 1o8t h VAL 71 CO 0.05 0.16 0.50 -0.07 0.02 0.00 0.00 177.57 178.23 1o8t h LEU 72 N -0.66 0.68 -0.74 2.57 4.07 -0.30 -1.06 115.31 119.87 1o8t h LEU 72 Ca -0.03 0.01 0.04 0.00 0.08 0.00 0.00 57.88 57.99 1o8t h LEU 72 Cb 0.47 -0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.03 1o8t h LEU 72 CO 0.04 0.43 0.45 -1.28 -1.08 0.00 0.00 178.44 177.00 1o8t h SER 73 N 0.77 0.72 0.95 -0.43 0.87 -1.07 -0.06 113.55 115.30 1o8t h SER 73 Ca 0.34 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 1o8t h SER 73 Cb 0.33 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1o8t h SER 73 CO -0.12 0.49 0.00 -0.37 -0.53 0.00 0.00 176.83 176.29 1o8t h VAL 74 N 0.86 0.00 -0.44 2.23 -1.51 -0.46 -2.88 116.25 114.05 1o8t h VAL 74 Ca 0.31 -0.38 -0.06 0.00 -1.23 0.00 0.00 66.70 65.34 1o8t h VAL 74 Cb 0.09 1.24 -0.02 0.00 -2.13 0.00 0.00 31.29 30.47 1o8t h VAL 74 CO -0.14 0.00 0.02 0.25 -1.23 0.00 0.00 177.57 176.47 1o8t h LEU 75 N 0.00 0.66 -0.00 4.19 7.12 -0.55 0.60 115.31 127.33 1o8t h LEU 75 Ca 0.00 -0.14 -0.00 0.00 0.13 0.00 0.00 57.88 57.87 1o8t h LEU 75 Cb 0.48 -0.17 0.00 0.00 -0.53 0.00 0.00 40.66 40.43 1o8t h LEU 75 CO 0.00 0.72 -0.00 0.11 -0.13 0.00 0.00 178.44 179.14 1o8t h LYS 76 N 0.66 0.00 -0.48 1.25 6.56 -1.48 -0.67 116.57 122.41 1o8t h LYS 76 Ca 0.14 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.69 1o8t h LYS 76 Cb 0.38 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.02 1o8t h LYS 76 CO 0.01 0.56 0.17 0.78 -2.06 0.00 0.00 179.45 178.91 1o8t h GLY 77 N -0.56 0.80 0.00 3.86 0.00 -1.57 -3.35 103.07 102.24 1o8t h GLY 77 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1o8t h GLY 77 CO 0.00 0.43 0.00 -2.21 0.00 0.00 0.00 176.54 174.76 1o8t n GLU 78 N -4.54 0.00 0.00 4.80 0.00 0.19 -5.13 120.64 115.97 1o8t n GLU 78 Ca 0.01 0.28 0.00 0.00 0.00 0.00 0.00 57.16 57.46 1o8t n GLU 78 Cb 0.18 -0.92 0.00 0.00 0.00 0.00 0.00 31.44 30.69 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22