#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 3.17 -0.02 -0.78 -0.21 -1.26 -4.92 119.66 115.64 1o8t s GLN 2 Ca 0.00 -0.62 -0.02 0.00 0.02 0.00 0.00 55.36 54.74 1o8t s GLN 2 Cb 0.00 -4.19 -0.01 0.00 1.00 0.00 0.00 33.01 29.81 1o8t s GLN 2 CO 0.00 -1.81 0.26 1.96 -2.12 0.00 0.00 175.29 173.58 1o8t h GLN 3 N 9.60 -0.09 -0.10 2.91 7.50 -2.04 -3.40 115.11 129.50 1o8t h GLN 3 Ca -0.28 0.01 -0.05 0.00 0.50 0.00 0.00 58.65 58.83 1o8t h GLN 3 Cb 1.07 0.02 -0.00 0.00 0.05 0.00 0.00 27.48 28.62 1o8t h GLN 3 CO 1.18 -0.06 -0.12 -1.00 -1.50 0.00 0.00 178.83 177.34 1o8t h PRO 4 N -0.31 0.25 -7.36 1.46 0.13 -2.07 -3.45 132.00 120.66 1o8t h PRO 4 Ca -0.01 -0.14 -0.50 0.00 -0.87 0.00 0.00 66.00 64.48 1o8t h PRO 4 Cb 0.07 0.01 0.12 0.00 0.13 0.00 0.00 31.00 31.33 1o8t h PRO 4 CO 0.01 0.69 0.32 -1.14 -0.23 0.00 0.00 178.00 177.65 1o8t s GLN 5 N -4.21 2.07 0.94 0.86 -0.44 -1.26 -5.03 119.66 112.59 1o8t s GLN 5 Ca -0.15 0.85 -0.12 0.00 -2.50 0.00 0.00 55.36 53.45 1o8t s GLN 5 Cb 0.04 -1.90 0.15 0.00 -1.64 0.00 0.00 33.01 29.66 1o8t s GLN 5 CO 0.73 -1.68 1.09 -1.14 0.50 0.00 0.00 175.29 174.79 1o8t s GLN 6 N -5.03 0.90 0.36 1.67 0.74 -1.26 -4.74 119.66 112.30 1o8t s GLN 6 Ca 0.61 0.87 -0.06 0.00 0.05 0.00 0.00 55.36 56.83 1o8t s GLN 6 Cb -0.16 -1.76 0.09 0.00 1.10 0.00 0.00 33.01 32.28 1o8t s GLN 6 CO 0.55 -2.50 0.34 -0.40 -0.55 0.00 0.00 175.29 172.73 1o8t n ASP 7 N -4.07 -1.17 0.12 6.67 5.75 -1.26 -4.74 116.55 117.85 1o8t n ASP 7 Ca 0.07 -0.75 -0.12 0.00 -0.01 0.00 0.00 54.79 53.98 1o8t n ASP 7 Cb 0.55 -0.30 -0.07 0.00 -1.03 0.00 0.00 41.12 40.26 1o8t n ASP 7 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1o8t h GLU 8 N 0.00 -0.34 -6.77 0.11 4.22 -1.96 -3.44 114.58 106.39 1o8t h GLU 8 Ca -0.12 0.02 -0.52 0.00 0.08 0.00 0.00 59.36 58.82 1o8t h GLU 8 Cb 0.38 0.08 0.04 0.00 0.50 0.00 0.00 28.75 29.75 1o8t h GLU 8 CO 0.08 0.01 0.63 -1.64 -2.18 0.00 0.00 179.01 175.91 1o8t s MET 9 N -3.94 4.40 -1.01 1.92 -1.94 -1.26 -4.91 119.30 112.57 1o8t s MET 9 Ca -0.13 2.09 -0.24 0.00 -1.71 0.00 0.00 55.69 55.71 1o8t s MET 9 Cb 0.01 -3.15 -0.06 0.00 2.01 0.00 0.00 34.83 33.64 1o8t s MET 9 CO 0.47 -0.18 1.95 -1.25 -0.01 0.00 0.00 175.02 176.00 1o8t s PRO 10 N -0.85 2.51 -0.23 2.03 0.04 -1.26 -4.94 135.00 132.30 1o8t s PRO 10 Ca 0.53 -0.60 -0.29 0.00 0.04 0.00 0.00 61.00 60.67 1o8t s PRO 10 Cb -0.37 -5.13 -0.02 0.00 0.04 0.00 0.00 34.50 29.03 1o8t s PRO 10 CO 0.44 -3.63 1.42 -1.54 0.04 0.00 0.00 177.00 173.73 1o8t s SER 11 N 7.51 6.63 -0.86 6.66 1.04 -1.26 -4.95 113.70 128.47 1o8t s SER 11 Ca 0.70 1.52 -0.25 0.00 0.48 0.00 0.00 55.95 58.40 1o8t s SER 11 Cb -0.05 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.56 1o8t s SER 11 CO 0.05 -1.06 1.54 -2.16 0.98 0.00 0.00 173.24 172.59 1o8t s PRO 12 N 4.18 3.15 0.17 4.02 0.04 -1.26 -4.99 135.00 140.32 1o8t s PRO 12 Ca 0.62 -0.47 -0.30 0.00 0.04 0.00 0.00 61.00 60.89 1o8t s PRO 12 Cb -0.22 -4.82 -0.08 0.00 0.04 0.00 0.00 34.50 29.43 1o8t s PRO 12 CO 0.24 -2.47 1.23 0.95 0.04 0.00 0.00 177.00 176.99 1o8t s THR 13 N 6.67 3.52 0.08 1.26 -4.23 -1.26 -4.82 115.64 116.86 1o8t s THR 13 Ca 0.50 1.24 0.00 0.00 -1.18 0.00 0.00 61.69 62.25 1o8t s THR 13 Cb -0.05 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.99 1o8t s THR 13 CO 0.03 0.18 0.00 0.33 -0.54 0.00 0.00 174.62 174.63 1o8t n PHE 14 N 2.73 -2.21 -0.16 3.99 7.35 -1.26 -4.93 117.46 122.98 1o8t n PHE 14 Ca 0.05 0.24 -0.02 0.00 -0.76 0.00 0.00 57.45 56.97 1o8t n PHE 14 Cb 0.44 0.97 0.21 0.00 0.35 0.00 0.00 39.48 41.46 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 0.80 -0.77 -2.13 4.07 -2.01 -2.63 115.31 112.64 1o8t h LEU 15 Ca 0.00 -0.10 0.05 0.00 0.08 0.00 0.00 57.88 57.91 1o8t h LEU 15 Cb 0.00 -0.21 -0.05 0.00 1.08 0.00 0.00 40.66 41.48 1o8t h LEU 15 CO 0.00 0.71 0.47 0.71 -1.08 0.00 0.00 178.44 179.26 1o8t h THR 16 N 0.88 1.06 0.31 0.22 1.35 -1.97 -2.81 112.91 111.93 1o8t h THR 16 Ca 0.21 -0.31 -0.02 0.00 -0.55 0.00 0.00 66.41 65.75 1o8t h THR 16 Cb 0.15 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 66.66 1o8t h THR 16 CO -0.02 0.16 -0.15 1.56 -0.25 0.00 0.00 175.52 176.82 1o8t h GLN 17 N 0.89 -0.40 -0.52 4.72 7.50 -1.83 -3.21 115.11 122.26 1o8t h GLN 17 Ca 0.33 0.03 0.10 0.00 0.50 0.00 0.00 58.65 59.60 1o8t h GLN 17 Cb 0.10 0.09 -0.10 0.00 0.05 0.00 0.00 27.48 27.63 1o8t h GLN 17 CO -0.15 -0.19 -0.14 0.28 -1.50 0.00 0.00 178.83 177.13 1o8t n VAL 18 N -5.22 -0.23 -0.12 -0.54 0.31 -1.06 0.41 118.33 111.88 1o8t n VAL 18 Ca -0.10 1.20 -0.05 0.00 -0.01 0.00 0.00 64.34 65.38 1o8t n VAL 18 Cb 0.21 -1.64 0.01 0.00 -0.91 0.00 0.00 33.84 31.52 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 -0.02 5.55 6.56 -1.60 -0.13 116.57 126.90 1o8t h LYS 19 Ca 0.24 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.79 1o8t h LYS 19 Cb 0.37 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.03 1o8t h LYS 19 CO -0.53 -0.02 -0.20 0.93 -2.06 0.00 0.00 179.45 177.57 1o8t h GLU 20 N -0.03 0.04 -0.73 3.15 3.07 -0.20 -2.44 114.58 117.43 1o8t h GLU 20 Ca 0.19 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 59.01 1o8t h GLU 20 Cb 0.32 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.20 1o8t h GLU 20 CO -0.42 0.24 0.32 0.66 -1.40 0.00 0.00 179.01 178.40 1o8t h SER 21 N 0.03 0.99 -0.20 1.42 4.64 -0.56 -1.94 113.55 117.93 1o8t h SER 21 Ca 0.01 -0.15 -0.17 0.00 -0.47 0.00 0.00 61.79 61.00 1o8t h SER 21 Cb 0.37 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1o8t h SER 21 CO 0.03 0.87 -0.52 -0.07 -0.87 0.00 0.00 176.83 176.27 1o8t h LEU 22 N 1.04 0.86 0.30 5.97 4.07 -0.98 -2.60 115.31 123.98 1o8t h LEU 22 Ca 0.25 -0.45 -0.01 0.00 0.08 0.00 0.00 57.88 57.75 1o8t h LEU 22 Cb 0.17 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 41.66 1o8t h LEU 22 CO -0.03 1.22 -0.18 0.28 -1.08 0.00 0.00 178.44 178.65 1o8t h SER 23 N 0.61 -0.45 0.37 -0.43 0.02 -1.20 -1.23 113.55 111.24 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 -0.29 0.00 0.28 -1.14 0.00 0.00 176.83 175.79 1o8t h SER 24 N -0.46 0.00 0.15 3.07 0.02 -1.41 -2.41 113.55 112.51 1o8t h SER 24 Ca -0.03 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.64 1o8t h SER 24 Cb 0.38 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.95 1o8t h SER 24 CO 0.04 0.00 -1.19 0.22 -1.14 0.00 0.00 176.83 174.75 1o8t h TYR 25 N 0.00 0.92 -0.69 3.45 3.20 -0.89 -3.31 116.97 119.65 1o8t h TYR 25 Ca 0.00 -0.61 -0.05 0.00 3.14 0.00 0.00 58.73 61.21 1o8t h TYR 25 Cb 0.19 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 1o8t h TYR 25 CO 0.00 1.45 0.22 -1.49 -1.64 0.00 0.00 178.16 176.70 1o8t h TRP 26 N 0.13 1.09 -0.90 -3.82 -0.00 -0.75 0.22 115.95 111.91 1o8t h TRP 26 Ca -0.19 -0.10 0.09 0.00 -0.00 0.00 0.00 58.89 58.68 1o8t h TRP 26 Cb 1.90 -0.32 -0.12 0.00 -0.00 0.00 0.00 29.16 30.62 1o8t h TRP 26 CO 0.13 0.87 -0.57 0.93 -0.00 0.00 0.00 178.44 179.80 1o8t h GLU 27 N 1.02 -0.06 -0.01 0.49 3.07 -1.60 0.13 114.58 117.62 1o8t h GLU 27 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1o8t h GLU 27 Cb 0.29 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 1o8t h GLU 27 CO -0.01 -0.04 -0.21 0.43 -1.40 0.00 0.00 179.01 177.78 1o8t n SER 28 N -5.28 1.35 -0.11 1.42 7.64 -1.20 -4.19 113.62 113.24 1o8t n SER 28 Ca 0.01 -1.16 0.01 0.00 1.01 0.00 0.00 58.87 58.75 1o8t n SER 28 Cb 0.28 0.14 0.31 0.00 -1.01 0.00 0.00 64.21 63.93 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 3.91 1.52 -0.26 -0.43 0.00 0.14 -2.88 119.26 121.27 1o8t h ALA 29 Ca 0.00 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1o8t h ALA 29 Cb 0.56 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1o8t h ALA 29 CO 0.00 0.42 -0.14 0.87 0.00 0.00 0.00 179.25 180.40 1o8t h LYS 30 N 0.79 -0.10 -1.02 0.00 1.57 -1.71 -0.12 116.57 115.99 1o8t h LYS 30 Ca 0.21 0.01 0.25 0.00 -1.87 0.00 0.00 60.65 59.25 1o8t h LYS 30 Cb -0.03 0.02 -0.12 0.00 0.08 0.00 0.00 32.23 32.19 1o8t h LYS 30 CO -0.04 -0.07 0.62 1.15 -0.57 0.00 0.00 179.45 180.54 1o8t h THR 31 N -0.10 0.52 -0.53 -0.16 2.02 -1.80 0.38 112.91 113.24 1o8t h THR 31 Ca 0.14 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1o8t h THR 31 Cb 0.31 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 1o8t h THR 31 CO -0.33 0.10 0.25 0.00 0.37 0.00 0.00 175.52 175.91 1o8t h ALA 32 N 1.70 0.69 -0.18 6.16 0.00 -1.08 -0.68 119.26 125.88 1o8t h ALA 32 Ca 0.64 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.46 1o8t h ALA 32 Cb 1.32 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 1o8t h ALA 32 CO -0.43 0.25 -0.46 0.00 0.00 0.00 0.00 179.25 178.61 1o8t h ALA 33 N 1.09 -0.66 -0.46 0.00 0.00 0.36 0.48 119.26 120.07 1o8t h ALA 33 Ca 0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1o8t h ALA 33 Cb 0.12 0.88 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1o8t h ALA 33 CO -0.02 -0.97 0.04 0.37 0.00 0.00 0.00 179.25 178.67 1o8t h GLN 34 N -0.49 0.72 0.00 0.00 4.15 -1.45 -1.91 115.11 116.12 1o8t h GLN 34 Ca 0.07 -0.16 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 1o8t h GLN 34 Cb 0.64 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.23 1o8t h GLN 34 CO -0.44 0.70 -0.08 -0.97 -1.93 0.00 0.00 178.83 176.11 1o8t h ASN 35 N 0.69 0.00 -0.40 -0.69 -0.73 0.39 -1.46 115.58 113.37 1o8t h ASN 35 Ca 0.14 0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.37 1o8t h ASN 35 Cb 0.36 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.90 1o8t h ASN 35 CO 0.01 0.08 0.13 0.25 -0.37 0.00 0.00 177.43 177.53 1o8t h LEU 36 N 0.00 0.13 -0.78 0.34 6.46 0.74 0.38 115.31 122.57 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 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.09 1o8t h LEU 36 CO 0.01 0.11 0.29 1.88 -0.62 0.00 0.00 178.44 180.11 1o8t h TYR 37 N 0.29 1.20 0.20 1.25 -1.99 -1.33 -3.00 116.97 113.60 1o8t h TYR 37 Ca 0.19 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.82 1o8t h TYR 37 Cb 0.18 -0.36 -0.02 0.00 2.00 0.00 0.00 36.73 38.54 1o8t h TYR 37 CO -0.16 0.92 -0.20 0.93 -0.00 0.00 0.00 178.16 179.65 1o8t h GLU 38 N 1.14 -0.42 0.00 4.88 4.39 -0.13 -2.01 114.58 122.43 1o8t h GLU 38 Ca 0.26 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1o8t h GLU 38 Cb 0.24 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1o8t h GLU 38 CO -0.02 -0.28 0.08 0.87 -1.16 0.00 0.00 179.01 178.50 1o8t h LYS 39 N -0.44 0.00 -0.14 2.33 1.79 -0.25 -1.74 116.57 118.13 1o8t h LYS 39 Ca 0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 1o8t h LYS 39 Cb 0.41 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1o8t h LYS 39 CO -0.05 0.00 -0.27 1.15 -1.08 0.00 0.00 179.45 179.20 1o8t h THR 40 N 0.00 1.37 -0.43 -0.16 2.02 -1.22 -3.27 112.91 111.21 1o8t h THR 40 Ca 0.00 -1.54 -0.06 0.00 0.77 0.00 0.00 66.41 65.58 1o8t h THR 40 Cb 0.16 2.03 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 1o8t h THR 40 CO 0.00 0.46 0.02 1.88 0.37 0.00 0.00 175.52 178.24 1o8t h TYR 41 N 0.03 0.82 -3.89 3.16 0.05 -1.33 -3.44 116.97 112.36 1o8t h TYR 41 Ca 0.00 -0.14 -0.47 0.00 0.05 0.00 0.00 58.73 58.18 1o8t h TYR 41 Cb 0.87 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 38.37 1o8t h TYR 41 CO 0.10 0.80 0.33 -0.51 -1.05 0.00 0.00 178.16 177.84 1o8t s LEU 42 N -9.44 4.30 -0.25 3.88 1.02 -1.13 -4.97 118.68 112.08 1o8t s LEU 42 Ca -0.13 1.80 0.04 0.00 0.02 0.00 0.00 54.13 55.86 1o8t s LEU 42 Cb 0.11 -4.05 0.43 0.00 0.02 0.00 0.00 46.19 42.69 1o8t s LEU 42 CO 0.80 -0.09 1.51 -0.81 0.02 0.00 0.00 176.35 177.77 1o8t n PRO 43 N 0.45 2.09 0.20 1.29 -0.04 -1.26 -4.46 135.00 133.26 1o8t n PRO 43 Ca 0.02 -1.87 0.14 0.00 -0.04 0.00 0.00 63.50 61.76 1o8t n PRO 43 Cb 0.50 -1.77 0.66 0.00 -0.04 0.00 0.00 33.50 32.85 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 1.75 1.00 -0.72 0.55 0.00 -1.93 -3.34 119.26 116.56 1o8t h ALA 44 Ca 0.32 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.29 1o8t h ALA 44 Cb 2.01 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 19.71 1o8t h ALA 44 CO 0.61 0.00 -0.43 0.28 0.00 0.00 0.00 179.25 179.71 1o8t n VAL 45 N -2.52 -0.49 0.12 0.00 0.31 -1.26 0.48 118.33 114.97 1o8t n VAL 45 Ca 0.00 1.88 -0.02 0.00 -0.01 0.00 0.00 64.34 66.19 1o8t n VAL 45 Cb 0.17 -2.33 0.10 0.00 -0.91 0.00 0.00 33.84 30.87 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 0.17 4.52 3.58 -1.98 -3.03 116.42 119.68 1o8t h ASP 46 Ca 0.12 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 1o8t h ASP 46 Cb 0.30 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.35 1o8t h ASP 46 CO -0.68 0.68 -0.08 -0.08 -2.88 0.00 0.00 179.24 176.20 1o8t h GLU 47 N 0.00 -0.23 0.00 0.28 4.22 -0.88 -2.87 114.58 115.10 1o8t h GLU 47 Ca -0.01 0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.44 1o8t h GLU 47 Cb 1.29 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 1o8t h GLU 47 CO 0.09 0.12 -0.05 -0.22 -2.18 0.00 0.00 179.01 176.78 1o8t h LYS 48 N -0.61 0.00 0.54 1.92 1.63 -0.07 0.11 116.57 120.08 1o8t h LYS 48 Ca -0.02 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1o8t h LYS 48 Cb 0.45 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.09 1o8t h LYS 48 CO 0.04 0.05 -0.26 1.25 -3.45 0.00 0.00 179.45 177.08 1o8t h LEU 49 N 0.00 -0.61 -1.70 5.20 5.85 -1.39 -1.68 115.31 120.97 1o8t h LEU 49 Ca -0.00 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1o8t h LEU 49 Cb 0.12 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 1o8t h LEU 49 CO 0.01 -0.38 -0.15 0.08 -0.34 0.00 0.00 178.44 177.66 1o8t h ARG 50 N -0.83 0.00 0.30 1.25 0.11 -1.36 -2.38 114.38 111.47 1o8t h ARG 50 Ca -0.07 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1o8t h ARG 50 Cb 0.55 -0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.61 1o8t h ARG 50 CO 0.12 0.15 -0.32 0.22 0.10 0.00 0.00 179.97 180.24 1o8t h ASP 51 N 0.00 -0.88 0.54 0.08 1.82 -0.67 -0.60 116.42 116.72 1o8t h ASP 51 Ca -0.00 0.08 -0.05 0.00 -0.39 0.00 0.00 57.03 56.67 1o8t h ASP 51 Cb 0.26 0.30 -0.01 0.00 0.68 0.00 0.00 39.33 40.57 1o8t h ASP 51 CO 0.02 -0.45 -0.22 -0.07 -1.61 0.00 0.00 179.24 176.91 1o8t h LEU 52 N -0.66 0.00 -0.11 2.28 4.07 -1.13 -2.91 115.31 116.86 1o8t h LEU 52 Ca -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.92 1o8t h LEU 52 Cb 0.61 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.35 1o8t h LEU 52 CO -0.08 0.22 -0.02 1.88 -1.08 0.00 0.00 178.44 179.36 1o8t h TYR 53 N 0.00 0.23 -0.21 1.13 0.05 -0.86 -0.15 116.97 117.16 1o8t h TYR 53 Ca -0.00 -0.05 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 1o8t h TYR 53 Cb 0.54 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.22 1o8t h TYR 53 CO 0.00 0.51 0.13 0.66 -1.05 0.00 0.00 178.16 178.41 1o8t h SER 54 N -0.11 0.26 -0.51 3.88 4.64 -1.03 -2.36 113.55 118.32 1o8t h SER 54 Ca 0.03 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1o8t h SER 54 Cb 0.43 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 1o8t h SER 54 CO 0.01 0.24 0.27 0.11 -0.87 0.00 0.00 176.83 176.59 1o8t h LYS 55 N 0.26 0.72 0.00 4.77 6.56 -1.53 -2.30 116.57 125.04 1o8t h LYS 55 Ca 0.08 -0.09 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1o8t h LYS 55 Cb 0.03 -0.14 0.00 0.00 -0.57 0.00 0.00 32.23 31.56 1o8t h LYS 55 CO -0.01 0.58 0.00 0.77 -2.06 0.00 0.00 179.45 178.72 1o8t h SER 56 N 0.68 0.00 -0.17 0.86 0.02 -0.79 -2.50 113.55 111.66 1o8t h SER 56 Ca 0.18 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1o8t h SER 56 Cb 0.08 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 1o8t h SER 56 CO -0.03 0.00 0.03 0.74 -1.14 0.00 0.00 176.83 176.43 1o8t h THR 57 N 0.00 0.93 0.09 -2.27 2.02 -0.87 0.79 112.91 113.59 1o8t h THR 57 Ca 0.00 -0.03 -0.29 0.00 0.77 0.00 0.00 66.41 66.86 1o8t h THR 57 Cb 0.12 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 1o8t h THR 57 CO 0.00 0.02 -1.53 0.00 0.37 0.00 0.00 175.52 174.38 1o8t h ALA 58 N 1.12 0.27 0.71 6.16 0.00 -1.69 -3.26 119.26 122.57 1o8t h ALA 58 Ca 0.07 -1.20 -0.03 0.00 0.00 0.00 0.00 54.91 53.75 1o8t h ALA 58 Cb 0.07 0.61 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1o8t h ALA 58 CO -0.10 0.93 -0.34 0.00 0.00 0.00 0.00 179.25 179.73 1o8t h ALA 59 N -0.13 -1.13 0.00 0.00 0.00 -1.50 -3.01 119.26 113.49 1o8t h ALA 59 Ca -0.35 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1o8t h ALA 59 Cb 1.71 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.87 1o8t h ALA 59 CO -0.00 -1.06 0.00 1.98 0.00 0.00 0.00 179.25 180.16 1o8t h MET 60 N -1.06 0.00 0.00 0.00 -1.53 -1.05 -2.09 114.93 109.19 1o8t h MET 60 Ca -0.10 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.16 1o8t h MET 60 Cb 0.73 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.78 1o8t h MET 60 CO 0.16 0.00 0.00 0.77 0.14 0.00 0.00 176.91 177.98 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.02 -1.52 0.34 113.55 113.78 1o8t h SER 61 Ca 0.00 0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.53 1o8t h SER 61 Cb 0.08 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.56 1o8t h SER 61 CO 0.00 0.00 -2.27 0.35 -1.14 0.00 0.00 176.83 173.77 1o8t n THR 62 N -2.78 1.53 0.31 -2.27 -2.24 -0.79 -4.16 114.28 103.88 1o8t n THR 62 Ca 0.00 -0.31 0.20 0.00 -2.27 0.00 0.00 64.05 61.67 1o8t n THR 62 Cb 0.21 -1.92 0.95 0.00 -2.10 0.00 0.00 70.33 67.48 1o8t n THR 62 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1o8t h TYR 63 N -1.00 0.00 0.45 4.78 0.05 -1.56 -0.40 116.97 119.29 1o8t h TYR 63 Ca -0.63 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.13 1o8t h TYR 63 Cb 1.55 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.29 1o8t h TYR 63 CO -0.05 0.00 -0.21 1.15 -1.05 0.00 0.00 178.16 178.00 1o8t h THR 64 N 0.00 0.00 -0.72 -2.88 2.02 -1.11 0.49 112.91 110.71 1o8t h THR 64 Ca -0.00 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 1o8t h THR 64 Cb 0.26 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.64 1o8t h THR 64 CO 0.00 0.00 0.36 1.23 0.37 0.00 0.00 175.52 177.48 1o8t h GLY 65 N -0.99 1.09 0.83 2.16 0.00 -1.70 -1.22 103.07 103.23 1o8t h GLY 65 Ca -0.06 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 1o8t h GLY 65 CO 0.10 0.49 -0.32 -2.22 0.00 0.00 0.00 176.54 174.59 1o8t h ILE 66 N 1.01 0.24 -0.11 2.60 1.08 -1.12 0.96 117.51 122.19 1o8t h ILE 66 Ca 0.25 -0.24 0.04 0.00 -0.39 0.00 0.00 64.86 64.53 1o8t h ILE 66 Cb 0.08 0.31 -0.06 0.00 -3.07 0.00 0.00 36.82 34.07 1o8t h ILE 66 CO -0.04 0.02 -0.41 0.15 -0.69 0.00 0.00 178.15 177.19 1o8t h PHE 67 N -1.06 -1.17 0.00 1.37 3.57 0.11 0.15 116.94 119.91 1o8t h PHE 67 Ca -0.09 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1o8t h PHE 67 Cb 0.71 0.53 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1o8t h PHE 67 CO -0.00 -0.47 0.00 1.79 -2.23 0.00 0.00 178.31 177.39 1o8t h THR 68 N -0.50 0.00 0.66 4.41 1.35 -1.27 -2.96 112.91 114.60 1o8t h THR 68 Ca 0.07 -0.23 -0.03 0.00 -0.55 0.00 0.00 66.41 65.68 1o8t h THR 68 Cb 0.62 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 68.24 1o8t h THR 68 CO -0.38 0.00 -0.46 -0.78 -0.25 0.00 0.00 175.52 173.65 1o8t h ASP 69 N 0.00 -1.18 0.74 5.36 1.82 0.13 0.27 116.42 123.56 1o8t h ASP 69 Ca 0.00 0.08 -0.05 0.00 -0.39 0.00 0.00 57.03 56.66 1o8t h ASP 69 Cb 0.23 0.36 -0.01 0.00 0.68 0.00 0.00 39.33 40.60 1o8t h ASP 69 CO 0.00 -0.68 -0.25 -0.61 -1.61 0.00 0.00 179.24 176.09 1o8t h GLN 70 N -1.07 0.00 0.29 0.28 4.15 -1.49 -2.05 115.11 115.23 1o8t h GLN 70 Ca -0.08 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 1o8t h GLN 70 Cb 0.88 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.57 1o8t h GLN 70 CO 0.05 0.25 -0.14 0.28 -1.93 0.00 0.00 178.83 177.34 1o8t h VAL 71 N 0.00 0.69 -0.58 2.39 2.07 -1.31 -2.58 116.25 116.94 1o8t h VAL 71 Ca -0.00 -0.67 0.08 0.00 0.82 0.00 0.00 66.70 66.93 1o8t h VAL 71 Cb 0.69 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1o8t h VAL 71 CO 0.03 0.12 0.39 -0.07 0.02 0.00 0.00 177.57 178.06 1o8t h LEU 72 N -0.79 0.41 -1.02 2.57 -0.00 -0.42 -0.57 115.31 115.50 1o8t h LEU 72 Ca -0.04 0.01 0.06 0.00 -0.00 0.00 0.00 57.88 57.90 1o8t h LEU 72 Cb 0.51 -0.08 -0.06 0.00 -0.00 0.00 0.00 40.66 41.02 1o8t h LEU 72 CO 0.07 0.26 0.65 -1.28 -0.00 0.00 0.00 178.44 178.13 1o8t h SER 73 N 0.46 1.05 0.96 -0.43 0.87 -1.14 0.75 113.55 116.08 1o8t h SER 73 Ca 0.26 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1o8t h SER 73 Cb 0.42 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1o8t h SER 73 CO -0.07 0.69 0.00 -0.37 -0.53 0.00 0.00 176.83 176.54 1o8t h VAL 74 N 1.20 0.00 -0.54 2.23 -1.51 -0.71 -2.87 116.25 114.05 1o8t h VAL 74 Ca 0.42 -0.39 -0.06 0.00 -1.23 0.00 0.00 66.70 65.43 1o8t h VAL 74 Cb 0.12 1.26 -0.02 0.00 -2.13 0.00 0.00 31.29 30.51 1o8t h VAL 74 CO -0.16 0.00 0.08 0.25 -1.23 0.00 0.00 177.57 176.51 1o8t h LEU 75 N 0.00 0.82 -0.21 4.19 5.85 -0.69 -2.43 115.31 122.85 1o8t h LEU 75 Ca 0.00 -0.17 -0.13 0.00 0.84 0.00 0.00 57.88 58.42 1o8t h LEU 75 Cb 0.48 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1o8t h LEU 75 CO 0.00 0.84 -0.37 0.11 -0.34 0.00 0.00 178.44 178.68 1o8t h LYS 76 N 0.82 0.62 -1.35 1.25 6.56 -1.50 0.66 116.57 123.63 1o8t h LYS 76 Ca 0.17 -0.39 -0.62 0.00 -1.06 0.00 0.00 60.65 58.75 1o8t h LYS 76 Cb 0.38 0.04 -0.25 0.00 -0.57 0.00 0.00 32.23 31.83 1o8t h LYS 76 CO 0.01 1.00 0.80 0.41 -2.06 0.00 0.00 179.45 179.61 1o8t n GLY 77 N 0.37 5.39 0.82 3.86 0.00 -1.11 -4.56 105.19 109.95 1o8t n GLY 77 Ca -0.06 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.87 1o8t n GLY 77 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1o8t n GLU 78 N -0.49 0.00 -0.60 1.61 0.00 -0.93 -4.97 120.64 115.25 1o8t n GLU 78 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.70 1o8t n GLU 78 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.00 1o8t n GLU 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22