#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 4.29 -0.23 -0.78 -0.44 -1.26 -5.04 119.66 116.20 1o8t s GLN 2 Ca 0.00 0.98 0.02 0.00 -2.50 0.00 0.00 55.36 53.87 1o8t s GLN 2 Cb 0.00 -3.57 0.05 0.00 -1.64 0.00 0.00 33.01 27.84 1o8t s GLN 2 CO 0.00 -0.32 -0.13 -1.14 0.50 0.00 0.00 175.29 174.20 1o8t s GLN 3 N 2.12 2.37 -1.14 1.67 -0.44 -1.26 -5.05 119.66 117.92 1o8t s GLN 3 Ca 0.37 -1.15 -0.22 0.00 -2.50 0.00 0.00 55.36 51.86 1o8t s GLN 3 Cb -0.16 -2.74 -0.05 0.00 -1.64 0.00 0.00 33.01 28.41 1o8t s GLN 3 CO 0.12 -0.47 1.89 -1.25 0.50 0.00 0.00 175.29 176.08 1o8t s PRO 4 N 1.19 2.76 0.12 1.67 0.04 -1.26 -4.74 135.00 134.78 1o8t s PRO 4 Ca -0.05 -1.13 -0.12 0.00 0.04 0.00 0.00 61.00 59.75 1o8t s PRO 4 Cb -0.18 -5.26 -0.11 0.00 0.04 0.00 0.00 34.50 28.99 1o8t s PRO 4 CO -0.07 -3.57 1.36 1.96 0.04 0.00 0.00 177.00 176.72 1o8t h GLN 5 N 9.70 0.82 -0.27 4.56 1.08 -1.98 -1.10 115.11 127.93 1o8t h GLN 5 Ca 0.23 -0.60 -0.07 0.00 -1.45 0.00 0.00 58.65 56.76 1o8t h GLN 5 Cb 0.94 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.47 1o8t h GLN 5 CO 1.26 1.22 -0.09 -0.56 -0.95 0.00 0.00 178.83 179.71 1o8t h GLN 6 N 0.59 0.54 0.00 1.46 3.07 -2.02 -3.38 115.11 115.37 1o8t h GLN 6 Ca -0.02 -0.22 0.00 0.00 0.09 0.00 0.00 58.65 58.50 1o8t h GLN 6 Cb 1.29 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 28.83 1o8t h GLN 6 CO 0.14 0.76 0.00 -0.25 0.09 0.00 0.00 178.83 179.57 1o8t n ASP 7 N -4.49 0.00 -4.63 0.06 8.00 -1.23 -4.67 116.55 109.58 1o8t n ASP 7 Ca -0.04 0.46 -0.43 0.00 0.71 0.00 0.00 54.79 55.50 1o8t n ASP 7 Cb 0.33 -0.24 -0.02 0.00 -0.02 0.00 0.00 41.12 41.16 1o8t n ASP 7 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1o8t s GLU 8 N -1.14 3.77 -0.10 -1.24 8.01 -0.42 -4.96 118.70 122.62 1o8t s GLU 8 Ca 0.00 1.58 -0.29 0.00 0.01 0.00 0.00 54.97 56.27 1o8t s GLU 8 Cb 0.00 -4.03 -0.04 0.00 -4.31 0.00 0.00 34.13 25.75 1o8t s GLU 8 CO 0.00 -1.32 1.57 1.41 0.01 0.00 0.00 175.26 176.93 1o8t s MET 9 N 4.70 4.13 0.73 1.61 1.75 -1.26 -4.41 119.30 126.55 1o8t s MET 9 Ca 0.70 2.00 -0.13 0.00 -1.25 0.00 0.00 55.69 57.01 1o8t s MET 9 Cb -0.24 -3.95 0.04 0.00 2.84 0.00 0.00 34.83 33.52 1o8t s MET 9 CO 0.29 -0.89 1.13 -1.25 -0.65 0.00 0.00 175.02 173.65 1o8t s PRO 10 N 4.03 2.35 -0.29 4.11 0.04 -1.26 -4.95 135.00 139.03 1o8t s PRO 10 Ca 0.69 1.41 -0.29 0.00 0.04 0.00 0.00 61.00 62.86 1o8t s PRO 10 Cb -0.30 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.34 1o8t s PRO 10 CO 0.26 -1.60 1.46 -1.12 0.04 0.00 0.00 177.00 176.04 1o8t s SER 11 N -2.71 6.47 0.02 6.66 0.01 -1.26 -4.92 113.70 117.96 1o8t s SER 11 Ca 0.67 1.30 -0.25 0.00 1.31 0.00 0.00 55.95 58.98 1o8t s SER 11 Cb -0.21 -2.54 -0.19 0.00 0.21 0.00 0.00 66.02 63.29 1o8t s SER 11 CO 0.48 -1.24 1.43 -0.65 0.41 0.00 0.00 173.24 173.66 1o8t h PRO 12 N 10.25 -0.00 -6.12 12.44 0.11 -2.05 -3.40 132.00 143.23 1o8t h PRO 12 Ca -0.30 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.30 1o8t h PRO 12 Cb 1.12 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 1o8t h PRO 12 CO 1.03 0.32 1.27 0.95 -0.21 0.00 0.00 178.00 181.36 1o8t s THR 13 N -4.90 3.48 -0.07 -1.15 -4.23 -1.26 -4.83 115.64 102.67 1o8t s THR 13 Ca -0.15 0.32 -0.19 0.00 -1.18 0.00 0.00 61.69 60.49 1o8t s THR 13 Cb 0.03 -4.12 -0.30 0.00 1.34 0.00 0.00 72.50 69.45 1o8t s THR 13 CO 0.67 -1.03 0.75 -0.26 -0.54 0.00 0.00 174.62 174.21 1o8t h PHE 14 N 13.55 0.50 -0.40 3.99 0.04 -2.02 -3.28 116.94 129.33 1o8t h PHE 14 Ca -0.27 -0.36 -0.02 0.00 2.80 0.00 0.00 57.97 60.12 1o8t h PHE 14 Cb 1.14 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 39.25 1o8t h PHE 14 CO 1.05 1.41 0.19 1.25 -0.60 0.00 0.00 178.31 181.60 1o8t h LEU 15 N -0.35 0.53 -2.25 1.54 6.46 -1.98 -2.44 115.31 116.81 1o8t h LEU 15 Ca -0.21 -0.13 0.04 0.00 -0.12 0.00 0.00 57.88 57.46 1o8t h LEU 15 Cb 1.69 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.48 1o8t h LEU 15 CO 0.11 0.51 0.14 0.74 -0.62 0.00 0.00 178.44 179.32 1o8t h THR 16 N 0.50 0.56 -0.02 1.05 2.02 -1.97 -2.60 112.91 112.45 1o8t h THR 16 Ca 0.14 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.32 1o8t h THR 16 Cb 0.13 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1o8t h THR 16 CO -0.02 0.00 0.01 -0.61 0.37 0.00 0.00 175.52 175.27 1o8t h GLN 17 N 0.00 0.03 -0.50 6.66 -0.00 -1.49 -3.20 115.11 116.61 1o8t h GLN 17 Ca 0.06 -0.00 0.19 0.00 -0.00 0.00 0.00 58.65 58.90 1o8t h GLN 17 Cb 0.34 -0.00 -0.09 0.00 0.00 0.00 0.00 27.48 27.72 1o8t h GLN 17 CO -0.00 0.12 0.18 1.33 0.00 0.00 0.00 178.83 180.47 1o8t n VAL 18 N -5.02 -0.21 -0.08 2.39 0.24 -0.98 0.06 118.33 114.73 1o8t n VAL 18 Ca -0.07 1.05 -0.07 0.00 -2.04 0.00 0.00 64.34 63.21 1o8t n VAL 18 Cb 0.08 -1.65 -0.00 0.00 -1.47 0.00 0.00 33.84 30.80 1o8t n VAL 18 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1o8t h LYS 19 N 0.00 -0.14 -0.09 7.34 6.56 -1.76 0.02 116.57 128.50 1o8t h LYS 19 Ca 0.39 0.01 -0.05 0.00 -1.06 0.00 0.00 60.65 59.94 1o8t h LYS 19 Cb 0.96 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.64 1o8t h LYS 19 CO -0.42 -0.09 -0.16 0.93 -2.06 0.00 0.00 179.45 177.65 1o8t h GLU 20 N -0.15 0.14 -0.53 3.15 3.07 -0.60 -1.82 114.58 117.84 1o8t h GLU 20 Ca 0.16 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.96 1o8t h GLU 20 Cb 0.39 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.26 1o8t h GLU 20 CO -0.40 0.30 0.23 1.03 -1.40 0.00 0.00 179.01 178.78 1o8t h SER 21 N 0.13 0.72 -0.12 1.42 0.87 -0.93 -1.90 113.55 113.74 1o8t h SER 21 Ca 0.03 -0.15 -0.17 0.00 -1.23 0.00 0.00 61.79 60.27 1o8t h SER 21 Cb 0.36 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1o8t h SER 21 CO 0.02 0.67 -0.52 0.25 -0.53 0.00 0.00 176.83 176.72 1o8t h LEU 22 N 0.72 0.77 0.31 2.23 6.46 -0.78 -2.67 115.31 122.35 1o8t h LEU 22 Ca 0.18 -0.40 -0.01 0.00 -0.12 0.00 0.00 57.88 57.53 1o8t h LEU 22 Cb 0.16 -0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 39.87 1o8t h LEU 22 CO -0.02 1.14 -0.19 0.28 -0.62 0.00 0.00 178.44 179.04 1o8t h SER 23 N 0.54 -0.46 0.39 1.25 0.02 -1.13 0.13 113.55 114.30 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 1.08 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1o8t h SER 23 CO 0.11 -0.30 0.00 0.77 -1.14 0.00 0.00 176.83 176.27 1o8t h SER 24 N -0.47 0.00 0.20 3.07 4.64 -1.40 -2.38 113.55 117.20 1o8t h SER 24 Ca -0.03 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.98 1o8t h SER 24 Cb 0.39 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.50 1o8t h SER 24 CO 0.04 0.00 -1.41 0.22 -0.87 0.00 0.00 176.83 174.80 1o8t h TYR 25 N 0.00 0.75 -0.59 4.77 3.20 -0.93 -3.34 116.97 120.83 1o8t h TYR 25 Ca 0.00 -0.55 -0.05 0.00 3.14 0.00 0.00 58.73 61.27 1o8t h TYR 25 Cb 0.20 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1o8t h TYR 25 CO 0.00 1.55 0.16 2.35 -1.64 0.00 0.00 178.16 180.57 1o8t h TRP 26 N -0.04 0.94 -0.92 -3.82 7.01 -0.29 0.09 115.95 118.92 1o8t h TRP 26 Ca -0.27 -0.09 0.10 0.00 2.11 0.00 0.00 58.89 60.75 1o8t h TRP 26 Cb 1.99 -0.27 -0.13 0.00 -2.10 0.00 0.00 29.16 28.65 1o8t h TRP 26 CO 0.14 0.77 -0.53 0.93 -2.79 0.00 0.00 178.44 176.96 1o8t h GLU 27 N 0.88 -0.05 0.00 2.65 5.08 -1.57 0.23 114.58 121.80 1o8t h GLU 27 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1o8t h GLU 27 Cb 0.29 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1o8t h GLU 27 CO -0.00 -0.03 -0.51 -1.13 -1.00 0.00 0.00 179.01 176.33 1o8t n SER 28 N -5.32 0.63 0.04 1.42 3.41 -1.18 -3.96 113.62 108.65 1o8t n SER 28 Ca 0.03 0.12 0.04 0.00 -0.26 0.00 0.00 58.87 58.80 1o8t n SER 28 Cb 0.31 0.05 0.43 0.00 -0.26 0.00 0.00 64.21 64.74 1o8t n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1o8t h ALA 29 N 2.63 1.70 -0.25 7.33 0.00 0.15 -2.86 119.26 127.95 1o8t h ALA 29 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1o8t h ALA 29 Cb 0.69 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1o8t h ALA 29 CO 0.00 0.26 -0.14 -0.22 0.00 0.00 0.00 179.25 179.15 1o8t h LYS 30 N 0.47 -0.11 -1.04 0.00 3.64 -1.54 0.04 116.57 118.03 1o8t h LYS 30 Ca 0.12 0.01 0.26 0.00 -1.27 0.00 0.00 60.65 59.78 1o8t h LYS 30 Cb 0.00 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 31.74 1o8t h LYS 30 CO -0.02 -0.07 0.65 1.15 -2.27 0.00 0.00 179.45 178.88 1o8t h THR 31 N -0.12 0.51 -0.71 1.00 2.02 -1.77 0.46 112.91 114.31 1o8t h THR 31 Ca 0.14 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 1o8t h THR 31 Cb 0.32 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.71 1o8t h THR 31 CO -0.32 0.08 0.34 0.00 0.37 0.00 0.00 175.52 175.99 1o8t h ALA 32 N 1.67 0.92 -0.28 6.16 0.00 -1.06 -0.88 119.26 125.78 1o8t h ALA 32 Ca 0.62 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.45 1o8t h ALA 32 Cb 1.43 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 1o8t h ALA 32 CO -0.38 0.48 -0.37 0.00 0.00 0.00 0.00 179.25 178.99 1o8t h ALA 33 N 1.16 -0.36 -0.62 0.00 0.00 0.35 0.76 119.26 120.56 1o8t h ALA 33 Ca 0.24 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 1o8t h ALA 33 Cb 0.12 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1o8t h ALA 33 CO -0.03 -0.81 0.12 0.37 0.00 0.00 0.00 179.25 178.90 1o8t h GLN 34 N -0.35 0.98 0.00 0.00 -0.00 -1.42 -1.84 115.11 112.48 1o8t h GLN 34 Ca 0.13 -0.23 -0.01 0.00 -0.00 0.00 0.00 58.65 58.53 1o8t h GLN 34 Cb 0.57 -0.13 -0.00 0.00 0.00 0.00 0.00 27.48 27.92 1o8t h GLN 34 CO -0.48 0.89 -0.06 -0.97 0.00 0.00 0.00 178.83 178.22 1o8t h ASN 35 N 0.93 0.00 -0.39 -0.69 -1.24 0.44 -1.62 115.58 113.01 1o8t h ASN 35 Ca 0.19 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.25 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 0.06 0.11 0.25 -1.29 0.00 0.00 177.43 176.57 1o8t h LEU 36 N 0.00 0.10 -0.92 0.34 6.46 0.13 0.25 115.31 121.67 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 0.13 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1o8t h LEU 36 CO 0.01 0.09 0.24 1.88 -0.62 0.00 0.00 178.44 180.04 1o8t h TYR 37 N 0.26 1.05 0.53 1.25 0.05 -1.36 -2.81 116.97 115.93 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 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.60 1o8t h TYR 37 CO -0.16 0.82 -0.37 1.49 -1.05 0.00 0.00 178.16 178.88 1o8t h GLU 38 N 1.00 -0.84 0.00 4.88 4.22 -0.43 -2.11 114.58 121.29 1o8t h GLU 38 Ca 0.23 0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.72 1o8t h GLU 38 Cb 0.24 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1o8t h GLU 38 CO -0.01 -0.56 0.00 1.17 -2.18 0.00 0.00 179.01 177.43 1o8t n LYS 39 N -5.50 0.07 0.37 1.92 0.00 0.64 -2.76 118.16 112.90 1o8t n LYS 39 Ca -0.12 0.54 -0.16 0.00 0.00 0.00 0.00 58.31 58.57 1o8t n LYS 39 Cb 0.39 -1.71 -0.08 0.00 0.00 0.00 0.00 35.03 33.63 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 0.16 -0.62 3.15 2.02 -1.12 -3.22 112.91 113.29 1o8t h THR 40 Ca 0.00 -0.22 -0.09 0.00 0.77 0.00 0.00 66.41 66.87 1o8t h THR 40 Cb 0.03 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1o8t h THR 40 CO 0.00 0.02 0.03 0.22 0.37 0.00 0.00 175.52 176.15 1o8t h TYR 41 N -1.14 1.15 -3.81 3.16 3.20 -1.60 -3.44 116.97 114.48 1o8t h TYR 41 Ca -0.10 -0.19 -0.53 0.00 3.14 0.00 0.00 58.73 61.06 1o8t h TYR 41 Cb 0.76 -0.31 0.07 0.00 1.54 0.00 0.00 36.73 38.79 1o8t h TYR 41 CO -0.00 1.00 0.68 -0.51 -1.64 0.00 0.00 178.16 177.69 1o8t s LEU 42 N -9.35 4.40 -0.31 2.82 1.02 -1.14 -4.93 118.68 111.19 1o8t s LEU 42 Ca -0.12 2.74 0.01 0.00 0.02 0.00 0.00 54.13 56.78 1o8t s LEU 42 Cb 0.14 -3.65 0.31 0.00 0.02 0.00 0.00 46.19 43.02 1o8t s LEU 42 CO 0.85 -0.61 1.77 -0.81 0.02 0.00 0.00 176.35 177.57 1o8t n PRO 43 N 0.99 1.82 0.19 1.29 -0.04 -1.26 -4.52 135.00 133.48 1o8t n PRO 43 Ca 0.01 -1.76 0.14 0.00 -0.04 0.00 0.00 63.50 61.85 1o8t n PRO 43 Cb 0.41 -1.69 0.65 0.00 -0.04 0.00 0.00 33.50 32.83 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 1.50 1.00 -0.26 0.55 0.00 -1.92 -3.35 119.26 116.78 1o8t h ALA 44 Ca 0.35 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.28 1o8t h ALA 44 Cb 1.48 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 1o8t h ALA 44 CO 0.76 0.00 -0.16 0.28 0.00 0.00 0.00 179.25 180.13 1o8t n VAL 45 N -2.50 -0.18 0.18 0.00 0.31 -1.26 0.93 118.33 115.81 1o8t n VAL 45 Ca 0.00 1.55 0.02 0.00 -0.01 0.00 0.00 64.34 65.90 1o8t n VAL 45 Cb 0.17 -2.00 0.34 0.00 -0.91 0.00 0.00 33.84 31.44 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 0.34 4.52 3.58 -1.99 -2.83 116.42 120.04 1o8t h ASP 46 Ca 0.04 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.48 1o8t h ASP 46 Cb 0.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.16 1o8t h ASP 46 CO -0.25 0.40 -0.16 -0.08 -2.88 0.00 0.00 179.24 176.27 1o8t h GLU 47 N 0.00 -0.44 -0.16 0.28 4.81 -1.08 -2.93 114.58 115.06 1o8t h GLU 47 Ca -0.00 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1o8t h GLU 47 Cb 0.74 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 1o8t h GLU 47 CO 0.05 -0.11 0.15 -0.22 -0.73 0.00 0.00 179.01 178.15 1o8t h LYS 48 N -0.83 0.00 0.70 1.92 1.63 0.53 0.16 116.57 120.68 1o8t h LYS 48 Ca -0.05 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 1o8t h LYS 48 Cb 0.52 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.16 1o8t h LYS 48 CO 0.08 0.00 -0.34 -0.07 -3.45 0.00 0.00 179.45 175.67 1o8t h LEU 49 N 0.00 -0.80 -1.59 5.20 -0.00 -1.39 -1.55 115.31 115.18 1o8t h LEU 49 Ca 0.08 0.03 -0.03 0.00 -0.00 0.00 0.00 57.88 57.95 1o8t h LEU 49 Cb 0.37 0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.23 1o8t h LEU 49 CO -0.00 -0.50 -0.08 0.03 -0.00 0.00 0.00 178.44 177.88 1o8t h ARG 50 N -1.08 0.16 0.58 1.13 3.08 -1.29 -2.04 114.38 114.91 1o8t h ARG 50 Ca -0.10 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1o8t h ARG 50 Cb 0.72 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 1o8t h ARG 50 CO 0.16 0.25 -0.48 -0.44 -1.07 0.00 0.00 179.97 178.39 1o8t h ASP 51 N 0.15 -1.28 0.53 7.04 5.19 -0.55 -1.20 116.42 126.30 1o8t h ASP 51 Ca 0.03 0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.51 1o8t h ASP 51 Cb 0.25 0.41 -0.00 0.00 0.18 0.00 0.00 39.33 40.17 1o8t h ASP 51 CO 0.01 -0.67 -0.12 0.25 -3.12 0.00 0.00 179.24 175.59 1o8t h LEU 52 N -1.03 0.00 -0.30 1.55 5.85 -1.17 -2.88 115.31 117.33 1o8t h LEU 52 Ca -0.07 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.58 1o8t h LEU 52 Cb 0.88 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1o8t h LEU 52 CO -0.01 0.12 -0.07 1.88 -0.34 0.00 0.00 178.44 180.02 1o8t h TYR 53 N 0.00 0.64 -0.07 1.25 0.05 -0.78 -0.27 116.97 117.78 1o8t h TYR 53 Ca -0.00 -0.14 -0.00 0.00 0.05 0.00 0.00 58.73 58.64 1o8t h TYR 53 Cb 0.42 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 38.00 1o8t h TYR 53 CO 0.00 0.76 0.04 0.77 -1.05 0.00 0.00 178.16 178.68 1o8t h SER 54 N 0.33 0.09 -0.44 3.88 0.02 -1.02 -2.15 113.55 114.25 1o8t h SER 54 Ca 0.08 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1o8t h SER 54 Cb 0.55 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1o8t h SER 54 CO 0.03 0.11 0.23 0.11 -1.14 0.00 0.00 176.83 176.18 1o8t h LYS 55 N 0.05 0.63 0.00 3.45 6.56 -1.54 -2.36 116.57 123.36 1o8t h LYS 55 Ca 0.03 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 1o8t h LYS 55 Cb 0.04 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 31.59 1o8t h LYS 55 CO -0.00 0.51 0.00 0.77 -2.06 0.00 0.00 179.45 178.67 1o8t h SER 56 N 0.58 0.00 0.62 0.86 0.02 -0.86 -1.73 113.55 113.04 1o8t h SER 56 Ca 0.16 0.00 -0.02 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 62.61 1o8t h SER 56 CO -0.02 0.00 -0.39 0.74 -1.14 0.00 0.00 176.83 176.02 1o8t h THR 57 N 0.00 0.22 0.12 -2.27 2.02 -0.82 -1.32 112.91 110.85 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 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 1o8t h THR 57 CO 0.00 0.00 -1.72 0.00 0.37 0.00 0.00 175.52 174.17 1o8t h ALA 58 N -0.66 0.30 0.79 6.16 0.00 -1.70 -3.27 119.26 120.86 1o8t h ALA 58 Ca -0.08 -1.25 -0.04 0.00 0.00 0.00 0.00 54.91 53.55 1o8t h ALA 58 Cb 0.77 0.61 0.01 0.00 0.00 0.00 0.00 17.79 19.18 1o8t h ALA 58 CO 0.08 1.06 -0.38 0.00 0.00 0.00 0.00 179.25 180.01 1o8t h ALA 59 N -0.02 -1.16 0.00 0.00 0.00 -1.42 -3.07 119.26 113.58 1o8t h ALA 59 Ca -0.37 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 1o8t h ALA 59 Cb 1.89 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 20.08 1o8t h ALA 59 CO 0.06 -1.08 -0.02 1.98 0.00 0.00 0.00 179.25 180.19 1o8t h MET 60 N -1.17 0.00 0.00 0.00 4.05 -1.40 -1.96 114.93 114.46 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 0.81 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.61 1o8t h MET 60 CO 0.18 0.02 0.00 1.03 0.23 0.00 0.00 176.91 178.37 1o8t h SER 61 N 0.00 0.00 0.00 1.39 0.87 -1.51 -0.27 113.55 114.02 1o8t h SER 61 Ca -0.00 0.00 -0.42 0.00 -1.23 0.00 0.00 61.79 60.14 1o8t h SER 61 Cb 0.11 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.00 1o8t h SER 61 CO 0.00 0.00 -2.39 0.35 -0.53 0.00 0.00 176.83 174.26 1o8t n THR 62 N -2.56 1.37 0.28 2.23 -2.24 -0.75 -4.27 114.28 108.34 1o8t n THR 62 Ca 0.00 -0.36 0.16 0.00 -2.27 0.00 0.00 64.05 61.59 1o8t n THR 62 Cb 0.20 -1.82 0.82 0.00 -2.10 0.00 0.00 70.33 67.43 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 -0.85 0.00 0.51 4.78 0.05 -1.54 0.10 116.97 120.02 1o8t h TYR 63 Ca -0.63 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.13 1o8t h TYR 63 Cb 1.57 0.00 0.01 0.00 1.01 0.00 0.00 36.73 39.31 1o8t h TYR 63 CO -0.08 0.07 -0.25 1.15 -1.05 0.00 0.00 178.16 178.01 1o8t h THR 64 N 0.00 0.06 -0.79 -2.88 2.02 -1.26 0.54 112.91 110.59 1o8t h THR 64 Ca -0.00 -0.50 -0.03 0.00 0.77 0.00 0.00 66.41 66.64 1o8t h THR 64 Cb 0.32 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.78 1o8t h THR 64 CO 0.01 0.01 0.37 1.23 0.37 0.00 0.00 175.52 177.51 1o8t h GLY 65 N -1.16 1.22 0.83 2.16 0.00 -1.72 -1.10 103.07 103.31 1o8t h GLY 65 Ca -0.07 -0.61 -0.04 0.00 0.00 0.00 0.00 47.33 46.62 1o8t h GLY 65 CO 0.12 0.58 -0.35 -2.22 0.00 0.00 0.00 176.54 174.67 1o8t h ILE 66 N 1.13 0.15 -0.12 2.60 1.08 -1.01 0.12 117.51 121.46 1o8t h ILE 66 Ca 0.27 -0.22 0.04 0.00 -0.39 0.00 0.00 64.86 64.57 1o8t h ILE 66 Cb 0.13 0.19 -0.06 0.00 -3.07 0.00 0.00 36.82 34.01 1o8t h ILE 66 CO -0.03 0.01 -0.40 0.15 -0.69 0.00 0.00 178.15 177.19 1o8t h PHE 67 N -1.15 -1.14 0.00 1.37 3.57 0.16 0.14 116.94 119.89 1o8t h PHE 67 Ca -0.10 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1o8t h PHE 67 Cb 0.77 0.52 -0.00 0.00 2.79 0.00 0.00 35.95 40.02 1o8t h PHE 67 CO -0.00 -0.46 -0.02 1.15 -2.23 0.00 0.00 178.31 176.74 1o8t h THR 68 N -0.48 0.10 0.58 4.41 2.02 -1.25 -2.90 112.91 115.39 1o8t h THR 68 Ca 0.08 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 1o8t h THR 68 Cb 0.61 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 1o8t h THR 68 CO -0.38 0.02 -0.42 -0.78 0.37 0.00 0.00 175.52 174.32 1o8t h ASP 69 N 0.00 -1.10 0.70 4.18 1.82 0.14 0.27 116.42 122.43 1o8t h ASP 69 Ca -0.00 0.07 -0.06 0.00 -0.39 0.00 0.00 57.03 56.65 1o8t h ASP 69 Cb 0.25 0.34 -0.01 0.00 0.68 0.00 0.00 39.33 40.59 1o8t h ASP 69 CO 0.00 -0.62 -0.28 -0.61 -1.61 0.00 0.00 179.24 176.12 1o8t h GLN 70 N -0.97 0.00 0.29 0.28 -0.00 -1.46 -1.92 115.11 111.32 1o8t h GLN 70 Ca -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.57 1o8t h GLN 70 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.29 1o8t h GLN 70 CO 0.03 0.28 -0.14 0.28 0.00 0.00 0.00 178.83 179.28 1o8t h VAL 71 N 0.00 0.70 -0.63 2.39 2.07 -1.27 -2.52 116.25 117.00 1o8t h VAL 71 Ca -0.00 -0.67 0.08 0.00 0.82 0.00 0.00 66.70 66.92 1o8t h VAL 71 Cb 0.71 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 1o8t h VAL 71 CO 0.04 0.13 0.42 0.25 0.02 0.00 0.00 177.57 178.42 1o8t h LEU 72 N -0.78 0.48 -1.21 2.57 6.46 -0.43 0.12 115.31 122.52 1o8t h LEU 72 Ca -0.04 0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.78 1o8t h LEU 72 Cb 0.51 -0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 40.29 1o8t h LEU 72 CO 0.07 0.30 0.55 -1.28 -0.62 0.00 0.00 178.44 177.46 1o8t h SER 73 N 0.54 0.85 1.06 1.25 0.87 -1.13 0.13 113.55 117.11 1o8t h SER 73 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1o8t h SER 73 Cb 0.40 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1o8t h SER 73 CO -0.09 0.56 0.00 0.58 -0.53 0.00 0.00 176.83 177.35 1o8t h VAL 74 N 0.97 0.00 -0.53 2.23 2.07 -0.54 -2.89 116.25 117.56 1o8t h VAL 74 Ca 0.36 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 67.33 1o8t h VAL 74 Cb 0.16 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1o8t h VAL 74 CO -0.12 0.00 0.08 0.25 0.02 0.00 0.00 177.57 177.79 1o8t h LEU 75 N 0.00 0.81 -0.29 2.57 5.85 -0.53 -1.65 115.31 122.07 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 0.53 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1o8t h LEU 75 CO 0.00 0.83 -0.51 0.50 -0.34 0.00 0.00 178.44 178.91 1o8t h LYS 76 N 0.81 0.85 -0.49 1.25 3.11 -1.50 0.34 116.57 120.94 1o8t h LYS 76 Ca 0.17 -0.53 -0.02 0.00 -2.81 0.00 0.00 60.65 57.45 1o8t h LYS 76 Cb 0.38 0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 31.64 1o8t h LYS 76 CO 0.01 1.17 0.22 0.78 -2.81 0.00 0.00 179.45 178.81 1o8t h GLY 77 N 0.63 0.78 0.21 5.01 0.00 -1.50 -3.28 103.07 104.92 1o8t h GLY 77 Ca 0.02 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1o8t h GLY 77 CO 0.12 0.38 -0.06 0.83 0.00 0.00 0.00 176.54 177.81 1o8t h GLU 78 N 0.65 -0.16 -0.03 4.80 5.08 -1.34 -3.52 114.58 120.06 1o8t h GLU 78 Ca 0.17 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1o8t h GLU 78 Cb 0.16 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1o8t h GLU 78 CO -0.02 0.20 0.00 0.39 -1.00 0.00 0.00 179.01 178.58