#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x59 s SER 2 N 0.00 2.61 0.06 1.61 1.04 -1.26 -5.09 113.70 112.67 1x59 s SER 2 Ca 0.00 1.82 -0.00 0.00 0.48 0.00 0.00 55.95 58.25 1x59 s SER 2 Cb 0.00 -2.41 -0.04 0.00 0.10 0.00 0.00 66.02 63.67 1x59 s SER 2 CO 0.00 -3.24 -0.04 -0.55 0.98 0.00 0.00 173.24 170.40 1x59 s SER 3 N -2.85 0.63 0.56 7.02 0.15 -1.26 -5.13 113.70 112.82 1x59 s SER 3 Ca 0.66 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1x59 s SER 3 Cb -0.22 0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.27 1x59 s SER 3 CO 0.59 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 175.07 1x59 n GLY 4 N 0.07 -1.50 2.83 9.45 0.00 -1.26 -4.93 105.19 109.85 1x59 n GLY 4 Ca -0.13 -1.16 -0.15 0.00 0.00 0.00 0.00 46.02 44.57 1x59 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x59 s SER 5 N -4.56 0.10 0.00 1.61 0.01 -1.26 -5.04 113.70 104.55 1x59 s SER 5 Ca 0.00 0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.43 1x59 s SER 5 Cb 0.00 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1x59 s SER 5 CO 0.00 -0.15 0.54 -1.54 0.41 0.00 0.00 173.24 172.50 1x59 n SER 6 N 4.34 1.53 -4.40 2.44 3.41 -1.26 -4.49 113.62 115.18 1x59 n SER 6 Ca -0.24 -1.30 -0.33 0.00 -0.26 0.00 0.00 58.87 56.74 1x59 n SER 6 Cb 0.51 -0.32 -0.14 0.00 -0.26 0.00 0.00 64.21 64.00 1x59 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x59 s GLY 7 N 0.57 1.59 0.26 5.00 0.00 -1.26 -5.01 107.32 108.48 1x59 s GLY 7 Ca 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 44.72 43.80 1x59 s GLY 7 CO 0.00 -0.14 1.88 1.98 0.00 0.00 0.00 173.10 176.82 1x59 h MET 8 N 6.73 1.11 -0.42 2.90 1.85 -1.99 0.07 114.93 125.18 1x59 h MET 8 Ca -0.27 -0.13 -0.02 0.00 -0.61 0.00 0.00 59.70 58.66 1x59 h MET 8 Cb 1.21 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 33.00 1x59 h MET 8 CO 0.58 0.82 0.17 0.00 -0.40 0.00 0.00 176.91 178.08 1x59 h ALA 9 N 1.35 0.54 -0.60 0.39 0.00 -1.96 0.13 119.26 119.12 1x59 h ALA 9 Ca 0.28 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1x59 h ALA 9 Cb 0.05 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1x59 h ALA 9 CO -0.04 0.14 0.22 0.93 0.00 0.00 0.00 179.25 180.50 1x59 h GLU 10 N 0.53 0.91 -0.44 0.00 4.39 -1.76 -1.67 114.58 116.53 1x59 h GLU 10 Ca 0.14 -0.18 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 1x59 h GLU 10 Cb 0.19 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 1x59 h GLU 10 CO -0.01 0.79 0.13 -0.09 -1.16 0.00 0.00 179.01 178.67 1x59 h ARG 11 N 0.83 0.69 -0.94 2.33 2.43 -0.94 -3.00 114.38 115.79 1x59 h ARG 11 Ca 0.20 -0.15 0.07 0.00 -0.81 0.00 0.00 59.98 59.29 1x59 h ARG 11 Cb 0.24 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.62 1x59 h ARG 11 CO -0.01 0.68 0.61 0.00 -1.51 0.00 0.00 179.97 179.74 1x59 h ALA 12 N 0.99 1.49 -0.72 2.80 0.00 -0.22 0.31 119.26 123.92 1x59 h ALA 12 Ca 0.14 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1x59 h ALA 12 Cb 0.28 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1x59 h ALA 12 CO -0.00 0.35 0.19 0.00 0.00 0.00 0.00 179.25 179.79 1x59 h ALA 13 N 1.50 0.94 0.00 0.00 0.00 -1.29 0.21 119.26 120.63 1x59 h ALA 13 Ca 0.42 -0.24 -0.20 0.00 0.00 0.00 0.00 54.91 54.88 1x59 h ALA 13 Cb 0.24 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1x59 h ALA 13 CO -0.17 0.65 -0.89 -0.07 0.00 0.00 0.00 179.25 178.77 1x59 h LEU 14 N 1.07 0.32 -1.08 0.00 3.38 -1.05 -2.56 115.31 115.40 1x59 h LEU 14 Ca 0.23 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1x59 h LEU 14 Cb 0.35 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1x59 h LEU 14 CO -0.00 1.06 0.12 -0.33 0.09 0.00 0.00 178.44 179.38 1x59 h GLU 15 N 0.14 0.78 -0.16 1.13 4.39 -0.35 -1.74 114.58 118.76 1x59 h GLU 15 Ca -0.05 -0.15 0.02 0.00 0.34 0.00 0.00 59.36 59.52 1x59 h GLU 15 Cb 1.52 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 30.03 1x59 h GLU 15 CO 0.14 0.71 0.02 1.49 -1.16 0.00 0.00 179.01 180.20 1x59 h GLU 16 N 0.75 0.07 -0.50 2.33 4.81 -0.78 0.12 114.58 121.39 1x59 h GLU 16 Ca 0.17 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1x59 h GLU 16 Cb 0.28 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1x59 h GLU 16 CO -0.00 0.05 0.32 -0.07 -0.73 0.00 0.00 179.01 178.58 1x59 h LEU 17 N 0.08 0.55 -0.20 1.64 3.38 -1.03 0.16 115.31 119.89 1x59 h LEU 17 Ca 0.07 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1x59 h LEU 17 Cb 0.08 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1x59 h LEU 17 CO -0.11 0.40 0.12 0.58 0.09 0.00 0.00 178.44 179.51 1x59 h VAL 18 N 0.66 1.08 0.32 1.22 2.07 -1.09 -0.04 116.25 120.47 1x59 h VAL 18 Ca 0.19 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1x59 h VAL 18 Cb -0.05 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1x59 h VAL 18 CO -0.05 0.08 -0.21 0.50 0.02 0.00 0.00 177.57 177.90 1x59 h LYS 19 N 0.24 -0.50 -0.21 1.57 3.11 -0.11 0.21 116.57 120.88 1x59 h LYS 19 Ca 0.07 0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 57.93 1x59 h LYS 19 Cb 0.03 0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.36 1x59 h LYS 19 CO -0.01 -0.33 0.07 -0.07 -2.81 0.00 0.00 179.45 176.29 1x59 h LEU 20 N -0.52 0.30 -1.10 5.20 -0.00 -0.72 0.57 115.31 119.05 1x59 h LEU 20 Ca -0.03 -0.20 -0.05 0.00 -0.00 0.00 0.00 57.88 57.60 1x59 h LEU 20 Cb 0.44 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 41.00 1x59 h LEU 20 CO 0.02 0.42 0.05 -0.61 -0.00 0.00 0.00 178.44 178.31 1x59 h GLN 21 N 0.17 0.68 0.19 1.13 5.75 -0.93 0.12 115.11 122.22 1x59 h GLN 21 Ca 0.07 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 1x59 h GLN 21 Cb 0.22 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.68 1x59 h GLN 21 CO -0.00 0.67 -0.09 0.78 -2.65 0.00 0.00 178.83 177.53 1x59 h GLY 22 N 0.91 -0.27 0.18 2.39 0.00 -0.37 0.08 103.07 105.99 1x59 h GLY 22 Ca 0.14 0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.65 1x59 h GLY 22 CO 0.01 -0.10 -0.13 -2.09 0.00 0.00 0.00 176.54 174.23 1x59 h GLU 23 N -0.29 -0.05 -0.28 4.80 4.57 -0.19 -1.26 114.58 121.87 1x59 h GLU 23 Ca -0.03 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.06 1x59 h GLU 23 Cb 0.23 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1x59 h GLU 23 CO 0.04 -0.04 -0.21 -0.09 -1.18 0.00 0.00 179.01 177.53 1x59 h ARG 24 N -0.06 0.64 0.01 1.92 2.43 -0.70 -1.30 114.38 117.32 1x59 h ARG 24 Ca 0.18 -0.31 0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1x59 h ARG 24 Cb 0.33 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1x59 h ARG 24 CO -0.41 0.91 -0.12 0.28 -1.51 0.00 0.00 179.97 179.12 1x59 h VAL 25 N 0.38 0.70 -0.34 0.20 2.07 -0.75 0.40 116.25 118.92 1x59 h VAL 25 Ca 0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.59 1x59 h VAL 25 Cb 0.76 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 1x59 h VAL 25 CO 0.06 0.00 0.22 0.03 0.02 0.00 0.00 177.57 177.90 1x59 h ARG 26 N -0.21 0.38 0.03 1.57 3.08 -1.14 -1.91 114.38 116.18 1x59 h ARG 26 Ca 0.04 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1x59 h ARG 26 Cb 0.26 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1x59 h ARG 26 CO -0.11 0.25 -0.01 0.78 -1.07 0.00 0.00 179.97 179.81 1x59 h GLY 27 N 0.39 -0.04 0.88 0.04 0.00 -0.38 -3.20 103.07 100.76 1x59 h GLY 27 Ca 0.13 0.02 0.04 0.00 0.00 0.00 0.00 47.33 47.52 1x59 h GLY 27 CO -0.03 -0.01 0.65 1.41 0.00 0.00 0.00 176.54 178.55 1x59 h LEU 28 N -0.33 1.07 -1.20 3.11 3.38 0.58 0.26 115.31 122.18 1x59 h LEU 28 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1x59 h LEU 28 Cb 0.31 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1x59 h LEU 28 CO 0.01 0.73 -0.31 0.11 0.09 0.00 0.00 178.44 179.06 1x59 h LYS 29 N 1.24 0.15 0.00 1.13 1.57 -1.60 -1.59 116.57 117.48 1x59 h LYS 29 Ca 0.40 -0.05 -0.16 0.00 -1.87 0.00 0.00 60.65 58.96 1x59 h LYS 29 Cb 0.03 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.34 1x59 h LYS 29 CO -0.13 0.45 -0.63 0.37 -0.57 0.00 0.00 179.45 178.94 1x59 h GLN 30 N 0.14 0.42 0.00 3.15 4.15 -1.14 -3.31 115.11 118.52 1x59 h GLN 30 Ca 0.02 -0.46 0.00 0.00 0.77 0.00 0.00 58.65 58.98 1x59 h GLN 30 Cb 0.62 0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.44 1x59 h GLN 30 CO 0.05 1.12 0.00 0.00 -1.93 0.00 0.00 178.83 178.07 1x59 n GLN 31 N -4.19 0.12 -3.68 1.69 10.64 0.78 -4.88 117.38 117.86 1x59 n GLN 31 Ca -0.10 0.14 -0.22 0.00 -1.83 0.00 0.00 57.00 54.99 1x59 n GLN 31 Cb 0.69 -1.50 0.03 0.00 -0.86 0.00 0.00 30.24 28.60 1x59 n GLN 31 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1x59 n LYS 32 N -1.41 -4.43 -1.04 2.61 4.76 -0.64 -5.01 118.16 113.00 1x59 n LYS 32 Ca 0.07 0.61 -0.27 0.00 -2.87 0.00 0.00 58.31 55.85 1x59 n LYS 32 Cb 0.19 -5.10 0.22 0.00 -1.84 0.00 0.00 35.03 28.50 1x59 n LYS 32 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x59 n ALA 33 N -4.21 -2.94 -1.67 7.82 0.00 -0.92 -4.97 120.51 113.62 1x59 n ALA 33 Ca -0.27 -1.50 -0.46 0.00 0.00 0.00 0.00 53.44 51.21 1x59 n ALA 33 Cb 0.67 -0.10 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 1x59 n ALA 33 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1x59 n SER 34 N -4.61 3.22 0.09 0.00 7.64 -1.26 -4.89 113.62 113.82 1x59 n SER 34 Ca 0.14 1.06 0.03 0.00 1.01 0.00 0.00 58.87 61.11 1x59 n SER 34 Cb 0.54 -1.43 0.41 0.00 -1.01 0.00 0.00 64.21 62.72 1x59 n SER 34 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x59 h ALA 35 N 6.61 1.59 -0.10 -0.43 0.00 -1.98 -1.41 119.26 123.54 1x59 h ALA 35 Ca -0.45 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.20 1x59 h ALA 35 Cb 1.25 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1x59 h ALA 35 CO 0.90 0.30 -0.38 1.49 0.00 0.00 0.00 179.25 181.57 1x59 h GLU 36 N 0.31 0.44 -0.52 0.00 4.57 -1.99 -2.61 114.58 114.78 1x59 h GLU 36 Ca 0.07 -0.34 0.08 0.00 -1.18 0.00 0.00 59.36 58.00 1x59 h GLU 36 Cb 0.23 0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.82 1x59 h GLU 36 CO 0.01 0.96 0.15 1.25 -1.18 0.00 0.00 179.01 180.20 1x59 h LEU 37 N 0.01 0.11 -0.38 1.64 5.85 -1.87 0.85 115.31 121.52 1x59 h LEU 37 Ca -0.02 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.86 1x59 h LEU 37 Cb 1.01 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 42.04 1x59 h LEU 37 CO 0.08 0.08 -0.14 0.40 -0.34 0.00 0.00 178.44 178.53 1x59 h ILE 38 N 0.31 0.53 -0.38 4.05 2.04 -1.25 0.34 117.51 123.15 1x59 h ILE 38 Ca 0.26 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.97 1x59 h ILE 38 Cb 0.31 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1x59 h ILE 38 CO -0.29 0.00 -0.35 -0.33 0.00 0.00 0.00 178.15 177.18 1x59 h GLU 39 N -0.06 0.88 -0.17 2.37 4.39 -0.97 -2.10 114.58 118.92 1x59 h GLU 39 Ca 0.19 -0.44 -0.01 0.00 0.34 0.00 0.00 59.36 59.44 1x59 h GLU 39 Cb 0.35 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1x59 h GLU 39 CO -0.43 1.08 0.08 0.93 -1.16 0.00 0.00 179.01 179.52 1x59 h GLU 40 N 0.73 0.25 -0.43 2.33 5.08 -0.48 0.49 114.58 122.55 1x59 h GLU 40 Ca 0.07 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 1x59 h GLU 40 Cb 0.92 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1x59 h GLU 40 CO 0.09 0.29 -0.16 0.93 -1.00 0.00 0.00 179.01 179.16 1x59 h GLU 41 N 0.14 0.81 -0.06 2.33 4.39 -0.95 -0.87 114.58 120.38 1x59 h GLU 41 Ca 0.06 -0.30 -0.00 0.00 0.34 0.00 0.00 59.36 59.46 1x59 h GLU 41 Cb 0.13 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1x59 h GLU 41 CO -0.01 0.92 0.04 0.28 -1.16 0.00 0.00 179.01 179.08 1x59 h VAL 42 N 0.72 1.05 -0.81 3.13 2.07 -1.22 0.57 116.25 121.76 1x59 h VAL 42 Ca 0.11 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1x59 h VAL 42 Cb 0.66 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 1x59 h VAL 42 CO 0.05 0.04 0.52 0.00 0.02 0.00 0.00 177.57 178.20 1x59 h ALA 43 N 0.98 1.06 -0.06 1.67 0.00 -0.44 0.88 119.26 123.36 1x59 h ALA 43 Ca 0.02 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.68 1x59 h ALA 43 Cb 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1x59 h ALA 43 CO -0.00 0.34 -0.85 0.87 0.00 0.00 0.00 179.25 179.61 1x59 h LYS 44 N 1.01 0.54 -0.29 0.00 1.57 -1.09 -0.72 116.57 117.58 1x59 h LYS 44 Ca 0.32 -0.50 0.03 0.00 -1.87 0.00 0.00 60.65 58.63 1x59 h LYS 44 Cb 0.00 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1x59 h LYS 44 CO -0.11 1.13 0.11 1.25 -0.57 0.00 0.00 179.45 181.26 1x59 h LEU 45 N 0.34 0.14 -0.51 2.94 5.85 -0.50 -0.06 115.31 123.51 1x59 h LEU 45 Ca -0.07 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.70 1x59 h LEU 45 Cb 1.47 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.48 1x59 h LEU 45 CO 0.16 0.11 0.31 -0.07 -0.34 0.00 0.00 178.44 178.61 1x59 h LEU 46 N 0.25 0.51 -0.62 2.25 3.38 -0.70 -0.53 115.31 119.85 1x59 h LEU 46 Ca 0.13 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1x59 h LEU 46 Cb 0.09 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1x59 h LEU 46 CO -0.12 0.36 0.22 0.11 0.09 0.00 0.00 178.44 179.10 1x59 h LYS 47 N 0.62 0.94 0.03 1.13 1.57 -0.86 -1.01 116.57 119.00 1x59 h LYS 47 Ca 0.20 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1x59 h LYS 47 Cb -0.01 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 1x59 h LYS 47 CO -0.08 0.81 -0.23 -0.07 -0.57 0.00 0.00 179.45 179.32 1x59 h LEU 48 N 0.87 -0.67 -1.47 2.94 3.38 -0.68 -2.56 115.31 117.11 1x59 h LEU 48 Ca 0.20 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.32 1x59 h LEU 48 Cb 0.24 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1x59 h LEU 48 CO -0.01 -0.30 0.42 0.11 0.09 0.00 0.00 178.44 178.75 1x59 h LYS 49 N -0.38 0.64 -0.52 1.13 1.57 -0.72 -0.14 116.57 118.15 1x59 h LYS 49 Ca 0.05 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1x59 h LYS 49 Cb 0.44 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1x59 h LYS 49 CO -0.19 0.42 0.24 0.00 -0.57 0.00 0.00 179.45 179.35 1x59 h ALA 50 N 1.65 1.44 -0.35 3.86 0.00 -0.80 -1.03 119.26 124.03 1x59 h ALA 50 Ca 0.27 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 1x59 h ALA 50 Cb 0.23 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1x59 h ALA 50 CO -0.08 0.44 -0.42 1.96 0.00 0.00 0.00 179.25 181.15 1x59 h GLN 51 N 0.74 0.90 -0.49 0.00 4.20 -0.76 -3.14 115.11 116.56 1x59 h GLN 51 Ca 0.18 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.35 1x59 h GLN 51 Cb 0.10 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1x59 h GLN 51 CO -0.02 1.15 0.16 -0.07 -0.67 0.00 0.00 178.83 179.38 1x59 h LEU 52 N 0.71 0.66 -8.46 1.46 -0.00 -0.98 -3.43 115.31 105.26 1x59 h LEU 52 Ca 0.05 -0.09 -0.56 0.00 -0.00 0.00 0.00 57.88 57.27 1x59 h LEU 52 Cb 1.02 -0.17 -0.09 0.00 -0.00 0.00 0.00 40.66 41.42 1x59 h LEU 52 CO 0.10 0.62 0.91 -0.83 -0.00 0.00 0.00 178.44 179.24 1x59 s GLY 53 N -3.67 1.11 0.66 0.83 0.00 -0.42 -5.01 107.32 100.81 1x59 s GLY 53 Ca -0.09 -1.16 -0.15 0.00 0.00 0.00 0.00 44.72 43.33 1x59 s GLY 53 CO 0.78 2.45 1.10 2.56 0.00 0.00 0.00 173.10 179.99 1x59 s PRO 54 N 5.00 2.85 -1.12 2.90 0.04 -1.26 -4.24 135.00 139.17 1x59 s PRO 54 Ca 0.37 1.33 -0.14 0.00 0.04 0.00 0.00 61.00 62.60 1x59 s PRO 54 Cb -0.09 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 1x59 s PRO 54 CO 0.20 -1.20 0.83 -0.25 0.04 0.00 0.00 177.00 176.62 1x59 n ASP 55 N -2.45 -5.51 -4.65 6.66 8.00 -1.26 -4.91 116.55 112.44 1x59 n ASP 55 Ca 0.10 -0.89 -0.43 0.00 0.71 0.00 0.00 54.79 54.28 1x59 n ASP 55 Cb 0.52 -4.10 -0.03 0.00 -0.02 0.00 0.00 41.12 37.49 1x59 n ASP 55 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1x59 s GLU 56 N -5.40 4.01 -1.13 -1.24 -1.05 -1.26 -4.93 118.70 107.70 1x59 s GLU 56 Ca 0.44 1.83 -0.21 0.00 -0.15 0.00 0.00 54.97 56.88 1x59 s GLU 56 Cb -0.12 -3.96 0.05 0.00 -0.44 0.00 0.00 34.13 29.66 1x59 s GLU 56 CO 0.81 -1.03 1.61 0.45 0.95 0.00 0.00 175.26 178.06 1x59 s SER 57 N 3.47 6.51 0.04 0.83 0.15 -1.26 -4.92 113.70 118.52 1x59 s SER 57 Ca 0.69 -1.82 -0.00 0.00 0.70 0.00 0.00 55.95 55.51 1x59 s SER 57 Cb -0.27 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.43 1x59 s SER 57 CO 0.26 -1.50 -0.03 -0.75 1.20 0.00 0.00 173.24 172.42 1x59 s LYS 58 N 4.84 0.54 0.65 5.44 2.20 -1.26 -5.16 119.74 126.99 1x59 s LYS 58 Ca 0.51 -1.04 -0.15 0.00 -0.36 0.00 0.00 55.97 54.93 1x59 s LYS 58 Cb 0.01 0.14 -0.01 0.00 -1.51 0.00 0.00 37.83 36.47 1x59 s LYS 58 CO -0.01 -0.08 1.10 -1.14 -0.36 0.00 0.00 175.35 174.86 1x59 s GLN 59 N -3.16 2.89 -0.75 4.03 -0.44 -1.26 -4.94 119.66 116.02 1x59 s GLN 59 Ca 0.00 1.36 -0.26 0.00 -2.50 0.00 0.00 55.36 53.96 1x59 s GLN 59 Cb 0.02 -1.96 0.01 0.00 -1.64 0.00 0.00 33.01 29.44 1x59 s GLN 59 CO -0.07 -1.17 1.50 -1.59 0.50 0.00 0.00 175.29 174.45 1x59 s LYS 60 N -4.08 3.06 0.02 1.67 -2.85 -1.26 -4.84 119.74 111.45 1x59 s LYS 60 Ca 0.66 -0.14 0.24 0.00 -1.00 0.00 0.00 55.97 55.73 1x59 s LYS 60 Cb -0.20 -4.45 1.01 0.00 -2.06 0.00 0.00 37.83 32.14 1x59 s LYS 60 CO 0.41 -2.39 1.77 1.19 0.10 0.00 0.00 175.35 176.42 1x59 n PHE 61 N 10.48 0.07 -3.78 1.78 3.01 -1.26 -4.94 117.46 122.83 1x59 n PHE 61 Ca 0.14 0.02 -0.25 0.00 1.01 0.00 0.00 57.45 58.37 1x59 n PHE 61 Cb 0.50 -0.54 0.02 0.00 -0.01 0.00 0.00 39.48 39.45 1x59 n PHE 61 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1x59 n VAL 62 N -1.56 -4.37 -3.42 -4.37 0.31 -1.26 -4.96 118.33 98.69 1x59 n VAL 62 Ca 0.06 -0.62 -0.22 0.00 -0.01 0.00 0.00 64.34 63.55 1x59 n VAL 62 Cb 0.29 -3.56 -0.10 0.00 -0.91 0.00 0.00 33.84 29.55 1x59 n VAL 62 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1x59 s LEU 63 N -6.70 0.21 -0.15 7.52 0.20 -1.26 -5.08 118.68 113.41 1x59 s LEU 63 Ca 0.11 -1.43 -0.29 0.00 0.69 0.00 0.00 54.13 53.21 1x59 s LEU 63 Cb -0.04 0.18 -0.05 0.00 -0.43 0.00 0.00 46.19 45.86 1x59 s LEU 63 CO 0.85 -0.34 1.89 -1.59 -0.29 0.00 0.00 176.35 176.87 1x59 s LYS 64 N 1.73 3.69 0.72 1.98 0.00 -1.26 -5.01 119.74 121.59 1x59 s LYS 64 Ca 0.14 2.02 -0.15 0.00 0.00 0.00 0.00 55.97 57.97 1x59 s LYS 64 Cb -0.17 -4.17 0.04 0.00 0.00 0.00 0.00 37.83 33.53 1x59 s LYS 64 CO -0.16 -1.45 1.23 0.99 0.00 0.00 0.00 175.35 175.96 1x59 s THR 65 N 5.92 2.20 0.00 3.79 2.01 -1.26 -5.06 115.64 123.24 1x59 s THR 65 Ca 0.84 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.95 1x59 s THR 65 Cb -0.32 -2.74 0.00 0.00 0.01 0.00 0.00 72.50 69.45 1x59 s THR 65 CO 0.34 -0.05 0.00 -0.81 -0.69 0.00 0.00 174.62 173.41 1x59 n PRO 66 N -2.63 -0.63 0.00 4.92 -0.04 -1.26 -5.05 135.00 130.32 1x59 n PRO 66 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 1x59 n PRO 66 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 1x59 n PRO 66 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1x59 n LYS 67 N -1.16 2.15 -4.00 0.54 5.02 -1.26 -5.12 118.16 114.32 1x59 n LYS 67 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1x59 n LYS 67 Cb 0.00 -0.71 -0.07 0.00 -0.02 0.00 0.00 35.03 34.23 1x59 n LYS 67 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1x59 s SER 68 N -1.59 0.02 0.63 4.39 0.01 -1.26 -5.18 113.70 110.71 1x59 s SER 68 Ca 0.00 -0.95 -0.01 0.00 1.31 0.00 0.00 55.95 56.30 1x59 s SER 68 Cb 0.00 0.47 0.09 0.00 0.21 0.00 0.00 66.02 66.79 1x59 s SER 68 CO 0.00 -0.95 0.61 0.61 0.41 0.00 0.00 173.24 173.92 1x59 n GLY 69 N -0.27 0.52 0.00 3.44 0.00 -1.26 -5.09 105.19 102.54 1x59 n GLY 69 Ca -0.05 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1x59 n GLY 69 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x59 n PRO 70 N -2.15 0.00 -3.59 1.61 -0.04 -1.26 -4.87 135.00 124.70 1x59 n PRO 70 Ca 0.10 0.45 -0.14 0.00 -0.04 0.00 0.00 63.50 63.87 1x59 n PRO 70 Cb 0.35 -1.21 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 1x59 n PRO 70 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x59 s SER 71 N -2.38 0.56 -0.04 3.54 0.15 -1.26 -5.06 113.70 109.21 1x59 s SER 71 Ca 0.00 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.02 1x59 s SER 71 Cb 0.00 0.70 0.03 0.00 -1.71 0.00 0.00 66.02 65.04 1x59 s SER 71 CO 0.00 -0.27 1.68 -1.20 1.20 0.00 0.00 173.24 174.65 1x59 n SER 72 N 5.35 4.66 0.00 5.45 7.64 -1.26 -5.31 113.62 130.14 1x59 n SER 72 Ca -0.06 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.46 1x59 n SER 72 Cb 0.50 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 1x59 n SER 72 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64