#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zts h LEU 2 N 0.00 -0.17 0.00 4.03 7.12 -1.94 -3.48 115.31 120.86 1zts h LEU 2 Ca 0.00 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.02 1zts h LEU 2 Cb 0.00 0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.18 1zts h LEU 2 CO 0.00 -0.08 0.00 0.18 -0.13 0.00 0.00 178.44 178.41 1zts n LEU 3 N -2.80 0.00 0.00 2.25 4.77 -1.26 -5.15 117.00 114.80 1zts n LEU 3 Ca -0.03 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.85 1zts n LEU 3 Cb 0.08 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 1zts n LEU 3 CO 0.06 0.00 0.25 2.30 -1.33 0.00 0.00 177.39 178.68 1zts n ILE 4 N 0.00 0.00 -4.34 -0.08 -5.35 -1.26 -5.10 119.36 103.23 1zts n ILE 4 Ca 0.00 -0.25 -0.18 0.00 -0.27 0.00 0.00 62.75 62.05 1zts n ILE 4 Cb 0.00 -1.45 -0.10 0.00 -1.74 0.00 0.00 39.64 36.35 1zts n ILE 4 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1zts s THR 5 N -1.84 1.72 0.31 7.28 -4.23 -1.26 -5.04 115.64 112.58 1zts s THR 5 Ca 0.25 -2.21 0.14 0.00 -1.18 0.00 0.00 61.69 58.69 1zts s THR 5 Cb -0.02 -2.04 0.08 0.00 1.34 0.00 0.00 72.50 71.86 1zts s THR 5 CO 0.18 -0.60 1.76 1.55 -0.54 0.00 0.00 174.62 176.97 1zts h PRO 6 N 2.56 0.00 -0.05 3.99 0.13 -1.89 -2.92 132.00 133.82 1zts h PRO 6 Ca -0.38 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.64 1zts h PRO 6 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1zts h PRO 6 CO 0.62 0.43 -0.49 -0.44 -0.23 0.00 0.00 178.00 177.90 1zts h ASP 7 N 0.00 0.14 0.00 1.44 3.32 -1.93 -2.98 116.42 116.40 1zts h ASP 7 Ca -0.00 -0.06 -0.13 0.00 0.02 0.00 0.00 57.03 56.85 1zts h ASP 7 Cb 0.82 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1zts h ASP 7 CO 0.06 0.61 -0.41 -0.08 -1.72 0.00 0.00 179.24 177.69 1zts h GLU 8 N 0.10 0.52 -0.25 3.56 4.22 -1.94 -2.41 114.58 118.38 1zts h GLU 8 Ca 0.00 -0.26 0.05 0.00 0.08 0.00 0.00 59.36 59.23 1zts h GLU 8 Cb 0.90 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.11 1zts h GLU 8 CO 0.07 0.84 -0.07 1.25 -2.18 0.00 0.00 179.01 178.92 1zts h LEU 9 N 0.43 -0.25 -0.94 1.64 5.85 -1.50 -0.10 115.31 120.43 1zts h LEU 9 Ca 0.04 0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 1zts h LEU 9 Cb 0.90 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1zts h LEU 9 CO 0.08 -0.09 -0.49 0.07 -0.34 0.00 0.00 178.44 177.66 1zts h LYS 10 N -0.01 0.00 -0.42 1.25 2.10 -1.60 0.27 116.57 118.16 1zts h LYS 10 Ca 0.12 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.68 1zts h LYS 10 Cb 0.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.51 1zts h LYS 10 CO -0.27 0.49 -0.12 1.03 -2.00 0.00 0.00 179.45 178.59 1zts h SER 11 N 0.00 0.74 0.01 7.07 0.87 -0.74 -3.31 113.55 118.19 1zts h SER 11 Ca -0.00 -0.22 -0.26 0.00 -1.23 0.00 0.00 61.79 60.07 1zts h SER 11 Cb 0.93 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.66 1zts h SER 11 CO 0.06 0.89 -1.44 0.00 -0.53 0.00 0.00 176.83 175.81 1zts n TYR 12 N -4.16 0.94 -0.71 2.24 9.36 -0.16 -4.96 117.16 119.72 1zts n TYR 12 Ca 0.01 0.39 -0.32 0.00 3.32 0.00 0.00 57.90 61.30 1zts n TYR 12 Cb 0.37 -1.10 0.16 0.00 -0.63 0.00 0.00 39.34 38.13 1zts n TYR 12 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 1zts n SER 13 N -4.34 -1.46 -0.14 2.98 3.41 0.95 -4.95 113.62 110.06 1zts n SER 13 Ca -0.34 0.23 0.09 0.00 -0.26 0.00 0.00 58.87 58.59 1zts n SER 13 Cb 0.73 -1.24 0.13 0.00 -0.26 0.00 0.00 64.21 63.57 1zts n SER 13 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1zts n VAL 14 N -4.05 1.77 -3.58 -3.33 0.24 -1.26 -4.85 118.33 103.27 1zts n VAL 14 Ca 0.07 -2.16 -0.39 0.00 -2.04 0.00 0.00 64.34 59.81 1zts n VAL 14 Cb 0.55 -0.18 -0.11 0.00 -1.47 0.00 0.00 33.84 32.62 1zts n VAL 14 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1zts s PHE 15 N -2.68 3.21 0.55 6.34 0.40 -1.26 -4.95 117.98 119.59 1zts s PHE 15 Ca 0.30 -0.29 0.23 0.00 -0.60 0.00 0.00 56.93 56.58 1zts s PHE 15 Cb 0.27 -2.42 1.48 0.00 0.51 0.00 0.00 43.02 42.86 1zts s PHE 15 CO 0.02 -0.36 2.13 1.49 0.70 0.00 0.00 175.22 179.19 1zts h GLU 16 N 8.43 0.00 -0.66 0.44 4.81 -1.97 -1.14 114.58 124.50 1zts h GLU 16 Ca -0.32 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.83 1zts h GLU 16 Cb 1.16 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 1zts h GLU 16 CO 0.62 0.00 0.09 1.03 -0.73 0.00 0.00 179.01 180.02 1zts h SER 17 N 0.00 1.05 0.67 1.04 0.87 -1.92 -2.07 113.55 113.19 1zts h SER 17 Ca 0.07 -0.26 -0.18 0.00 -1.23 0.00 0.00 61.79 60.19 1zts h SER 17 Cb 0.31 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1zts h SER 17 CO -0.00 1.05 -0.84 0.58 -0.53 0.00 0.00 176.83 177.09 1zts h VAL 18 N 1.02 1.53 0.00 2.23 2.07 -1.45 -2.99 116.25 118.65 1zts h VAL 18 Ca 0.20 -2.65 0.00 0.00 0.82 0.00 0.00 66.70 65.06 1zts h VAL 18 Cb 0.45 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1zts h VAL 18 CO 0.01 0.77 0.00 0.29 0.02 0.00 0.00 177.57 178.66 1zts n LYS 19 N -3.63 0.85 0.00 1.57 5.02 -0.81 -2.82 118.16 118.33 1zts n LYS 19 Ca -0.02 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.34 1zts n LYS 19 Cb 0.79 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 34.32 1zts n LYS 19 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1zts n THR 20 N -1.07 0.00 -3.22 -0.18 -2.24 -0.80 -4.99 114.28 101.78 1zts n THR 20 Ca 0.21 -0.41 -0.30 0.00 -2.27 0.00 0.00 64.05 61.28 1zts n THR 20 Cb 0.14 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.56 1zts n THR 20 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1zts s ARG 21 N -1.57 3.74 0.73 -0.78 0.52 -1.13 -5.09 118.95 115.38 1zts s ARG 21 Ca 0.14 0.25 -0.12 0.00 -0.52 0.00 0.00 55.73 55.48 1zts s ARG 21 Cb 0.12 -2.56 0.18 0.00 0.52 0.00 0.00 34.95 33.21 1zts s ARG 21 CO 0.30 0.17 0.65 -0.35 0.02 0.00 0.00 175.30 176.09 1zts n PRO 22 N -0.77 -2.29 0.06 3.54 -0.04 -1.26 -4.76 135.00 129.48 1zts n PRO 22 Ca 0.00 -1.04 -0.07 0.00 -0.04 0.00 0.00 63.50 62.35 1zts n PRO 22 Cb 0.53 -0.98 -0.12 0.00 -0.04 0.00 0.00 33.50 32.90 1zts n PRO 22 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1zts h ASP 23 N -2.04 0.01 0.41 3.54 3.45 -1.98 -1.98 116.42 117.82 1zts h ASP 23 Ca -0.24 -0.01 -0.17 0.00 0.43 0.00 0.00 57.03 57.04 1zts h ASP 23 Cb 0.75 -0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.51 1zts h ASP 23 CO 0.16 1.01 -0.69 1.05 -1.57 0.00 0.00 179.24 179.19 1zts h GLU 24 N 0.00 0.25 0.00 3.56 4.11 -2.00 -2.85 114.58 117.66 1zts h GLU 24 Ca -0.02 -0.20 -0.05 0.00 0.07 0.00 0.00 59.36 59.16 1zts h GLU 24 Cb 1.78 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.06 1zts h GLU 24 CO 0.13 0.85 -0.25 -0.07 0.07 0.00 0.00 179.01 179.74 1zts h LEU 25 N 0.17 0.00 -0.70 3.06 3.38 -1.93 -2.99 115.31 116.30 1zts h LEU 25 Ca -0.02 -0.89 0.14 0.00 0.09 0.00 0.00 57.88 57.20 1zts h LEU 25 Cb 1.24 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.89 1zts h LEU 25 CO 0.11 1.09 0.18 -0.07 0.09 0.00 0.00 178.44 179.84 1zts h LEU 26 N -1.00 0.05 -0.61 1.67 3.38 -1.45 0.01 115.31 117.35 1zts h LEU 26 Ca -0.07 0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1zts h LEU 26 Cb 1.05 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 1zts h LEU 26 CO -0.04 -0.00 -0.05 0.07 0.09 0.00 0.00 178.44 178.51 1zts h LYS 27 N 0.29 1.05 -0.84 1.13 2.10 -1.64 -2.75 116.57 115.92 1zts h LYS 27 Ca 0.39 -0.36 0.14 0.00 -2.00 0.00 0.00 60.65 58.82 1zts h LYS 27 Cb 0.63 -0.08 -0.06 0.00 -0.90 0.00 0.00 32.23 31.81 1zts h LYS 27 CO -0.47 1.05 0.55 1.96 -2.00 0.00 0.00 179.45 180.54 1zts h GLN 28 N 0.95 0.60 -0.00 0.07 4.20 -0.85 0.21 115.11 120.28 1zts h GLN 28 Ca 0.16 -0.04 -0.17 0.00 0.06 0.00 0.00 58.65 58.66 1zts h GLN 28 Cb 0.61 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1zts h GLN 28 CO 0.04 0.39 -0.81 -0.44 -0.67 0.00 0.00 178.83 177.35 1zts h ASP 29 N 0.61 0.07 0.04 1.46 3.45 -1.13 -2.92 116.42 117.99 1zts h ASP 29 Ca 0.42 -0.05 -0.00 0.00 0.43 0.00 0.00 57.03 57.82 1zts h ASP 29 Cb 0.73 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.48 1zts h ASP 29 CO -0.17 0.84 -0.02 0.40 -1.57 0.00 0.00 179.24 178.72 1zts h ILE 30 N 0.03 1.37 -0.14 0.35 2.04 -0.61 -2.67 117.51 117.89 1zts h ILE 30 Ca -0.02 -1.55 0.04 0.00 1.00 0.00 0.00 64.86 64.34 1zts h ILE 30 Cb 1.42 2.37 -0.01 0.00 -0.74 0.00 0.00 36.82 39.86 1zts h ILE 30 CO 0.11 0.38 0.11 -0.07 0.00 0.00 0.00 178.15 178.68 1zts h LEU 31 N -0.76 0.00 -0.06 1.44 3.38 -0.80 0.52 115.31 119.03 1zts h LEU 31 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1zts h LEU 31 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1zts h LEU 31 CO 0.01 0.00 -0.44 -0.08 0.09 0.00 0.00 178.44 178.02 1zts h GLU 32 N 0.00 0.00 -0.23 1.13 4.57 -1.52 -3.29 114.58 115.24 1zts h GLU 32 Ca 0.06 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.08 1zts h GLU 32 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1zts h GLU 32 CO -0.00 0.44 -0.48 0.00 -1.18 0.00 0.00 179.01 177.78 1zts h ALA 33 N 1.56 0.37 -0.08 2.92 0.00 -0.53 -3.00 119.26 120.50 1zts h ALA 33 Ca -0.00 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.44 1zts h ALA 33 Cb 1.31 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1zts h ALA 33 CO 0.06 0.53 0.17 0.00 0.00 0.00 0.00 179.25 180.01 1zts h THR 34 N 0.45 0.21 -0.17 0.00 1.03 -1.55 0.16 112.91 113.04 1zts h THR 34 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 66.41 66.32 1zts h THR 34 Cb 1.09 0.85 -0.01 0.00 -1.07 0.00 0.00 68.15 69.01 1zts h THR 34 CO 0.11 0.00 -0.28 0.00 -0.01 0.00 0.00 175.52 175.33 1zts h ALA 35 N 1.73 1.21 0.02 0.00 0.00 -1.65 -1.97 119.26 118.60 1zts h ALA 35 Ca 0.04 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1zts h ALA 35 Cb 0.37 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1zts h ALA 35 CO -0.00 0.52 -0.24 0.22 0.00 0.00 0.00 179.25 179.75 1zts h ASP 36 N 0.28 0.19 -0.86 0.00 -0.00 -1.10 -2.62 116.42 112.31 1zts h ASP 36 Ca 0.04 -0.84 0.06 0.00 -0.00 0.00 0.00 57.03 56.29 1zts h ASP 36 Cb 0.65 -0.06 -0.06 0.00 -0.00 0.00 0.00 39.33 39.86 1zts h ASP 36 CO 0.05 1.01 0.53 0.40 -0.00 0.00 0.00 179.24 181.23 1zts h ILE 37 N -0.61 1.04 -0.20 2.25 2.04 -1.50 -1.54 117.51 118.98 1zts h ILE 37 Ca -0.03 -0.33 -0.12 0.00 1.00 0.00 0.00 64.86 65.37 1zts h ILE 37 Cb 1.06 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1zts h ILE 37 CO 0.05 0.18 -0.40 0.40 0.00 0.00 0.00 178.15 178.37 1zts h ILE 38 N 0.97 1.30 0.00 -0.67 2.04 -1.45 -2.59 117.51 117.12 1zts h ILE 38 Ca 0.38 -1.55 -0.02 0.00 1.00 0.00 0.00 64.86 64.67 1zts h ILE 38 Cb 0.18 1.58 -0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1zts h ILE 38 CO -0.18 0.48 -0.08 -0.07 0.00 0.00 0.00 178.15 178.30 1zts h LEU 39 N 0.39 0.00 0.06 1.44 3.38 -0.90 0.26 115.31 119.94 1zts h LEU 39 Ca 0.04 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1zts h LEU 39 Cb 0.87 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 1zts h LEU 39 CO 0.07 0.08 -0.79 0.11 0.09 0.00 0.00 178.44 178.01 1zts h LYS 40 N 0.00 0.13 0.00 1.13 1.57 -1.07 -3.34 116.57 115.00 1zts h LYS 40 Ca -0.00 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.47 1zts h LYS 40 Cb 0.35 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1zts h LYS 40 CO 0.01 1.11 -0.39 -0.39 -0.57 0.00 0.00 179.45 179.22 1zts h VAL 41 N -0.67 0.87 -0.40 0.50 -1.51 -1.31 -3.48 116.25 110.25 1zts h VAL 41 Ca -0.18 -1.61 -0.02 0.00 -1.23 0.00 0.00 66.70 63.67 1zts h VAL 41 Cb 1.40 1.99 0.00 0.00 -2.13 0.00 0.00 31.29 32.56 1zts h VAL 41 CO 0.01 0.38 -0.02 0.61 -1.23 0.00 0.00 177.57 177.32 1zts n GLY 42 N 0.37 0.49 3.64 5.19 0.00 0.88 -3.20 105.19 112.54 1zts n GLY 42 Ca 0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 45.17 1zts n GLY 42 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1zts s HIS 43 N -2.30 -0.20 0.00 1.61 -3.43 -1.08 -4.97 115.29 104.93 1zts s HIS 43 Ca 0.01 0.45 0.00 0.00 -0.80 0.00 0.00 55.06 54.72 1zts s HIS 43 Cb -0.00 0.45 0.00 0.00 -1.43 0.00 0.00 32.58 31.60 1zts s HIS 43 CO 0.01 -0.12 0.00 -0.40 -2.00 0.00 0.00 174.74 172.23 1zts n ASP 44 N 1.49 0.51 -2.71 7.38 5.68 -1.26 -4.68 116.55 122.95 1zts n ASP 44 Ca -0.09 -0.99 -0.19 0.00 -0.50 0.00 0.00 54.79 53.02 1zts n ASP 44 Cb 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 1zts n ASP 44 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1zts n PHE 45 N -0.74 2.19 0.02 2.11 3.72 -1.26 -4.87 117.46 118.64 1zts n PHE 45 Ca 0.00 -3.22 -0.19 0.00 -0.05 0.00 0.00 57.45 53.99 1zts n PHE 45 Cb 0.00 -0.30 -0.11 0.00 -0.94 0.00 0.00 39.48 38.13 1zts n PHE 45 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1zts h SER 46 N 2.85 0.64 -1.51 4.37 4.64 -1.98 -3.43 113.55 119.13 1zts h SER 46 Ca 0.10 -0.78 -0.67 0.00 -0.47 0.00 0.00 61.79 59.97 1zts h SER 46 Cb 0.97 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1zts h SER 46 CO 0.66 1.34 1.20 0.47 -0.87 0.00 0.00 176.83 179.64 1zts n ASP 47 N -4.10 2.64 0.29 4.97 10.43 -1.26 -4.79 116.55 124.73 1zts n ASP 47 Ca -0.11 0.73 0.19 0.00 2.57 0.00 0.00 54.79 58.17 1zts n ASP 47 Cb 0.76 -1.28 0.98 0.00 1.84 0.00 0.00 41.12 43.43 1zts n ASP 47 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1zts h ALA 48 N 10.31 1.39 -0.58 2.24 0.00 -2.02 0.11 119.26 130.72 1zts h ALA 48 Ca -0.39 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.35 1zts h ALA 48 Cb 1.30 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.99 1zts h ALA 48 CO 0.98 -0.15 0.22 -0.85 0.00 0.00 0.00 179.25 179.45 1zts n GLU 49 N -3.38 3.10 -2.69 0.00 0.28 -1.26 -4.36 120.64 112.33 1zts n GLU 49 Ca -0.01 -2.35 -0.06 0.00 -0.16 0.00 0.00 57.16 54.58 1zts n GLU 49 Cb 0.21 -2.00 0.10 0.00 1.43 0.00 0.00 31.44 31.18 1zts n GLU 49 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 1zts n TYR 50 N -0.05 -1.57 -3.33 -1.84 9.36 0.39 -5.06 117.16 115.06 1zts n TYR 50 Ca 0.32 -1.39 -0.31 0.00 3.32 0.00 0.00 57.90 59.84 1zts n TYR 50 Cb 1.16 1.39 -0.06 0.00 -0.63 0.00 0.00 39.34 41.20 1zts n TYR 50 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 1zts n ILE 51 N 0.43 3.03 -2.26 2.97 5.41 -1.22 -4.62 119.36 123.10 1zts n ILE 51 Ca -0.00 -5.39 -0.36 0.00 1.00 0.00 0.00 62.75 58.00 1zts n ILE 51 Cb 0.73 -2.09 -0.00 0.00 -0.71 0.00 0.00 39.64 37.57 1zts n ILE 51 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1zts s PRO 52 N -2.56 3.48 -0.46 0.38 0.04 -1.26 -5.03 135.00 129.60 1zts s PRO 52 Ca 0.38 1.66 0.06 0.00 0.04 0.00 0.00 61.00 63.13 1zts s PRO 52 Cb 0.13 -2.12 0.19 0.00 0.04 0.00 0.00 34.50 32.73 1zts s PRO 52 CO 0.02 -0.75 0.53 -0.11 0.04 0.00 0.00 177.00 176.72 1zts n LEU 53 N -1.06 -1.77 0.00 -3.56 7.94 -1.26 -5.07 117.00 112.23 1zts n LEU 53 Ca 0.10 -3.76 -0.02 0.00 -1.11 0.00 0.00 56.01 51.23 1zts n LEU 53 Cb 0.50 0.65 0.01 0.00 0.53 0.00 0.00 43.42 45.12 1zts n LEU 53 CO 0.44 1.91 0.04 -0.81 -1.11 0.00 0.00 177.39 177.85 1zts n PRO 54 N 2.74 -1.15 0.14 1.96 -0.04 -1.26 -4.90 135.00 132.49 1zts n PRO 54 Ca 0.24 -0.10 0.07 0.00 -0.04 0.00 0.00 63.50 63.67 1zts n PRO 54 Cb 0.52 -0.10 0.05 0.00 -0.04 0.00 0.00 33.50 33.93 1zts n PRO 54 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1zts h GLU 55 N 0.00 0.00 -0.00 0.54 4.81 -2.00 -3.25 114.58 114.67 1zts h GLU 55 Ca -0.02 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1zts h GLU 55 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1zts h GLU 55 CO 0.02 0.18 -0.06 1.79 -0.73 0.00 0.00 179.01 180.20 1zts h THR 56 N 0.00 1.58 -0.42 0.32 1.35 -1.93 -3.17 112.91 110.65 1zts h THR 56 Ca -0.03 -1.79 0.04 0.00 -0.55 0.00 0.00 66.41 64.08 1zts h THR 56 Cb 1.20 2.77 -0.04 0.00 -1.73 0.00 0.00 68.15 70.35 1zts h THR 56 CO 0.02 0.47 0.20 0.58 -0.25 0.00 0.00 175.52 176.54 1zts h VAL 57 N -0.68 0.95 -0.73 6.82 2.07 -1.81 0.14 116.25 123.01 1zts h VAL 57 Ca -0.01 -0.14 0.13 0.00 0.82 0.00 0.00 66.70 67.51 1zts h VAL 57 Cb 0.81 0.52 -0.09 0.00 -1.52 0.00 0.00 31.29 31.00 1zts h VAL 57 CO 0.01 0.07 0.28 -0.09 0.02 0.00 0.00 177.57 177.87 1zts h ARG 58 N 0.40 0.42 -0.11 1.57 2.43 -1.66 -0.55 114.38 116.87 1zts h ARG 58 Ca 0.18 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 1zts h ARG 58 Cb 0.11 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1zts h ARG 58 CO -0.14 0.28 -0.49 1.25 -1.51 0.00 0.00 179.97 179.36 1zts h LEU 59 N 0.43 0.62 -0.64 3.80 5.85 -1.38 -2.75 115.31 121.24 1zts h LEU 59 Ca 0.40 -0.63 0.12 0.00 0.84 0.00 0.00 57.88 58.60 1zts h LEU 59 Cb 0.59 -0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.34 1zts h LEU 59 CO -0.39 1.15 0.17 0.00 -0.34 0.00 0.00 178.44 179.03 1zts h ALA 60 N 0.49 0.80 -0.34 1.25 0.00 0.13 -0.82 119.26 120.77 1zts h ALA 60 Ca -0.03 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1zts h ALA 60 Cb 1.13 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1zts h ALA 60 CO 0.10 -0.28 -0.02 -0.07 0.00 0.00 0.00 179.25 178.98 1zts h LEU 61 N 0.31 0.60 -1.98 0.00 4.07 -1.17 -2.63 115.31 114.50 1zts h LEU 61 Ca 0.34 -0.32 0.09 0.00 0.08 0.00 0.00 57.88 58.07 1zts h LEU 61 Cb 0.51 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 1zts h LEU 61 CO -0.40 0.78 0.23 -0.07 -1.08 0.00 0.00 178.44 177.90 1zts h LEU 62 N 0.41 0.02 0.07 1.67 3.38 -0.98 0.26 115.31 120.13 1zts h LEU 62 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1zts h LEU 62 Cb 0.48 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1zts h LEU 62 CO 0.02 0.01 -0.03 0.11 0.09 0.00 0.00 178.44 178.64 1zts h LYS 63 N 0.02 -0.09 -0.34 1.13 1.79 -0.88 -3.13 116.57 115.06 1zts h LYS 63 Ca 0.15 0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.57 1zts h LYS 63 Cb 0.59 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.24 1zts h LYS 63 CO -0.00 0.45 -0.06 -0.07 -1.08 0.00 0.00 179.45 178.69 1zts h LEU 64 N -0.74 0.53 -1.27 2.94 3.38 -1.08 -2.55 115.31 116.52 1zts h LEU 64 Ca -0.01 -0.12 0.08 0.00 0.09 0.00 0.00 57.88 57.91 1zts h LEU 64 Cb 0.59 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 1zts h LEU 64 CO 0.02 0.64 0.53 0.77 0.09 0.00 0.00 178.44 180.50 1zts h SER 65 N 0.53 0.76 0.60 -0.43 4.64 -0.56 -1.32 113.55 117.76 1zts h SER 65 Ca 0.10 0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.22 1zts h SER 65 Cb 0.42 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1zts h SER 65 CO 0.02 0.47 -0.96 -0.61 -0.87 0.00 0.00 176.83 174.88 1zts h GLN 66 N 0.85 0.22 0.40 4.77 4.15 -1.41 -2.24 115.11 121.85 1zts h GLN 66 Ca 0.36 -0.27 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 1zts h GLN 66 Cb 0.31 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1zts h GLN 66 CO -0.14 1.02 -0.30 0.35 -1.93 0.00 0.00 178.83 177.83 1zts h PHE 67 N 0.11 -0.81 0.03 3.99 3.57 -0.89 0.15 116.94 123.10 1zts h PHE 67 Ca -0.06 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1zts h PHE 67 Cb 1.62 0.30 0.00 0.00 2.79 0.00 0.00 35.95 40.66 1zts h PHE 67 CO 0.04 -0.45 -0.02 1.88 -2.23 0.00 0.00 178.31 177.53 1zts h TYR 68 N -0.70 -0.04 -0.39 0.41 -1.99 -1.54 -2.97 116.97 109.75 1zts h TYR 68 Ca -0.04 -0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.81 1zts h TYR 68 Cb 0.60 0.01 -0.02 0.00 2.00 0.00 0.00 36.73 39.33 1zts h TYR 68 CO -0.14 0.40 0.37 0.00 -0.00 0.00 0.00 178.16 178.79 1zts h ALA 69 N 0.45 2.15 -0.14 3.88 0.00 -1.39 -0.03 119.26 124.17 1zts h ALA 69 Ca -0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1zts h ALA 69 Cb 0.46 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1zts h ALA 69 CO 0.01 -0.57 -0.18 1.25 0.00 0.00 0.00 179.25 179.76 1zts h LEU 70 N 0.00 0.40 -2.39 0.00 5.85 -0.53 -3.07 115.31 115.57 1zts h LEU 70 Ca 0.19 -0.51 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1zts h LEU 70 Cb 0.92 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1zts h LEU 70 CO -0.00 0.83 0.00 2.30 -0.34 0.00 0.00 178.44 181.22 1zts n ILE 71 N -4.52 1.46 -0.05 4.05 -5.35 -0.35 -3.02 119.36 111.58 1zts n ILE 71 Ca -0.06 -0.82 0.00 0.00 -0.27 0.00 0.00 62.75 61.60 1zts n ILE 71 Cb 0.39 -0.18 -0.15 0.00 -1.74 0.00 0.00 39.64 37.96 1zts n ILE 71 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1zts n ASN 72 N 0.52 0.55 -0.41 7.28 3.02 -0.17 -4.60 115.26 121.44 1zts n ASN 72 Ca 0.17 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.74 1zts n ASN 72 Cb 0.73 1.41 0.03 0.00 -0.61 0.00 0.00 39.78 41.33 1zts n ASN 72 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zts n GLY 73 N 1.65 1.30 0.00 7.41 0.00 -1.22 -5.07 105.19 109.25 1zts n GLY 73 Ca -0.17 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1zts n GLY 73 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zts n ASP 74 N -0.27 -1.42 -2.42 1.61 -0.08 -1.17 -4.81 116.55 107.98 1zts n ASP 74 Ca 0.03 -0.05 -0.24 0.00 -1.51 0.00 0.00 54.79 53.02 1zts n ASP 74 Cb 0.69 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 44.06 1zts n ASP 74 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1zts n GLU 75 N -1.48 2.45 -2.58 -0.67 1.02 -1.26 -4.76 120.64 113.36 1zts n GLU 75 Ca 0.00 -2.01 -0.06 0.00 -0.02 0.00 0.00 57.16 55.07 1zts n GLU 75 Cb 0.00 -2.15 0.01 0.00 -0.02 0.00 0.00 31.44 29.28 1zts n GLU 75 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1zts n SER 76 N 1.48 -6.83 -4.77 1.62 2.88 -1.26 -4.98 113.62 101.76 1zts n SER 76 Ca 0.49 0.49 -0.38 0.00 -1.33 0.00 0.00 58.87 58.14 1zts n SER 76 Cb 0.64 -4.56 -0.06 0.00 -0.75 0.00 0.00 64.21 59.47 1zts n SER 76 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1zts s ILE 77 N -2.23 4.05 0.00 2.46 1.01 -1.26 -5.03 121.20 120.20 1zts s ILE 77 Ca 0.19 1.79 -0.24 0.00 0.00 0.00 0.00 60.65 62.39 1zts s ILE 77 Cb -0.05 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 1zts s ILE 77 CO 0.62 0.23 0.71 -0.63 0.00 0.00 0.00 174.94 175.87 1zts s ILE 78 N -1.48 4.86 0.01 2.92 1.09 -1.16 -4.95 121.20 122.49 1zts s ILE 78 Ca 0.48 1.50 0.00 0.00 -1.10 0.00 0.00 60.65 61.53 1zts s ILE 78 Cb -0.22 -4.06 -0.00 0.00 -1.06 0.00 0.00 42.46 37.12 1zts s ILE 78 CO 0.28 0.34 0.00 0.29 -0.10 0.00 0.00 174.94 175.75 1zts n LYS 79 N 3.08 0.01 0.00 2.79 4.01 -1.26 -0.13 118.16 126.66 1zts n LYS 79 Ca -0.03 -0.05 0.00 0.00 -0.51 0.00 0.00 58.31 57.72 1zts n LYS 79 Cb 0.51 0.04 0.00 0.00 -0.51 0.00 0.00 35.03 35.07 1zts n LYS 79 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1zts n GLY 80 N -0.01 -2.48 3.15 0.72 0.00 -1.18 -4.92 105.19 100.46 1zts n GLY 80 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 46.02 46.16 1zts n GLY 80 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1zts s TYR 81 N -0.46 -0.08 -0.29 1.61 5.04 -1.26 -5.16 117.35 116.75 1zts s TYR 81 Ca 0.00 0.05 -0.15 0.00 -2.44 0.00 0.00 57.07 54.53 1zts s TYR 81 Cb 0.00 0.01 0.14 0.00 0.35 0.00 0.00 41.96 42.47 1zts s TYR 81 CO 0.00 -0.04 0.89 0.95 -1.34 0.00 0.00 175.55 176.01 1zts s THR 82 N 2.99 -0.38 0.22 4.34 -4.23 -1.26 -5.14 115.64 112.18 1zts s THR 82 Ca 0.32 0.00 -0.32 0.00 -1.18 0.00 0.00 61.69 60.51 1zts s THR 82 Cb 0.00 -1.00 -0.12 0.00 1.34 0.00 0.00 72.50 72.73 1zts s THR 82 CO -0.22 0.00 1.68 0.42 -0.54 0.00 0.00 174.62 175.96 1zts s THR 83 N 2.10 2.10 0.06 3.99 -4.23 -1.26 -4.74 115.64 113.67 1zts s THR 83 Ca -0.06 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 1zts s THR 83 Cb -0.06 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.73 1zts s THR 83 CO -0.17 0.01 0.00 -0.62 -0.54 0.00 0.00 174.62 173.30 1zts n GLU 84 N 3.65 -0.55 -3.25 3.99 -0.58 -1.26 -4.55 120.64 118.09 1zts n GLU 84 Ca 0.14 0.36 -0.40 0.00 -0.42 0.00 0.00 57.16 56.84 1zts n GLU 84 Cb 0.36 -0.67 -0.08 0.00 -0.57 0.00 0.00 31.44 30.48 1zts n GLU 84 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 1zts s LYS 85 N -0.54 3.91 -0.00 3.49 0.00 -1.26 -4.88 119.74 120.46 1zts s LYS 85 Ca 0.00 0.13 0.02 0.00 0.00 0.00 0.00 55.97 56.12 1zts s LYS 85 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 37.83 34.10 1zts s LYS 85 CO 0.00 -0.45 0.08 -0.89 0.00 0.00 0.00 175.35 174.09 1zts n ILE 86 N 5.25 0.00 0.00 3.79 5.41 -1.26 -5.02 119.36 127.53 1zts n ILE 86 Ca -0.05 -0.39 0.00 0.00 1.00 0.00 0.00 62.75 63.32 1zts n ILE 86 Cb 0.50 0.91 0.00 0.00 -0.71 0.00 0.00 39.64 40.34 1zts n ILE 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1zts n GLY 87 N 1.27 0.68 0.08 7.39 0.00 -1.26 -5.15 105.19 108.19 1zts n GLY 87 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 46.02 45.56 1zts n GLY 87 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zts n ASP 88 N 0.00 0.03 -1.18 1.61 4.64 -1.26 -5.06 116.55 115.32 1zts n ASP 88 Ca 0.00 -1.02 -0.01 0.00 -1.38 0.00 0.00 54.79 52.38 1zts n ASP 88 Cb 0.00 -0.01 -0.02 0.00 -1.04 0.00 0.00 41.12 40.05 1zts n ASP 88 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1zts n TYR 89 N -1.43 0.00 -2.82 -0.67 4.19 -1.26 -4.94 117.16 110.23 1zts n TYR 89 Ca 0.00 -0.44 -0.21 0.00 3.31 0.00 0.00 57.90 60.57 1zts n TYR 89 Cb 0.01 0.12 -0.01 0.00 0.49 0.00 0.00 39.34 39.95 1zts n TYR 89 CO 0.00 0.00 0.00 0.43 0.91 0.00 0.00 176.86 178.20 1zts n SER 90 N 0.25 3.06 -4.50 2.98 7.64 -1.26 -5.04 113.62 116.74 1zts n SER 90 Ca -0.08 -3.34 -0.42 0.00 1.01 0.00 0.00 58.87 56.05 1zts n SER 90 Cb 0.91 -0.54 -0.03 0.00 -1.01 0.00 0.00 64.21 63.54 1zts n SER 90 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1zts s TYR 91 N -3.17 2.53 -0.81 1.43 2.02 -1.26 -3.09 117.35 115.00 1zts s TYR 91 Ca 0.42 -0.43 -0.21 0.00 -0.37 0.00 0.00 57.07 56.48 1zts s TYR 91 Cb 0.36 -4.47 0.09 0.00 -0.40 0.00 0.00 41.96 37.55 1zts s TYR 91 CO -0.10 -1.84 1.10 0.99 -1.57 0.00 0.00 175.55 174.13 1zts s THR 92 N 4.74 4.39 1.25 -0.71 2.01 0.81 -3.35 115.64 124.79 1zts s THR 92 Ca 0.30 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.32 1zts s THR 92 Cb -0.11 -4.78 0.32 0.00 0.01 0.00 0.00 72.50 67.94 1zts s THR 92 CO 0.09 -1.56 0.95 0.18 -0.69 0.00 0.00 174.62 173.59 1zts n LEU 93 N 7.50 -1.68 0.14 4.42 4.77 -1.03 -2.99 117.00 128.14 1zts n LEU 93 Ca 0.11 -0.34 0.18 0.00 -0.03 0.00 0.00 56.01 55.93 1zts n LEU 93 Cb 0.48 -1.19 0.77 0.00 -2.33 0.00 0.00 43.42 41.15 1zts n LEU 93 CO 0.60 -3.62 1.16 1.23 -1.33 0.00 0.00 177.39 175.42 1zts h GLY 94 N -2.93 0.00 -3.10 -0.72 0.00 -1.93 0.23 103.07 94.63 1zts h GLY 94 Ca -0.59 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.63 1zts h GLY 94 CO 0.45 0.00 0.14 1.22 0.00 0.00 0.00 176.54 178.35 1zts n ASP 95 N -3.93 4.32 -2.22 0.19 8.00 -1.26 -4.88 116.55 116.76 1zts n ASP 95 Ca 0.04 -2.85 -0.13 0.00 0.71 0.00 0.00 54.79 52.57 1zts n ASP 95 Cb 0.43 -0.67 -0.02 0.00 -0.02 0.00 0.00 41.12 40.84 1zts n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zts n GLY 96 N 0.14 -0.15 3.86 0.44 0.00 0.82 -4.93 105.19 105.37 1zts n GLY 96 Ca 0.28 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 1zts n GLY 96 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zts s SER 97 N -2.04 6.58 -1.16 1.61 0.01 -1.26 -4.83 113.70 112.61 1zts s SER 97 Ca 0.00 0.69 -0.19 0.00 1.31 0.00 0.00 55.95 57.76 1zts s SER 97 Cb 0.00 -2.15 0.09 0.00 0.21 0.00 0.00 66.02 64.17 1zts s SER 97 CO 0.00 0.35 1.53 -0.94 0.41 0.00 0.00 173.24 174.59 1zts s SER 98 N -1.14 6.77 -0.58 2.44 1.04 -1.26 -2.45 113.70 118.51 1zts s SER 98 Ca 0.20 -2.25 -0.28 0.00 0.48 0.00 0.00 55.95 54.11 1zts s SER 98 Cb -0.14 -2.52 -0.11 0.00 0.10 0.00 0.00 66.02 63.35 1zts s SER 98 CO 0.10 -1.16 2.46 -0.11 0.98 0.00 0.00 173.24 175.50 1zts n LEU 99 N 7.76 1.90 -4.89 2.42 7.94 -1.21 -4.92 117.00 126.00 1zts n LEU 99 Ca 0.39 -0.27 -0.32 0.00 -1.11 0.00 0.00 56.01 54.70 1zts n LEU 99 Cb 0.47 -1.42 -0.05 0.00 0.53 0.00 0.00 43.42 42.95 1zts n LEU 99 CO 0.68 -1.30 -0.01 0.00 -1.11 0.00 0.00 177.39 175.65 1zts s GLN 100 N 8.23 3.60 0.94 1.96 -2.07 -1.26 -4.80 119.66 126.27 1zts s GLN 100 Ca 1.07 -0.10 -0.12 0.00 -1.82 0.00 0.00 55.36 54.39 1zts s GLN 100 Cb -0.46 -2.94 0.05 0.00 -1.09 0.00 0.00 33.01 28.57 1zts s GLN 100 CO 0.33 0.54 0.51 1.63 -1.32 0.00 0.00 175.29 176.97 1zts n LYS 101 N 0.43 -0.31 -1.15 9.60 4.01 -1.26 -4.98 118.16 124.51 1zts n LYS 101 Ca -0.05 -0.04 -0.29 0.00 -0.51 0.00 0.00 58.31 57.42 1zts n LYS 101 Cb 0.52 -1.93 0.19 0.00 -0.51 0.00 0.00 35.03 33.30 1zts n LYS 101 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1zts s PRO 102 N -3.77 0.14 -1.05 1.97 0.04 -1.26 -4.98 135.00 126.09 1zts s PRO 102 Ca 0.58 0.43 -0.06 0.00 0.04 0.00 0.00 61.00 61.98 1zts s PRO 102 Cb -0.21 -1.71 0.27 0.00 0.04 0.00 0.00 34.50 32.88 1zts s PRO 102 CO 0.66 -2.91 1.05 -0.25 0.04 0.00 0.00 177.00 175.59 1zts n ASP 103 N -4.28 5.20 -1.42 6.66 8.00 -1.26 -4.82 116.55 124.63 1zts n ASP 103 Ca 0.06 -3.09 0.05 0.00 0.71 0.00 0.00 54.79 52.51 1zts n ASP 103 Cb 0.58 -1.27 0.28 0.00 -0.02 0.00 0.00 41.12 40.68 1zts n ASP 103 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1zts n VAL 104 N 2.46 1.80 0.06 2.53 0.24 -1.26 -4.23 118.33 119.92 1zts n VAL 104 Ca 0.24 -0.95 -0.06 0.00 -2.04 0.00 0.00 64.34 61.53 1zts n VAL 104 Cb 0.38 -0.27 0.12 0.00 -1.47 0.00 0.00 33.84 32.60 1zts n VAL 104 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 1zts h TYR 105 N 2.83 0.43 0.00 6.34 3.20 -1.98 -2.78 116.97 125.01 1zts h TYR 105 Ca 0.00 -0.15 -0.05 0.00 3.14 0.00 0.00 58.73 61.67 1zts h TYR 105 Cb 1.45 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.63 1zts h TYR 105 CO 0.72 0.81 -0.25 0.00 -1.64 0.00 0.00 178.16 177.80 1zts h ALA 106 N 1.15 1.04 0.05 1.82 0.00 -2.00 -1.52 119.26 119.81 1zts h ALA 106 Ca 0.00 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 1zts h ALA 106 Cb 1.05 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.81 1zts h ALA 106 CO 0.09 0.32 -0.68 -0.07 0.00 0.00 0.00 179.25 178.91 1zts h LEU 107 N 0.00 0.51 -0.80 0.00 3.38 -1.80 -3.22 115.31 113.38 1zts h LEU 107 Ca -0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.14 1zts h LEU 107 Cb 0.74 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1zts h LEU 107 CO 0.03 1.28 0.00 2.30 0.09 0.00 0.00 178.44 182.15 1zts n ILE 108 N -4.18 0.20 0.33 1.22 -5.35 -1.07 -4.01 119.36 106.50 1zts n ILE 108 Ca -0.12 -0.26 0.20 0.00 -0.27 0.00 0.00 62.75 62.30 1zts n ILE 108 Cb 0.73 0.16 1.08 0.00 -1.74 0.00 0.00 39.64 39.87 1zts n ILE 108 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1zts h LYS 109 N 1.49 0.00 0.00 6.28 2.10 -1.29 0.25 116.57 125.40 1zts h LYS 109 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 1zts h LYS 109 Cb 0.33 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.66 1zts h LYS 109 CO 0.00 0.00 -0.30 -0.44 -2.00 0.00 0.00 179.45 176.71 1zts h ASP 110 N 0.00 0.00 -1.06 7.07 3.32 -1.82 -3.33 116.42 120.60 1zts h ASP 110 Ca 0.01 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.56 1zts h ASP 110 Cb 0.20 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 39.33 1zts h ASP 110 CO -0.00 0.09 -0.88 -1.22 -1.72 0.00 0.00 179.24 175.51 1zts n TYR 111 N -3.03 2.61 -3.68 4.55 4.01 0.83 -4.99 117.16 117.46 1zts n TYR 111 Ca 0.03 -2.66 -0.38 0.00 -0.16 0.00 0.00 57.90 54.72 1zts n TYR 111 Cb 0.57 -0.23 -0.10 0.00 -0.31 0.00 0.00 39.34 39.27 1zts n TYR 111 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1zts s VAL 112 N -4.67 3.72 -0.38 -0.72 1.01 -0.93 -4.81 120.40 113.61 1zts s VAL 112 Ca 0.43 -1.84 -0.21 0.00 0.00 0.00 0.00 61.98 60.37 1zts s VAL 112 Cb 0.40 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 33.36 1zts s VAL 112 CO -0.06 -0.66 0.50 1.17 0.00 0.00 0.00 175.10 176.04 1zts n LYS 113 N 4.75 -2.18 -0.37 2.72 3.00 -1.20 -4.99 118.16 119.89 1zts n LYS 113 Ca -0.06 1.85 -0.11 0.00 -0.00 0.00 0.00 58.31 60.00 1zts n LYS 113 Cb 0.41 -3.99 0.09 0.00 0.00 0.00 0.00 35.03 31.54 1zts n LYS 113 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1zts n PRO 114 N 0.01 -1.77 -1.41 1.64 -0.04 -1.26 -4.90 135.00 127.26 1zts n PRO 114 Ca 0.02 -0.62 -0.26 0.00 -0.04 0.00 0.00 63.50 62.61 1zts n PRO 114 Cb 0.48 -0.58 -0.04 0.00 -0.04 0.00 0.00 33.50 33.33 1zts n PRO 114 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1zts n ALA 115 N -3.66 6.27 -1.79 0.55 0.00 -1.26 -4.97 120.51 115.65 1zts n ALA 115 Ca -0.07 -2.89 -0.34 0.00 0.00 0.00 0.00 53.44 50.14 1zts n ALA 115 Cb 0.21 -2.03 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 1zts n ALA 115 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1zts s ASP 116 N 0.26 6.37 0.50 0.00 2.15 -1.26 -5.06 116.67 119.63 1zts s ASP 116 Ca 0.55 1.90 0.00 0.00 0.43 0.00 0.00 52.55 55.43 1zts s ASP 116 Cb 0.37 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 1zts s ASP 116 CO -0.19 -0.76 0.00 -0.81 -0.17 0.00 0.00 175.17 173.24 1zts n PRO 117 N -0.99 -0.01 -0.47 4.34 -0.04 -1.26 -4.90 135.00 131.67 1zts n PRO 117 Ca 0.09 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.59 1zts n PRO 117 Cb 0.53 0.00 0.21 0.00 -0.04 0.00 0.00 33.50 34.20 1zts n PRO 117 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1zts n ASP 118 N -1.49 3.46 0.24 3.54 4.64 -1.26 -4.31 116.55 121.37 1zts n ASP 118 Ca 0.00 -2.47 0.18 0.00 -1.38 0.00 0.00 54.79 51.12 1zts n ASP 118 Cb 0.00 -0.58 0.88 0.00 -1.04 0.00 0.00 41.12 40.38 1zts n ASP 118 CO 0.00 0.00 0.00 0.17 -0.82 0.00 0.00 177.20 176.55 1zts h LEU 119 N 2.14 0.00 -9.80 -2.67 8.10 -2.03 -3.43 115.31 107.62 1zts h LEU 119 Ca 0.00 0.00 -0.49 0.00 0.11 0.00 0.00 57.88 57.50 1zts h LEU 119 Cb 1.25 0.00 0.22 0.00 -0.44 0.00 0.00 40.66 41.70 1zts h LEU 119 CO 0.25 0.00 -0.69 -0.62 -4.11 0.00 0.00 178.44 173.27 1zts n GLU 120 N -3.58 -1.01 0.00 0.17 -0.58 -1.26 -3.49 120.64 110.89 1zts n GLU 120 Ca 0.01 -0.26 0.00 0.00 -0.42 0.00 0.00 57.16 56.48 1zts n GLU 120 Cb 0.30 -1.85 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 1zts n GLU 120 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zts n GLY 121 N 1.60 2.94 3.80 0.62 0.00 -1.26 -5.04 105.19 107.84 1zts n GLY 121 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1zts n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zts s ILE 122 N -2.56 4.36 -0.59 -0.61 -1.09 -1.23 -3.48 121.20 116.01 1zts s ILE 122 Ca 0.00 1.59 0.00 0.00 -2.23 0.00 0.00 60.65 60.01 1zts s ILE 122 Cb 0.00 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.97 1zts s ILE 122 CO 0.00 0.11 0.00 1.21 -1.23 0.00 0.00 174.94 175.03 1zts n GLU 123 N 0.47 -1.33 -0.09 2.79 2.13 -1.26 -4.81 120.64 118.53 1zts n GLU 123 Ca 0.01 0.61 -0.14 0.00 0.66 0.00 0.00 57.16 58.31 1zts n GLU 123 Cb 0.51 -4.73 -0.14 0.00 0.27 0.00 0.00 31.44 27.34 1zts n GLU 123 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1zts n ALA 124 N 1.10 1.43 0.06 4.31 0.00 -1.23 -3.98 120.51 122.20 1zts n ALA 124 Ca -0.06 -1.14 -0.04 0.00 0.00 0.00 0.00 53.44 52.21 1zts n ALA 124 Cb 0.42 -0.26 -0.08 0.00 0.00 0.00 0.00 19.45 19.52 1zts n ALA 124 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1zts h LYS 125 N 0.01 0.00 0.06 0.00 3.64 -1.88 -3.34 116.57 115.06 1zts h LYS 125 Ca -0.52 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1zts h LYS 125 Cb 2.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.91 1zts h LYS 125 CO -0.00 0.68 -0.03 0.28 -2.27 0.00 0.00 179.45 178.11 1zts h VAL 126 N 0.00 1.19 -1.02 2.00 2.07 -1.94 -1.44 116.25 117.11 1zts h VAL 126 Ca -0.08 -0.89 0.27 0.00 0.82 0.00 0.00 66.70 66.82 1zts h VAL 126 Cb 1.70 1.77 -0.06 0.00 -1.52 0.00 0.00 31.29 33.18 1zts h VAL 126 CO 0.09 0.22 0.69 0.08 0.02 0.00 0.00 177.57 178.68 1zts h ARG 127 N -0.48 0.20 0.03 1.57 0.11 -1.70 0.27 114.38 114.38 1zts h ARG 127 Ca -0.01 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 60.06 1zts h ARG 127 Cb 0.42 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.46 1zts h ARG 127 CO 0.01 0.13 -0.02 0.52 0.10 0.00 0.00 179.97 180.72 1zts h MET 128 N 0.21 -0.04 -0.33 0.08 2.86 -1.65 -3.11 114.93 112.95 1zts h MET 128 Ca 0.52 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 58.26 1zts h MET 128 Cb 1.68 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.33 1zts h MET 128 CO -0.14 0.30 0.33 0.00 1.06 0.00 0.00 176.91 178.46 1zts h ARG 129 N -0.99 0.00 -1.86 1.72 3.08 -0.52 -1.98 114.38 113.83 1zts h ARG 129 Ca -0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1zts h ARG 129 Cb 0.37 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.02 1zts h ARG 129 CO 0.01 0.00 -0.46 0.43 -1.07 0.00 0.00 179.97 178.88 1zts n SER 130 N -3.87 5.01 -4.69 7.04 7.64 0.88 -5.04 113.62 120.58 1zts n SER 130 Ca 0.05 -3.72 -0.32 0.00 1.01 0.00 0.00 58.87 55.90 1zts n SER 130 Cb 0.49 -0.58 -0.08 0.00 -1.01 0.00 0.00 64.21 63.03 1zts n SER 130 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1zts s ILE 131 N -5.08 4.14 -0.08 0.44 1.10 -0.75 -4.83 121.20 116.16 1zts s ILE 131 Ca 0.48 -0.75 -0.23 0.00 -0.51 0.00 0.00 60.65 59.64 1zts s ILE 131 Cb 0.35 -2.90 -0.30 0.00 0.15 0.00 0.00 42.46 39.76 1zts s ILE 131 CO -0.19 0.26 0.84 -0.07 -2.11 0.00 0.00 174.94 173.67 1zts h LEU 132 N 3.93 0.34 0.00 8.50 3.38 -1.90 -3.48 115.31 126.08 1zts h LEU 132 Ca -0.48 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 56.53 1zts h LEU 132 Cb 1.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1zts h LEU 132 CO 0.59 1.31 0.00 -1.84 0.09 0.00 0.00 178.44 178.59 1zts n GLU 133 N -4.24 0.00 0.02 1.13 0.28 -1.26 -5.05 120.64 111.53 1zts n GLU 133 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.86 1zts n GLU 133 Cb 0.74 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.61 1zts n GLU 133 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 1zts n HIS 134 N -1.27 -2.20 -3.58 -1.84 -0.00 -1.26 -5.16 115.22 99.89 1zts n HIS 134 Ca 0.00 0.14 -0.06 0.00 0.46 0.00 0.00 57.72 58.26 1zts n HIS 134 Cb 0.00 0.71 -0.02 0.00 -0.12 0.00 0.00 29.99 30.56 1zts n HIS 134 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 1zts s HIS 135 N -2.00 -0.25 -0.44 1.57 3.76 -1.26 -5.13 115.29 111.54 1zts s HIS 135 Ca 0.00 0.08 -0.17 0.00 -0.15 0.00 0.00 55.06 54.82 1zts s HIS 135 Cb 0.00 0.56 0.03 0.00 1.11 0.00 0.00 32.58 34.29 1zts s HIS 135 CO 0.00 -0.57 0.43 -1.58 -0.85 0.00 0.00 174.74 172.17 1zts s HIS 136 N -3.05 3.18 -0.00 1.40 2.46 -1.26 -5.06 115.29 112.95 1zts s HIS 136 Ca 0.08 -0.50 -0.02 0.00 0.47 0.00 0.00 55.06 55.09 1zts s HIS 136 Cb -0.01 -2.96 -0.04 0.00 -0.13 0.00 0.00 32.58 29.44 1zts s HIS 136 CO -0.05 -0.74 0.14 -3.38 -2.47 0.00 0.00 174.74 168.24 1zts s HIS 137 N 2.06 3.43 -0.02 3.88 -3.43 -1.26 -5.11 115.29 114.84 1zts s HIS 137 Ca 0.10 0.29 -0.09 0.00 -0.80 0.00 0.00 55.06 54.56 1zts s HIS 137 Cb -0.19 -1.79 0.01 0.00 -1.43 0.00 0.00 32.58 29.19 1zts s HIS 137 CO 0.12 0.61 0.20 -1.58 -2.00 0.00 0.00 174.74 172.08 1zts s HIS 138 N -1.28 -0.08 -1.60 0.38 2.46 -1.26 -5.30 115.29 108.62 1zts s HIS 138 Ca 0.26 0.13 0.13 0.00 0.47 0.00 0.00 55.06 56.04 1zts s HIS 138 Cb -0.12 0.02 0.10 0.00 -0.13 0.00 0.00 32.58 32.44 1zts s HIS 138 CO 0.17 -0.27 0.91 1.58 -2.47 0.00 0.00 174.74 174.66