#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlv h SER 2 N 0.00 -0.63 -5.09 1.61 0.87 -2.11 -3.47 113.55 104.74 2dlv h SER 2 Ca 0.00 -0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.46 2dlv h SER 2 Cb 0.00 0.16 -0.16 0.00 -0.44 0.00 0.00 62.40 61.96 2dlv h SER 2 CO 0.00 -0.22 -0.32 -0.55 -0.53 0.00 0.00 176.83 175.21 2dlv s SER 3 N -4.71 -0.01 0.00 6.23 0.15 -1.26 -5.14 113.70 108.96 2dlv s SER 3 Ca -0.12 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2dlv s SER 3 Cb 0.01 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 2dlv s SER 3 CO 0.36 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.78 2dlv n GLY 4 N 0.42 3.36 1.69 9.45 0.00 -1.26 -5.00 105.19 113.85 2dlv n GLY 4 Ca -0.18 -0.32 0.07 0.00 0.00 0.00 0.00 46.02 45.59 2dlv n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dlv n SER 5 N 0.00 5.06 -0.09 1.61 2.88 -1.26 -4.39 113.62 117.43 2dlv n SER 5 Ca 0.00 -2.69 -0.13 0.00 -1.33 0.00 0.00 58.87 54.71 2dlv n SER 5 Cb 0.00 -0.63 -0.05 0.00 -0.75 0.00 0.00 64.21 62.77 2dlv n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dlv n SER 6 N 0.76 1.87 0.00 -3.46 7.64 -1.26 -5.08 113.62 114.09 2dlv n SER 6 Ca 0.25 0.47 0.00 0.00 1.01 0.00 0.00 58.87 60.61 2dlv n SER 6 Cb 1.02 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 2dlv n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dlv n GLY 7 N 1.48 0.18 3.26 0.23 0.00 -1.26 -4.66 105.19 104.43 2dlv n GLY 7 Ca -0.22 -1.80 -0.02 0.00 0.00 0.00 0.00 46.02 43.98 2dlv n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlv s SER 8 N -4.00 -0.85 0.48 1.61 0.15 -1.26 -5.02 113.70 104.80 2dlv s SER 8 Ca 0.00 0.97 0.26 0.00 0.70 0.00 0.00 55.95 57.88 2dlv s SER 8 Cb 0.00 1.89 1.11 0.00 -1.71 0.00 0.00 66.02 67.31 2dlv s SER 8 CO 0.00 -0.25 1.91 1.55 1.20 0.00 0.00 173.24 177.64 2dlv h PRO 9 N 8.06 0.00 -0.18 5.44 0.13 -1.94 -2.33 132.00 141.18 2dlv h PRO 9 Ca -0.20 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.74 2dlv h PRO 9 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2dlv h PRO 9 CO 0.20 0.17 -0.66 1.49 -0.23 0.00 0.00 178.00 178.97 2dlv h GLU 10 N 0.00 0.69 0.08 0.86 4.81 -1.99 -3.05 114.58 115.98 2dlv h GLU 10 Ca -0.00 -0.50 -0.27 0.00 -0.13 0.00 0.00 59.36 58.46 2dlv h GLU 10 Cb 0.62 0.08 0.01 0.00 0.63 0.00 0.00 28.75 30.10 2dlv h GLU 10 CO 0.02 1.12 -1.14 0.93 -0.73 0.00 0.00 179.01 179.22 2dlv h GLU 11 N 0.50 0.46 0.10 1.92 4.39 -1.95 -3.29 114.58 116.71 2dlv h GLU 11 Ca -0.02 -0.60 0.02 0.00 0.34 0.00 0.00 59.36 59.10 2dlv h GLU 11 Cb 1.26 0.20 -0.04 0.00 -0.10 0.00 0.00 28.75 30.06 2dlv h GLU 11 CO 0.13 1.24 -0.32 0.00 -1.16 0.00 0.00 179.01 178.90 2dlv h ALA 12 N 0.53 -0.54 -0.92 3.43 0.00 -1.45 0.24 119.26 120.55 2dlv h ALA 12 Ca -0.14 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 54.93 2dlv h ALA 12 Cb 1.81 0.54 -0.07 0.00 0.00 0.00 0.00 17.79 20.06 2dlv h ALA 12 CO 0.20 -0.86 0.60 -0.24 0.00 0.00 0.00 179.25 178.95 2dlv h VAL 13 N -0.54 0.68 -0.03 0.00 3.04 -1.65 -1.41 116.25 116.35 2dlv h VAL 13 Ca 0.03 -0.16 -0.05 0.00 -1.01 0.00 0.00 66.70 65.52 2dlv h VAL 13 Cb 0.58 0.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.03 2dlv h VAL 13 CO -0.20 0.09 -0.17 0.11 -1.01 0.00 0.00 177.57 176.38 2dlv h LYS 14 N 0.47 0.17 -0.93 4.17 1.57 -1.33 -3.31 116.57 117.37 2dlv h LYS 14 Ca 0.49 -0.14 0.15 0.00 -1.87 0.00 0.00 60.65 59.27 2dlv h LYS 14 Cb 1.13 0.03 -0.15 0.00 0.08 0.00 0.00 32.23 33.32 2dlv h LYS 14 CO -0.21 0.81 -0.36 0.91 -0.57 0.00 0.00 179.45 180.04 2dlv n TRP 15 N -4.58 0.04 -0.39 -1.35 8.01 0.75 0.13 117.44 120.06 2dlv n TRP 15 Ca -0.09 1.15 0.31 0.00 -1.31 0.00 0.00 57.50 57.56 2dlv n TRP 15 Cb 0.43 -0.86 0.58 0.00 -2.01 0.00 0.00 31.31 29.46 2dlv n TRP 15 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 2dlv h GLY 16 N 0.00 1.45 -0.68 6.99 0.00 -1.62 -1.67 103.07 107.55 2dlv h GLY 16 Ca 0.33 -0.16 0.10 0.00 0.00 0.00 0.00 47.33 47.60 2dlv h GLY 16 CO -0.92 -0.37 -0.27 1.18 0.00 0.00 0.00 176.54 176.15 2dlv n GLU 17 N -4.76 -0.17 -3.47 4.80 1.02 0.36 -4.67 120.64 113.74 2dlv n GLU 17 Ca 0.33 1.04 -0.10 0.00 -0.02 0.00 0.00 57.16 58.42 2dlv n GLU 17 Cb 1.21 -1.55 -0.02 0.00 -0.02 0.00 0.00 31.44 31.06 2dlv n GLU 17 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2dlv s SER 18 N -5.25 -0.45 0.24 1.62 0.15 -0.63 -5.03 113.70 104.35 2dlv s SER 18 Ca -0.09 0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.54 2dlv s SER 18 Cb 0.13 0.47 0.37 0.00 -1.71 0.00 0.00 66.02 65.28 2dlv s SER 18 CO 0.48 -0.75 1.82 0.15 1.20 0.00 0.00 173.24 176.15 2dlv h PHE 19 N 2.04 0.89 -0.56 3.44 3.57 -1.83 -1.89 116.94 122.60 2dlv h PHE 19 Ca -0.27 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.33 2dlv h PHE 19 Cb 1.26 -0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.67 2dlv h PHE 19 CO 0.25 0.40 0.25 0.22 -2.23 0.00 0.00 178.31 177.20 2dlv h ASP 20 N 0.84 0.33 -0.91 0.41 1.82 -1.96 -1.49 116.42 115.46 2dlv h ASP 20 Ca 0.38 0.05 0.12 0.00 -0.39 0.00 0.00 57.03 57.19 2dlv h ASP 20 Cb 0.29 -0.01 -0.08 0.00 0.68 0.00 0.00 39.33 40.21 2dlv h ASP 20 CO -0.22 0.22 0.53 0.11 -1.61 0.00 0.00 179.24 178.27 2dlv h LYS 21 N 0.48 0.80 0.65 0.28 1.79 -1.61 0.18 116.57 119.14 2dlv h LYS 21 Ca 0.26 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.65 2dlv h LYS 21 Cb 0.23 -0.18 0.01 0.00 -1.58 0.00 0.00 32.23 30.71 2dlv h LYS 21 CO -0.22 0.53 -0.31 1.25 -1.08 0.00 0.00 179.45 179.62 2dlv h LEU 22 N 0.83 -0.74 -0.67 2.94 5.85 -1.14 -3.01 115.31 119.37 2dlv h LEU 22 Ca 0.46 0.03 0.13 0.00 0.84 0.00 0.00 57.88 59.34 2dlv h LEU 22 Cb 0.50 0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.63 2dlv h LEU 22 CO -0.29 -0.40 0.19 -0.07 -0.34 0.00 0.00 178.44 177.52 2dlv h LEU 23 N -1.12 0.08 -0.92 2.25 3.38 -1.12 -0.24 115.31 117.62 2dlv h LEU 23 Ca -0.09 0.12 0.23 0.00 0.09 0.00 0.00 57.88 58.23 2dlv h LEU 23 Cb 0.67 0.14 -0.12 0.00 0.09 0.00 0.00 40.66 41.44 2dlv h LEU 23 CO 0.15 0.03 0.44 -1.28 0.09 0.00 0.00 178.44 177.87 2dlv h SER 24 N 0.31 0.42 -3.90 -0.43 0.87 -0.65 -3.40 113.55 106.76 2dlv h SER 24 Ca 0.36 0.15 -0.46 0.00 -1.23 0.00 0.00 61.79 60.61 2dlv h SER 24 Cb 0.56 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.61 2dlv h SER 24 CO -0.43 0.03 0.31 -2.28 -0.53 0.00 0.00 176.83 173.93 2dlv s HIS 25 N -5.86 3.54 -0.07 2.24 5.65 -0.10 -5.01 115.29 115.69 2dlv s HIS 25 Ca -0.11 1.65 -0.18 0.00 0.25 0.00 0.00 55.06 56.67 2dlv s HIS 25 Cb 0.26 -2.85 -0.14 0.00 -1.18 0.00 0.00 32.58 28.67 2dlv s HIS 25 CO 0.78 0.11 0.69 -0.09 -0.65 0.00 0.00 174.74 175.58 2dlv h ARG 26 N 2.71 -0.19 -0.28 2.88 9.65 -1.81 -2.98 114.38 124.37 2dlv h ARG 26 Ca -0.48 0.01 0.07 0.00 -1.10 0.00 0.00 59.98 58.48 2dlv h ARG 26 Cb 1.19 0.04 -0.08 0.00 -1.39 0.00 0.00 29.97 29.73 2dlv h ARG 26 CO 0.64 0.21 -0.25 -0.44 2.80 0.00 0.00 179.97 182.93 2dlv h ASP 27 N -0.93 -0.80 -0.55 -3.80 5.19 -1.95 0.11 116.42 113.70 2dlv h ASP 27 Ca -0.02 0.15 0.10 0.00 -0.62 0.00 0.00 57.03 56.64 2dlv h ASP 27 Cb 0.49 0.38 -0.08 0.00 0.18 0.00 0.00 39.33 40.30 2dlv h ASP 27 CO 0.03 -0.28 0.11 1.23 -3.12 0.00 0.00 179.24 177.21 2dlv h GLY 28 N -0.23 0.68 0.84 2.75 0.00 -1.80 -0.67 103.07 104.64 2dlv h GLY 28 Ca 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 2dlv h GLY 28 CO -0.42 -0.09 -0.18 -2.00 0.00 0.00 0.00 176.54 173.85 2dlv h LEU 29 N 0.24 -0.43 -0.10 3.11 5.85 -1.17 0.30 115.31 123.12 2dlv h LEU 29 Ca 0.28 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.95 2dlv h LEU 29 Cb 0.40 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 2dlv h LEU 29 CO -0.37 -0.18 -0.54 -0.33 -0.34 0.00 0.00 178.44 176.68 2dlv h GLU 30 N -0.67 -0.59 -0.91 1.25 5.08 -0.46 -0.27 114.58 118.01 2dlv h GLU 30 Ca -0.05 0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2dlv h GLU 30 Cb 0.48 0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.80 2dlv h GLU 30 CO 0.09 -0.39 0.57 0.00 -1.00 0.00 0.00 179.01 178.28 2dlv h ALA 31 N -0.32 1.25 -0.32 3.43 0.00 -1.16 -2.42 119.26 119.71 2dlv h ALA 31 Ca 0.03 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2dlv h ALA 31 Cb 0.69 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2dlv h ALA 31 CO -0.42 0.34 -0.05 0.35 0.00 0.00 0.00 179.25 179.48 2dlv h PHE 32 N 1.05 -0.11 -0.40 0.00 3.57 0.23 -2.36 116.94 118.92 2dlv h PHE 32 Ca 0.39 0.03 0.08 0.00 3.53 0.00 0.00 57.97 62.00 2dlv h PHE 32 Cb 0.16 0.10 -0.08 0.00 2.79 0.00 0.00 35.95 38.91 2dlv h PHE 32 CO -0.02 -0.11 -0.16 1.15 -2.23 0.00 0.00 178.31 176.94 2dlv h THR 33 N 0.04 0.48 -0.62 4.41 2.02 -0.58 -2.56 112.91 116.09 2dlv h THR 33 Ca 0.16 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.40 2dlv h THR 33 Cb 0.23 0.48 -0.09 0.00 -1.74 0.00 0.00 68.15 67.03 2dlv h THR 33 CO -0.31 0.00 -0.49 0.03 0.37 0.00 0.00 175.52 175.13 2dlv h ARG 34 N -0.08 -0.14 -0.99 6.66 3.08 -1.32 0.35 114.38 121.92 2dlv h ARG 34 Ca 0.20 0.01 0.35 0.00 0.07 0.00 0.00 59.98 60.60 2dlv h ARG 34 Cb 0.38 0.03 -0.18 0.00 0.08 0.00 0.00 29.97 30.28 2dlv h ARG 34 CO -0.45 -0.10 0.29 0.34 -1.07 0.00 0.00 179.97 178.98 2dlv n PHE 35 N -4.92 0.91 -0.03 3.04 7.35 -0.97 0.11 117.46 122.95 2dlv n PHE 35 Ca -0.00 1.18 -0.13 0.00 -0.76 0.00 0.00 57.45 57.73 2dlv n PHE 35 Cb 0.25 -1.42 -0.10 0.00 0.35 0.00 0.00 39.48 38.56 2dlv n PHE 35 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2dlv h LEU 36 N 0.00 0.05 -0.90 -2.13 3.38 -0.42 -3.22 115.31 112.07 2dlv h LEU 36 Ca 0.73 -0.62 0.24 0.00 0.09 0.00 0.00 57.88 58.31 2dlv h LEU 36 Cb 1.76 -0.02 -0.16 0.00 0.09 0.00 0.00 40.66 42.34 2dlv h LEU 36 CO -0.84 0.67 0.08 0.11 0.09 0.00 0.00 178.44 178.54 2dlv h LYS 37 N -0.55 0.08 -0.91 1.13 1.57 0.23 0.83 116.57 118.95 2dlv h LYS 37 Ca -0.00 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2dlv h LYS 37 Cb 0.66 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.91 2dlv h LYS 37 CO 0.01 0.05 0.60 1.79 -0.57 0.00 0.00 179.45 181.33 2dlv h THR 38 N 0.08 1.21 -0.52 -0.16 1.35 -1.35 -1.03 112.91 112.50 2dlv h THR 38 Ca 0.54 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.98 2dlv h THR 38 Cb 1.07 -0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 2dlv h THR 38 CO -0.78 0.22 0.00 -0.62 -0.25 0.00 0.00 175.52 174.09 2dlv n GLU 39 N -4.41 3.40 -3.06 4.72 1.02 0.25 -4.91 120.64 117.65 2dlv n GLU 39 Ca 0.11 -2.38 -0.20 0.00 -0.02 0.00 0.00 57.16 54.67 2dlv n GLU 39 Cb 0.04 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 2dlv n GLU 39 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2dlv n PHE 40 N 0.83 -1.73 0.67 -0.32 3.01 0.12 -4.82 117.46 115.22 2dlv n PHE 40 Ca 0.21 0.36 0.08 0.00 1.01 0.00 0.00 57.45 59.11 2dlv n PHE 40 Cb 0.80 -3.19 -0.10 0.00 -0.01 0.00 0.00 39.48 36.98 2dlv n PHE 40 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dlv n SER 41 N -2.21 0.83 -0.31 4.37 7.64 0.09 -4.54 113.62 119.49 2dlv n SER 41 Ca -0.07 -0.75 0.12 0.00 1.01 0.00 0.00 58.87 59.18 2dlv n SER 41 Cb 0.57 1.13 0.26 0.00 -1.01 0.00 0.00 64.21 65.16 2dlv n SER 41 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2dlv h GLU 42 N 0.00 0.06 -1.28 1.43 -0.00 -1.83 0.30 114.58 113.26 2dlv h GLU 42 Ca 0.00 -0.00 0.39 0.00 -0.00 0.00 0.00 59.36 59.75 2dlv h GLU 42 Cb 0.46 -0.01 -0.07 0.00 -0.00 0.00 0.00 28.75 29.12 2dlv h GLU 42 CO 0.00 0.04 0.89 -0.85 -0.00 0.00 0.00 179.01 179.09 2dlv n GLU 43 N -5.41 -0.01 0.35 1.06 0.28 -1.26 0.92 120.64 116.57 2dlv n GLU 43 Ca 0.20 0.84 -0.15 0.00 -0.16 0.00 0.00 57.16 57.89 2dlv n GLU 43 Cb 0.68 -1.82 -0.08 0.00 1.43 0.00 0.00 31.44 31.65 2dlv n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2dlv h ASN 44 N 0.00 -0.78 -0.30 -1.84 4.21 -0.71 -2.87 115.58 113.28 2dlv h ASN 44 Ca 0.67 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 58.13 2dlv h ASN 44 Cb 2.50 0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 39.88 2dlv h ASN 44 CO -0.13 -0.42 0.02 -0.29 -1.29 0.00 0.00 177.43 175.32 2dlv h ILE 45 N -1.17 1.21 -0.64 2.81 6.09 0.39 -2.85 117.51 123.35 2dlv h ILE 45 Ca -0.09 -0.84 0.12 0.00 -1.37 0.00 0.00 64.86 62.67 2dlv h ILE 45 Cb 0.73 0.89 -0.09 0.00 0.47 0.00 0.00 36.82 38.82 2dlv h ILE 45 CO 0.15 0.29 0.18 -0.33 -3.07 0.00 0.00 178.15 175.38 2dlv h GLU 46 N 0.60 0.31 -0.55 2.19 5.08 -0.97 -1.00 114.58 120.23 2dlv h GLU 46 Ca 0.13 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 2dlv h GLU 46 Cb 0.35 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2dlv h GLU 46 CO 0.01 0.20 0.08 0.35 -1.00 0.00 0.00 179.01 178.65 2dlv h PHE 47 N 0.32 0.99 -0.59 4.33 3.57 -1.27 -2.28 116.94 122.00 2dlv h PHE 47 Ca 0.34 -0.14 0.10 0.00 3.53 0.00 0.00 57.97 61.80 2dlv h PHE 47 Cb 0.50 -0.27 -0.08 0.00 2.79 0.00 0.00 35.95 38.89 2dlv h PHE 47 CO -0.22 0.88 0.15 2.35 -2.23 0.00 0.00 178.31 179.24 2dlv h TRP 48 N 0.82 0.25 0.27 0.41 7.01 -1.09 -2.24 115.95 121.37 2dlv h TRP 48 Ca 0.17 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.19 2dlv h TRP 48 Cb 0.43 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.47 2dlv h TRP 48 CO 0.03 0.01 -0.13 0.82 -2.79 0.00 0.00 178.44 176.38 2dlv h ILE 49 N 0.30 0.77 -0.77 2.65 2.04 -1.25 -2.79 117.51 118.46 2dlv h ILE 49 Ca 0.30 -0.58 0.22 0.00 1.00 0.00 0.00 64.86 65.81 2dlv h ILE 49 Cb 0.43 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 2dlv h ILE 49 CO -0.36 0.12 0.90 0.00 0.00 0.00 0.00 178.15 178.81 2dlv h ALA 50 N -0.06 2.61 0.01 1.87 0.00 -1.04 -1.17 119.26 121.48 2dlv h ALA 50 Ca -0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dlv h ALA 50 Cb 0.47 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2dlv h ALA 50 CO 0.06 -1.30 -0.00 0.00 0.00 0.00 0.00 179.25 178.01 2dlv h GLU 52 N -0.08 0.00 0.00 0.00 -0.00 -1.19 1.33 114.58 114.64 2dlv h GLU 52 Ca -0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 59.36 59.05 2dlv h GLU 52 Cb 0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 28.75 28.70 2dlv h GLU 52 CO 0.00 0.00 -2.00 -3.47 -0.00 0.00 0.00 179.01 173.54 2dlv n ASP 53 N -3.35 0.45 -0.13 3.06 -0.08 -0.51 -3.79 116.55 112.21 2dlv n ASP 53 Ca 0.16 0.21 -0.01 0.00 -1.51 0.00 0.00 54.79 53.64 2dlv n ASP 53 Cb 1.16 0.51 0.23 0.00 2.34 0.00 0.00 41.12 45.36 2dlv n ASP 53 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2dlv h PHE 54 N 0.00 0.82 -0.03 -0.67 3.04 0.43 -2.70 116.94 117.84 2dlv h PHE 54 Ca -0.38 -0.05 -0.23 0.00 3.98 0.00 0.00 57.97 61.29 2dlv h PHE 54 Cb 2.04 -0.25 0.01 0.00 2.56 0.00 0.00 35.95 40.31 2dlv h PHE 54 CO 0.00 0.64 -0.93 1.57 -2.02 0.00 0.00 178.31 177.57 2dlv h LYS 55 N 0.80 0.54 -1.15 1.11 2.10 -1.53 -3.25 116.57 115.19 2dlv h LYS 55 Ca 0.19 -0.54 0.42 0.00 -2.00 0.00 0.00 60.65 58.71 2dlv h LYS 55 Cb 0.17 0.15 -0.14 0.00 -0.90 0.00 0.00 32.23 31.51 2dlv h LYS 55 CO -0.02 1.17 0.71 1.63 -2.00 0.00 0.00 179.45 180.94 2dlv n LYS 56 N -3.81 -0.04 -1.14 0.07 5.02 -1.02 -4.48 118.16 112.76 2dlv n LYS 56 Ca -0.08 1.17 -0.35 0.00 -2.02 0.00 0.00 58.31 57.03 2dlv n LYS 56 Cb 0.83 -2.24 0.09 0.00 -0.02 0.00 0.00 35.03 33.68 2dlv n LYS 56 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2dlv n SER 57 N -4.68 -1.24 -0.06 4.39 2.88 -1.23 -4.96 113.62 108.72 2dlv n SER 57 Ca 0.36 0.53 -0.08 0.00 -1.33 0.00 0.00 58.87 58.35 2dlv n SER 57 Cb 1.34 -1.24 -0.06 0.00 -0.75 0.00 0.00 64.21 63.51 2dlv n SER 57 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dlv n LYS 58 N -1.13 0.90 -3.21 -1.46 0.00 -1.26 -5.04 118.16 106.96 2dlv n LYS 58 Ca 0.09 0.05 -0.21 0.00 0.00 0.00 0.00 58.31 58.25 2dlv n LYS 58 Cb 0.51 -1.25 0.00 0.00 0.00 0.00 0.00 35.03 34.29 2dlv n LYS 58 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2dlv s GLY 59 N -4.94 1.59 0.09 3.14 0.00 -1.26 -5.03 107.32 100.92 2dlv s GLY 59 Ca -0.14 -1.27 -0.15 0.00 0.00 0.00 0.00 44.72 43.16 2dlv s GLY 59 CO 0.32 -1.14 1.41 -0.56 0.00 0.00 0.00 173.10 173.14 2dlv h PRO 60 N 0.63 0.67 -0.07 2.90 0.13 -1.98 -3.25 132.00 131.02 2dlv h PRO 60 Ca -0.46 -0.36 0.01 0.00 -0.87 0.00 0.00 66.00 64.32 2dlv h PRO 60 Cb 1.26 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 2dlv h PRO 60 CO 0.55 0.97 -0.04 0.94 -0.23 0.00 0.00 178.00 180.18 2dlv n GLN 61 N -4.29 -0.03 -0.26 0.86 -0.06 -1.26 -0.21 117.38 112.13 2dlv n GLN 61 Ca -0.04 0.98 0.07 0.00 -2.00 0.00 0.00 57.00 56.02 2dlv n GLN 61 Cb 0.46 -1.47 0.21 0.00 -4.06 0.00 0.00 30.24 25.38 2dlv n GLN 61 CO 0.00 0.00 0.00 0.37 -0.20 0.00 0.00 177.06 177.23 2dlv h GLN 62 N 0.00 0.28 -0.76 3.69 5.75 -2.00 0.11 115.11 122.17 2dlv h GLN 62 Ca 0.01 -0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.59 2dlv h GLN 62 Cb 0.03 -0.06 -0.07 0.00 1.07 0.00 0.00 27.48 28.44 2dlv h GLN 62 CO -0.07 0.19 0.40 0.82 -2.65 0.00 0.00 178.83 177.52 2dlv h ILE 63 N 0.29 0.86 -0.04 2.39 2.04 -0.66 -1.00 117.51 121.39 2dlv h ILE 63 Ca 0.45 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 66.08 2dlv h ILE 63 Cb 0.79 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2dlv h ILE 63 CO -0.53 0.12 0.01 0.45 0.00 0.00 0.00 178.15 178.21 2dlv h HIS 64 N 0.67 0.06 0.42 1.37 3.86 0.20 0.23 115.15 121.97 2dlv h HIS 64 Ca 0.37 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.57 2dlv h HIS 64 Cb 0.38 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.81 2dlv h HIS 64 CO -0.09 0.21 -0.46 -0.07 0.86 0.00 0.00 177.93 178.38 2dlv h LEU 65 N -0.11 -1.27 0.22 2.43 3.38 -0.75 -0.20 115.31 119.01 2dlv h LEU 65 Ca 0.01 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2dlv h LEU 65 Cb 0.18 0.42 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 2dlv h LEU 65 CO -0.00 -0.59 -0.35 0.11 0.09 0.00 0.00 178.44 177.69 2dlv h LYS 66 N -0.89 -0.63 -0.64 1.13 1.57 -1.24 -1.31 116.57 114.56 2dlv h LYS 66 Ca -0.05 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.87 2dlv h LYS 66 Cb 0.78 0.14 -0.12 0.00 0.08 0.00 0.00 32.23 33.12 2dlv h LYS 66 CO -0.08 -0.42 -0.39 0.00 -0.57 0.00 0.00 179.45 178.00 2dlv h ALA 67 N -0.12 -0.14 0.22 3.86 0.00 -0.86 0.39 119.26 122.62 2dlv h ALA 67 Ca 0.01 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2dlv h ALA 67 Cb 0.64 0.89 -0.04 0.00 0.00 0.00 0.00 17.79 19.28 2dlv h ALA 67 CO -0.14 -0.74 -0.38 -0.22 0.00 0.00 0.00 179.25 177.77 2dlv h LYS 68 N -0.17 -0.65 0.20 0.00 3.64 -0.75 0.43 116.57 119.28 2dlv h LYS 68 Ca 0.22 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.64 2dlv h LYS 68 Cb 0.56 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.51 2dlv h LYS 68 CO -0.73 -0.43 -0.23 0.00 -2.27 0.00 0.00 179.45 175.79 2dlv h ALA 69 N -0.17 -0.90 -0.89 5.00 0.00 -0.21 -1.46 119.26 120.63 2dlv h ALA 69 Ca 0.00 -0.08 0.20 0.00 0.00 0.00 0.00 54.91 55.04 2dlv h ALA 69 Cb 0.66 0.50 -0.12 0.00 0.00 0.00 0.00 17.79 18.83 2dlv h ALA 69 CO -0.16 -0.93 0.41 0.82 0.00 0.00 0.00 179.25 179.40 2dlv h ILE 70 N -0.44 0.54 0.14 0.00 2.04 -0.23 0.09 117.51 119.65 2dlv h ILE 70 Ca -0.02 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 2dlv h ILE 70 Cb 0.39 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 2dlv h ILE 70 CO -0.04 0.08 -0.18 0.22 0.00 0.00 0.00 178.15 178.23 2dlv h TYR 71 N 0.46 -0.51 0.00 1.37 3.20 0.25 0.15 116.97 121.89 2dlv h TYR 71 Ca 0.54 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.41 2dlv h TYR 71 Cb 0.96 0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.43 2dlv h TYR 71 CO -0.12 -0.23 0.00 0.39 -1.64 0.00 0.00 178.16 176.56 2dlv n GLU 72 N -3.44 0.11 -0.00 1.82 1.02 -0.58 -0.26 120.64 119.31 2dlv n GLU 72 Ca -0.04 0.17 -0.00 0.00 -0.02 0.00 0.00 57.16 57.27 2dlv n GLU 72 Cb 0.16 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.08 2dlv n GLU 72 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2dlv h LYS 73 N 0.00 0.00 0.00 3.49 3.64 0.62 -3.43 116.57 120.89 2dlv h LYS 73 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2dlv h LYS 73 Cb 0.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2dlv h LYS 73 CO 0.00 0.00 -0.71 1.19 -2.27 0.00 0.00 179.45 177.66 2dlv n PHE 74 N -2.34 0.15 -0.07 1.91 3.01 0.36 -2.64 117.46 117.83 2dlv n PHE 74 Ca -0.00 0.06 -0.02 0.00 1.01 0.00 0.00 57.45 58.50 2dlv n PHE 74 Cb 0.01 -0.45 -0.02 0.00 -0.01 0.00 0.00 39.48 39.02 2dlv n PHE 74 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2dlv n ILE 75 N -4.06 -0.11 -1.65 4.37 2.08 -0.87 -3.50 119.36 115.61 2dlv n ILE 75 Ca -0.10 1.22 -0.43 0.00 0.56 0.00 0.00 62.75 64.00 2dlv n ILE 75 Cb 0.37 -1.58 -0.01 0.00 -0.75 0.00 0.00 39.64 37.67 2dlv n ILE 75 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2dlv n GLN 76 N -3.23 1.78 -1.80 0.38 10.64 0.65 -4.83 117.38 120.97 2dlv n GLN 76 Ca 0.00 0.62 -0.29 0.00 -1.83 0.00 0.00 57.00 55.51 2dlv n GLN 76 Cb 0.04 -2.11 0.13 0.00 -0.86 0.00 0.00 30.24 27.44 2dlv n GLN 76 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2dlv s THR 77 N -1.08 1.99 -1.13 -0.39 2.01 -1.26 -3.96 115.64 111.81 2dlv s THR 77 Ca 0.57 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.54 2dlv s THR 77 Cb -0.63 -2.93 0.02 0.00 0.01 0.00 0.00 72.50 68.98 2dlv s THR 77 CO 0.61 0.00 0.20 0.47 -0.69 0.00 0.00 174.62 175.21 2dlv n ASP 78 N -3.57 -3.91 -4.93 3.53 9.92 -1.26 -4.94 116.55 111.39 2dlv n ASP 78 Ca 0.09 -0.02 -0.20 0.00 -0.53 0.00 0.00 54.79 54.14 2dlv n ASP 78 Cb 0.60 -3.28 -0.01 0.00 -0.64 0.00 0.00 41.12 37.79 2dlv n ASP 78 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dlv s ALA 79 N -2.74 4.27 0.29 2.24 0.00 -1.25 -5.01 121.76 119.56 2dlv s ALA 79 Ca 0.15 -1.80 0.08 0.00 0.00 0.00 0.00 51.96 50.38 2dlv s ALA 79 Cb -0.08 -1.21 0.44 0.00 0.00 0.00 0.00 23.12 22.27 2dlv s ALA 79 CO 0.18 -0.30 1.68 -1.00 0.00 0.00 0.00 175.76 176.33 2dlv h PRO 80 N 0.84 0.17 -0.06 0.00 0.13 -1.88 -3.15 132.00 128.04 2dlv h PRO 80 Ca -0.40 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2dlv h PRO 80 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2dlv h PRO 80 CO 0.52 0.61 0.00 1.63 -0.23 0.00 0.00 178.00 180.53 2dlv n LYS 81 N -3.98 2.11 -1.57 0.86 4.76 -1.17 -4.96 118.16 114.21 2dlv n LYS 81 Ca -0.02 -2.28 -0.51 0.00 -2.87 0.00 0.00 58.31 52.63 2dlv n LYS 81 Cb 0.51 -1.40 -0.06 0.00 -1.84 0.00 0.00 35.03 32.24 2dlv n LYS 81 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2dlv n GLU 82 N -0.90 1.45 -3.07 1.97 -0.00 -1.08 -4.10 120.64 114.90 2dlv n GLU 82 Ca 0.12 0.47 -0.18 0.00 -0.00 0.00 0.00 57.16 57.57 2dlv n GLU 82 Cb 0.55 -2.49 0.01 0.00 -0.00 0.00 0.00 31.44 29.52 2dlv n GLU 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 2dlv s VAL 83 N 5.76 2.83 -0.52 3.84 -7.23 -1.23 -4.93 120.40 118.91 2dlv s VAL 83 Ca 1.02 -1.04 -0.28 0.00 -1.81 0.00 0.00 61.98 59.88 2dlv s VAL 83 Cb -0.82 -2.86 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 2dlv s VAL 83 CO 0.52 0.00 1.66 0.20 -0.31 0.00 0.00 175.10 177.17 2dlv s ASN 84 N -4.38 5.78 0.00 4.85 0.01 -1.26 -4.90 114.94 115.04 2dlv s ASN 84 Ca 0.55 0.55 0.01 0.00 -0.71 0.00 0.00 52.86 53.26 2dlv s ASN 84 Cb -0.09 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 39.03 2dlv s ASN 84 CO 0.33 -1.94 -0.05 -0.76 -1.51 0.00 0.00 177.10 173.18 2dlv s LEU 85 N 7.30 2.06 0.34 0.60 1.43 -1.26 -4.71 118.68 124.43 2dlv s LEU 85 Ca 0.64 -0.17 -0.28 0.00 -1.03 0.00 0.00 54.13 53.29 2dlv s LEU 85 Cb -0.14 -0.20 -0.10 0.00 0.03 0.00 0.00 46.19 45.78 2dlv s LEU 85 CO 0.26 -0.00 1.27 1.51 0.23 0.00 0.00 176.35 179.61 2dlv s ASP 86 N -0.39 6.77 0.28 2.29 -4.77 -1.26 -4.87 116.67 114.72 2dlv s ASP 86 Ca -0.01 2.60 -0.01 0.00 -3.30 0.00 0.00 52.55 51.83 2dlv s ASP 86 Cb -0.03 -2.64 0.63 0.00 -1.09 0.00 0.00 42.92 39.78 2dlv s ASP 86 CO -0.00 -0.53 1.61 0.15 0.70 0.00 0.00 175.17 177.10 2dlv h PHE 87 N 3.30 0.05 0.02 2.11 3.57 -2.00 -1.64 116.94 122.35 2dlv h PHE 87 Ca -0.49 0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.08 2dlv h PHE 87 Cb 1.23 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 40.07 2dlv h PHE 87 CO 0.56 -0.31 -0.18 1.25 -2.23 0.00 0.00 178.31 177.40 2dlv h HIS 88 N 0.09 -0.53 -0.88 0.41 2.76 -1.99 0.32 115.15 115.34 2dlv h HIS 88 Ca 0.52 0.02 0.21 0.00 -2.20 0.00 0.00 60.37 58.92 2dlv h HIS 88 Cb 1.02 0.23 -0.16 0.00 1.55 0.00 0.00 27.41 30.05 2dlv h HIS 88 CO -0.41 -0.20 -0.01 1.15 -1.30 0.00 0.00 177.93 177.16 2dlv h THR 89 N -0.24 0.18 -0.09 6.26 2.02 -1.70 0.24 112.91 119.58 2dlv h THR 89 Ca 0.00 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 2dlv h THR 89 Cb 0.25 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.77 2dlv h THR 89 CO -0.11 0.01 0.05 0.11 0.37 0.00 0.00 175.52 175.95 2dlv h LYS 90 N 0.06 0.13 0.29 6.66 1.57 -0.81 -2.03 116.57 122.45 2dlv h LYS 90 Ca 0.50 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.26 2dlv h LYS 90 Cb 0.93 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 2dlv h LYS 90 CO -0.80 0.15 -0.24 1.49 -0.57 0.00 0.00 179.45 179.48 2dlv h GLU 91 N 0.07 -0.52 -0.70 3.15 4.81 0.26 0.25 114.58 121.90 2dlv h GLU 91 Ca 0.03 0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.45 2dlv h GLU 91 Cb 0.06 0.12 -0.11 0.00 0.63 0.00 0.00 28.75 29.45 2dlv h GLU 91 CO -0.01 -0.34 0.15 0.28 -0.73 0.00 0.00 179.01 178.36 2dlv h VAL 92 N -0.54 0.53 -0.32 0.32 2.07 -0.65 -0.74 116.25 116.93 2dlv h VAL 92 Ca -0.02 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 2dlv h VAL 92 Cb 0.48 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2dlv h VAL 92 CO -0.02 0.05 -0.15 0.40 0.02 0.00 0.00 177.57 177.86 2dlv h ILE 93 N 0.25 1.29 -0.71 4.57 2.04 -1.03 0.42 117.51 124.33 2dlv h ILE 93 Ca 0.39 -1.26 0.11 0.00 1.00 0.00 0.00 64.86 65.10 2dlv h ILE 93 Cb 0.64 1.42 -0.08 0.00 -0.74 0.00 0.00 36.82 38.06 2dlv h ILE 93 CO -0.49 0.41 0.32 0.74 0.00 0.00 0.00 178.15 179.12 2dlv h THR 94 N 0.44 0.76 0.06 -0.27 2.02 0.84 1.15 112.91 117.92 2dlv h THR 94 Ca 0.07 -0.18 -0.28 0.00 0.77 0.00 0.00 66.41 66.80 2dlv h THR 94 Cb 0.68 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2dlv h THR 94 CO 0.05 0.09 -1.42 0.78 0.37 0.00 0.00 175.52 175.39 2dlv h ASN 95 N 0.51 0.21 -0.38 4.18 2.35 -1.14 -3.28 115.58 118.03 2dlv h ASN 95 Ca 0.37 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2dlv h ASN 95 Cb 0.47 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2dlv h ASN 95 CO -0.32 1.24 0.00 -0.24 -1.65 0.00 0.00 177.43 176.46 2dlv n SER 96 N -3.35 3.68 0.03 5.81 2.88 0.15 -4.19 113.62 118.62 2dlv n SER 96 Ca -0.12 -2.47 0.08 0.00 -1.33 0.00 0.00 58.87 55.03 2dlv n SER 96 Cb 1.02 -0.56 0.34 0.00 -0.75 0.00 0.00 64.21 64.26 2dlv n SER 96 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dlv n ILE 97 N 0.48 1.01 -0.00 2.46 0.13 0.39 -1.51 119.36 122.33 2dlv n ILE 97 Ca 0.17 0.26 0.09 0.00 -1.10 0.00 0.00 62.75 62.17 2dlv n ILE 97 Cb 0.76 -1.06 -0.13 0.00 -0.84 0.00 0.00 39.64 38.36 2dlv n ILE 97 CO 0.00 0.00 0.00 1.07 2.80 0.00 0.00 176.55 180.42 2dlv n THR 98 N -1.66 0.00 -1.56 9.51 5.66 -1.26 -4.44 114.28 120.54 2dlv n THR 98 Ca 0.03 -0.40 0.03 0.00 -3.05 0.00 0.00 64.05 60.67 2dlv n THR 98 Cb 0.17 0.11 0.21 0.00 -1.55 0.00 0.00 70.33 69.27 2dlv n THR 98 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2dlv n GLN 99 N -2.10 1.65 -2.18 1.09 6.02 -0.93 -5.04 117.38 115.90 2dlv n GLN 99 Ca -0.03 -3.27 -0.42 0.00 -0.01 0.00 0.00 57.00 53.27 2dlv n GLN 99 Cb 0.45 -1.67 -0.03 0.00 1.02 0.00 0.00 30.24 30.01 2dlv n GLN 99 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2dlv s PRO 100 N -3.24 4.27 0.60 -1.09 0.04 -0.57 -5.03 135.00 130.00 2dlv s PRO 100 Ca 0.40 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.52 2dlv s PRO 100 Cb 0.38 -3.56 0.09 0.00 0.04 0.00 0.00 34.50 31.45 2dlv s PRO 100 CO -0.05 -0.59 0.83 0.95 0.04 0.00 0.00 177.00 178.18 2dlv s THR 101 N 2.36 2.19 0.32 1.26 -4.23 -1.26 -4.89 115.64 111.39 2dlv s THR 101 Ca 0.65 -0.89 0.12 0.00 -1.18 0.00 0.00 61.69 60.39 2dlv s THR 101 Cb -0.33 -2.30 0.04 0.00 1.34 0.00 0.00 72.50 71.25 2dlv s THR 101 CO 0.27 0.00 1.73 -0.07 -0.54 0.00 0.00 174.62 176.01 2dlv h LEU 102 N 0.02 0.00 -3.22 4.79 3.38 -1.93 -2.63 115.31 115.71 2dlv h LEU 102 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2dlv h LEU 102 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2dlv h LEU 102 CO 0.41 0.48 0.00 1.41 0.09 0.00 0.00 178.44 180.83 2dlv n HIS 103 N -3.93 1.75 0.00 1.13 8.25 -1.26 -4.55 115.22 116.60 2dlv n HIS 103 Ca -0.01 -0.63 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 2dlv n HIS 103 Cb 0.50 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.23 2dlv n HIS 103 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2dlv n SER 104 N 0.79 0.00 -0.47 0.41 2.88 -0.99 -3.95 113.62 112.29 2dlv n SER 104 Ca 0.25 0.49 0.41 0.00 -1.33 0.00 0.00 58.87 58.70 2dlv n SER 104 Cb 1.03 -0.47 0.76 0.00 -0.75 0.00 0.00 64.21 64.78 2dlv n SER 104 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 2dlv h PHE 105 N 0.00 0.06 -0.84 0.66 0.04 -1.80 -0.64 116.94 114.42 2dlv h PHE 105 Ca 0.00 0.00 0.33 0.00 2.80 0.00 0.00 57.97 61.10 2dlv h PHE 105 Cb 0.00 -0.02 -0.15 0.00 2.20 0.00 0.00 35.95 37.98 2dlv h PHE 105 CO 0.01 -0.01 0.38 -0.25 -0.60 0.00 0.00 178.31 177.83 2dlv n ASP 106 N -4.15 0.23 0.44 2.17 9.92 -1.25 0.13 116.55 124.03 2dlv n ASP 106 Ca 0.33 1.40 -0.18 0.00 -0.53 0.00 0.00 54.79 55.81 2dlv n ASP 106 Cb 1.52 -0.65 -0.09 0.00 -0.64 0.00 0.00 41.12 41.26 2dlv n ASP 106 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dlv h ALA 107 N 1.68 -1.13 -0.68 2.24 0.00 -1.33 -2.72 119.26 117.33 2dlv h ALA 107 Ca 0.68 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 55.41 2dlv h ALA 107 Cb 1.75 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 19.91 2dlv h ALA 107 CO -0.67 -1.07 0.36 0.00 0.00 0.00 0.00 179.25 177.86 2dlv h ALA 108 N -1.18 0.92 -1.00 0.00 0.00 -0.50 -1.51 119.26 115.98 2dlv h ALA 108 Ca -0.12 0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.03 2dlv h ALA 108 Cb 0.87 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.47 2dlv h ALA 108 CO 0.19 0.00 0.61 0.37 0.00 0.00 0.00 179.25 180.42 2dlv h GLN 109 N 0.64 0.68 0.22 0.00 4.15 -0.72 -1.61 115.11 118.48 2dlv h GLN 109 Ca 0.32 -0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.70 2dlv h GLN 109 Cb 0.26 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 2dlv h GLN 109 CO -0.22 0.45 -0.29 1.03 -1.93 0.00 0.00 178.83 177.87 2dlv h SER 110 N 0.70 -0.81 -0.62 -0.69 0.87 -0.94 0.34 113.55 112.39 2dlv h SER 110 Ca 0.59 0.08 0.06 0.00 -1.23 0.00 0.00 61.79 61.29 2dlv h SER 110 Cb 1.00 0.29 -0.09 0.00 -0.44 0.00 0.00 62.40 63.16 2dlv h SER 110 CO -0.39 -0.40 -0.54 0.03 -0.53 0.00 0.00 176.83 174.99 2dlv h ARG 111 N -0.57 -0.21 0.32 2.24 2.47 -1.29 -0.46 114.38 116.87 2dlv h ARG 111 Ca 0.01 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2dlv h ARG 111 Cb 0.55 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 2dlv h ARG 111 CO -0.11 -0.14 -0.27 0.28 0.56 0.00 0.00 179.97 180.29 2dlv h VAL 112 N -0.22 0.43 -1.00 2.04 2.07 -1.44 0.19 116.25 118.33 2dlv h VAL 112 Ca 0.10 0.00 0.37 0.00 0.82 0.00 0.00 66.70 68.00 2dlv h VAL 112 Cb 0.49 0.43 -0.17 0.00 -1.52 0.00 0.00 31.29 30.52 2dlv h VAL 112 CO -0.70 0.00 0.50 0.22 0.02 0.00 0.00 177.57 177.61 2dlv h TYR 113 N -0.61 0.78 0.02 1.57 3.20 -0.09 0.37 116.97 122.22 2dlv h TYR 113 Ca -0.02 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2dlv h TYR 113 Cb 0.54 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.64 2dlv h TYR 113 CO -0.15 -0.37 -0.01 1.96 -1.64 0.00 0.00 178.16 177.94 2dlv h GLN 114 N 0.11 -0.03 -0.91 1.82 4.20 -0.54 -1.52 115.11 118.23 2dlv h GLN 114 Ca 0.79 0.00 0.22 0.00 0.06 0.00 0.00 58.65 59.71 2dlv h GLN 114 Cb 1.96 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 29.68 2dlv h GLN 114 CO -0.73 0.69 0.61 -0.07 -0.67 0.00 0.00 178.83 178.66 2dlv h LEU 115 N -0.90 0.35 0.00 1.46 3.38 0.12 -0.82 115.31 118.91 2dlv h LEU 115 Ca -0.00 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2dlv h LEU 115 Cb 0.74 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2dlv h LEU 115 CO 0.01 0.13 -0.02 0.24 0.09 0.00 0.00 178.44 178.89 2dlv h MET 116 N 0.34 0.00 0.00 1.13 2.86 -0.46 -0.72 114.93 118.08 2dlv h MET 116 Ca 0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.11 2dlv h MET 116 Cb 1.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.93 2dlv h MET 116 CO -0.16 0.50 0.36 1.49 1.06 0.00 0.00 176.91 180.15 2dlv h GLU 117 N -1.00 0.00 0.00 1.72 4.81 -0.75 0.48 114.58 119.85 2dlv h GLU 117 Ca -0.00 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.89 2dlv h GLU 117 Cb 0.50 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.82 2dlv h GLU 117 CO -0.00 0.00 -2.26 0.00 -0.73 0.00 0.00 179.01 176.01 2dlv n GLN 118 N -2.35 0.67 0.00 1.92 10.64 -0.36 -4.26 117.38 123.64 2dlv n GLN 118 Ca -0.01 0.10 0.00 0.00 -1.83 0.00 0.00 57.00 55.26 2dlv n GLN 118 Cb 0.39 -1.45 0.00 0.00 -0.86 0.00 0.00 30.24 28.32 2dlv n GLN 118 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 2dlv n ASP 119 N -3.06 0.00 -0.27 2.61 -0.08 0.16 -3.77 116.55 112.15 2dlv n ASP 119 Ca -0.38 0.05 0.08 0.00 -1.51 0.00 0.00 54.79 53.03 2dlv n ASP 119 Cb 0.95 -0.47 0.22 0.00 2.34 0.00 0.00 41.12 44.16 2dlv n ASP 119 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2dlv h SER 120 N 0.00 0.06 0.19 1.67 4.64 -0.39 -0.73 113.55 118.98 2dlv h SER 120 Ca 0.00 0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 2dlv h SER 120 Cb 0.00 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2dlv h SER 120 CO 0.00 -0.05 -0.09 0.22 -0.87 0.00 0.00 176.83 176.04 2dlv h TYR 121 N 0.29 -0.23 -0.98 4.77 3.20 -0.64 0.67 116.97 124.04 2dlv h TYR 121 Ca 0.46 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.49 2dlv h TYR 121 Cb 0.81 0.08 -0.17 0.00 1.54 0.00 0.00 36.73 38.99 2dlv h TYR 121 CO -0.25 -0.15 -0.32 0.25 -1.64 0.00 0.00 178.16 176.06 2dlv n THR 122 N -2.75 -0.47 -0.02 1.81 -2.24 -1.05 -0.29 114.28 109.26 2dlv n THR 122 Ca -0.03 2.28 -0.12 0.00 -2.27 0.00 0.00 64.05 63.90 2dlv n THR 122 Cb 0.10 -3.07 -0.08 0.00 -2.10 0.00 0.00 70.33 65.18 2dlv n THR 122 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2dlv h ARG 123 N 0.00 0.12 -0.53 -0.78 3.08 -1.15 -3.08 114.38 112.04 2dlv h ARG 123 Ca 0.40 -0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.51 2dlv h ARG 123 Cb 0.64 -0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.58 2dlv h ARG 123 CO -0.99 0.44 -0.17 0.35 -1.07 0.00 0.00 179.97 178.52 2dlv h PHE 124 N -0.21 -0.40 -0.80 3.04 3.57 0.32 0.70 116.94 123.15 2dlv h PHE 124 Ca 0.02 0.05 0.15 0.00 3.53 0.00 0.00 57.97 61.71 2dlv h PHE 124 Cb 0.39 0.26 -0.06 0.00 2.79 0.00 0.00 35.95 39.33 2dlv h PHE 124 CO 0.05 -0.27 0.53 -0.07 -2.23 0.00 0.00 178.31 176.32 2dlv h LEU 125 N -0.05 0.49 -3.31 0.59 3.38 -0.64 0.21 115.31 115.98 2dlv h LEU 125 Ca 0.25 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2dlv h LEU 125 Cb 0.43 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2dlv h LEU 125 CO -0.57 0.25 0.00 2.29 0.09 0.00 0.00 178.44 180.50 2dlv n LYS 126 N -4.51 3.93 -3.37 1.13 2.85 0.75 -4.61 118.16 114.34 2dlv n LYS 126 Ca 0.15 -2.93 -0.38 0.00 -1.05 0.00 0.00 58.31 54.11 2dlv n LYS 126 Cb 0.50 -1.98 -0.06 0.00 -0.65 0.00 0.00 35.03 32.85 2dlv n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2dlv s SER 127 N -1.11 6.86 0.18 -5.58 1.04 0.21 -4.97 113.70 110.33 2dlv s SER 127 Ca 0.49 1.02 -0.23 0.00 0.48 0.00 0.00 55.95 57.71 2dlv s SER 127 Cb 0.35 -2.30 0.09 0.00 0.10 0.00 0.00 66.02 64.26 2dlv s SER 127 CO 0.17 0.21 1.58 -0.78 0.98 0.00 0.00 173.24 175.40 2dlv h ASP 128 N 5.27 -1.33 -0.90 7.02 3.58 -1.89 -0.19 116.42 128.00 2dlv h ASP 128 Ca -0.48 0.24 0.16 0.00 0.42 0.00 0.00 57.03 57.37 2dlv h ASP 128 Cb 1.21 0.63 -0.16 0.00 1.72 0.00 0.00 39.33 42.73 2dlv h ASP 128 CO 0.66 -0.32 -0.31 0.40 -2.88 0.00 0.00 179.24 176.79 2dlv h ILE 129 N -0.19 0.06 0.75 2.25 2.04 -1.94 0.72 117.51 121.21 2dlv h ILE 129 Ca 0.21 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.03 2dlv h ILE 129 Cb 0.56 0.06 0.01 0.00 -0.74 0.00 0.00 36.82 36.71 2dlv h ILE 129 CO -0.69 0.00 -0.36 0.22 0.00 0.00 0.00 178.15 177.32 2dlv h TYR 130 N -0.03 -0.94 -0.13 1.37 5.03 -1.30 -2.49 116.97 118.49 2dlv h TYR 130 Ca 0.37 -0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.70 2dlv h TYR 130 Cb 0.62 0.31 -0.01 0.00 1.55 0.00 0.00 36.73 39.21 2dlv h TYR 130 CO -0.77 -0.56 0.35 -0.07 -1.32 0.00 0.00 178.16 175.79 2dlv h LEU 131 N -1.18 0.00 0.25 2.82 3.38 -0.06 -1.77 115.31 118.76 2dlv h LEU 131 Ca -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2dlv h LEU 131 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2dlv h LEU 131 CO 0.17 0.00 -0.12 -0.78 0.09 0.00 0.00 178.44 177.80 2dlv h ASP 132 N 0.00 -0.29 -0.75 -0.43 3.58 0.82 0.77 116.42 120.12 2dlv h ASP 132 Ca 0.06 -0.19 0.13 0.00 0.42 0.00 0.00 57.03 57.46 2dlv h ASP 132 Cb 0.77 0.07 -0.13 0.00 1.72 0.00 0.00 39.33 41.76 2dlv h ASP 132 CO -0.00 0.21 -0.23 0.18 -2.88 0.00 0.00 179.24 176.52 2dlv n LEU 133 N -5.01 -0.37 0.00 2.28 4.32 -0.67 0.12 117.00 117.68 2dlv n LEU 133 Ca -0.07 1.29 -0.13 0.00 -0.02 0.00 0.00 56.01 57.08 2dlv n LEU 133 Cb 0.23 -0.35 -0.14 0.00 -1.62 0.00 0.00 43.42 41.55 2dlv n LEU 133 CO 0.21 -1.20 -0.55 0.00 -1.22 0.00 0.00 177.39 174.62 2dlv h MET 134 N 0.00 0.11 -4.97 3.23 -0.00 -1.65 -3.44 114.93 108.22 2dlv h MET 134 Ca 0.31 -0.18 -0.29 0.00 -0.00 0.00 0.00 59.70 59.54 2dlv h MET 134 Cb 0.50 0.07 0.13 0.00 -0.00 0.00 0.00 31.60 32.30 2dlv h MET 134 CO -0.76 0.80 -0.60 0.45 -0.00 0.00 0.00 176.91 176.80 2dlv n SER 135 N -3.23 -3.46 -4.00 -0.10 2.88 0.27 -5.02 113.62 100.95 2dlv n SER 135 Ca -0.20 -0.48 -0.10 0.00 -1.33 0.00 0.00 58.87 56.75 2dlv n SER 135 Cb 1.05 -4.25 -0.11 0.00 -0.75 0.00 0.00 64.21 60.15 2dlv n SER 135 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dlv s GLY 136 N -3.77 0.32 0.06 0.46 0.00 -1.19 -5.03 107.32 98.16 2dlv s GLY 136 Ca 0.19 -0.64 -0.31 0.00 0.00 0.00 0.00 44.72 43.97 2dlv s GLY 136 CO 0.60 -0.70 1.41 2.56 0.00 0.00 0.00 173.10 176.96 2dlv s PRO 137 N -1.48 4.30 -0.21 2.90 0.04 -1.26 -4.94 135.00 134.35 2dlv s PRO 137 Ca -0.14 2.03 -0.10 0.00 0.04 0.00 0.00 61.00 62.83 2dlv s PRO 137 Cb -0.10 -3.43 -0.05 0.00 0.04 0.00 0.00 34.50 30.96 2dlv s PRO 137 CO -0.01 -0.52 0.13 -1.54 0.04 0.00 0.00 177.00 175.11 2dlv s SER 138 N 1.57 6.15 0.00 6.66 1.04 -1.26 -5.09 113.70 122.77 2dlv s SER 138 Ca 0.65 0.19 0.00 0.00 0.48 0.00 0.00 55.95 57.27 2dlv s SER 138 Cb -0.34 -2.09 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 2dlv s SER 138 CO 0.29 0.15 0.06 -0.44 0.98 0.00 0.00 173.24 174.28 2dlv s SER 139 N 0.53 5.52 0.00 7.02 0.01 -1.26 -5.19 113.70 120.34 2dlv s SER 139 Ca 0.08 0.10 0.22 0.00 1.31 0.00 0.00 55.95 57.65 2dlv s SER 139 Cb -0.12 -1.54 1.33 0.00 0.21 0.00 0.00 66.02 65.90 2dlv s SER 139 CO -0.00 0.27 1.70 0.61 0.41 0.00 0.00 173.24 176.23