#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlv s SER 2 N 0.00 2.13 0.23 1.61 0.01 -1.26 -5.12 113.70 111.30 2dlv s SER 2 Ca 0.00 -0.42 -0.21 0.00 1.31 0.00 0.00 55.95 56.63 2dlv s SER 2 Cb 0.00 -0.20 0.07 0.00 0.21 0.00 0.00 66.02 66.10 2dlv s SER 2 CO 0.00 0.16 0.96 -0.55 0.41 0.00 0.00 173.24 174.22 2dlv s SER 3 N -0.84 -0.03 0.00 2.44 0.15 -1.26 -5.10 113.70 109.06 2dlv s SER 3 Ca 0.06 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.95 2dlv s SER 3 Cb -0.08 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 2dlv s SER 3 CO 0.01 -1.17 0.38 0.61 1.20 0.00 0.00 173.24 174.27 2dlv n GLY 4 N -0.62 -2.82 3.99 9.45 0.00 -1.26 -4.73 105.19 109.19 2dlv n GLY 4 Ca -0.05 0.50 -0.21 0.00 0.00 0.00 0.00 46.02 46.27 2dlv n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlv s SER 5 N -2.83 5.18 0.65 1.61 0.01 -1.26 -5.11 113.70 111.94 2dlv s SER 5 Ca 0.00 -0.18 -0.04 0.00 1.31 0.00 0.00 55.95 57.04 2dlv s SER 5 Cb 0.00 -0.63 0.05 0.00 0.21 0.00 0.00 66.02 65.65 2dlv s SER 5 CO 0.00 -1.21 0.93 -0.44 0.41 0.00 0.00 173.24 172.93 2dlv s SER 6 N -4.48 4.96 -0.53 2.44 0.01 -1.26 -4.70 113.70 110.15 2dlv s SER 6 Ca 0.59 0.28 -0.15 0.00 1.31 0.00 0.00 55.95 57.98 2dlv s SER 6 Cb -0.09 -1.01 0.02 0.00 0.21 0.00 0.00 66.02 65.15 2dlv s SER 6 CO 0.39 -1.45 0.63 0.61 0.41 0.00 0.00 173.24 173.83 2dlv n GLY 7 N -2.72 -1.07 3.86 3.44 0.00 -1.26 -4.99 105.19 102.45 2dlv n GLY 7 Ca 0.08 1.04 -0.36 0.00 0.00 0.00 0.00 46.02 46.78 2dlv n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dlv s SER 8 N -2.54 6.66 0.36 1.61 1.04 -1.26 -4.70 113.70 114.86 2dlv s SER 8 Ca 0.20 0.79 0.15 0.00 0.48 0.00 0.00 55.95 57.57 2dlv s SER 8 Cb -0.05 -2.18 0.69 0.00 0.10 0.00 0.00 66.02 64.58 2dlv s SER 8 CO 0.79 0.26 1.77 1.55 0.98 0.00 0.00 173.24 178.59 2dlv h PRO 9 N 4.24 0.00 -0.98 4.02 0.13 -1.91 -2.92 132.00 134.57 2dlv h PRO 9 Ca -0.51 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.72 2dlv h PRO 9 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 2dlv h PRO 9 CO 0.64 0.41 0.62 1.49 -0.23 0.00 0.00 178.00 180.92 2dlv h GLU 10 N 0.00 1.01 0.22 0.86 4.81 -1.98 -1.89 114.58 117.61 2dlv h GLU 10 Ca -0.00 -0.06 -0.28 0.00 -0.13 0.00 0.00 59.36 58.88 2dlv h GLU 10 Cb 0.80 -0.23 0.03 0.00 0.63 0.00 0.00 28.75 29.99 2dlv h GLU 10 CO 0.05 0.67 -1.24 0.93 -0.73 0.00 0.00 179.01 178.69 2dlv h GLU 11 N 1.04 0.46 -0.41 1.92 4.39 -1.97 -3.32 114.58 116.69 2dlv h GLU 11 Ca 0.46 -0.78 0.08 0.00 0.34 0.00 0.00 59.36 59.46 2dlv h GLU 11 Cb 0.34 0.29 -0.09 0.00 -0.10 0.00 0.00 28.75 29.19 2dlv h GLU 11 CO -0.23 1.37 -0.26 0.00 -1.16 0.00 0.00 179.01 178.74 2dlv h ALA 12 N 0.12 -0.03 -0.87 3.43 0.00 -1.26 0.24 119.26 120.89 2dlv h ALA 12 Ca -0.22 0.13 0.17 0.00 0.00 0.00 0.00 54.91 54.99 2dlv h ALA 12 Cb 1.98 0.59 -0.07 0.00 0.00 0.00 0.00 17.79 20.30 2dlv h ALA 12 CO 0.23 -0.64 0.57 -0.24 0.00 0.00 0.00 179.25 179.17 2dlv h VAL 13 N -0.19 0.77 0.01 0.00 3.04 -1.49 -2.06 116.25 116.33 2dlv h VAL 13 Ca 0.19 -0.19 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2dlv h VAL 13 Cb 0.49 0.17 0.00 0.00 -2.01 0.00 0.00 31.29 29.95 2dlv h VAL 13 CO -0.52 0.10 -0.00 0.11 -1.01 0.00 0.00 177.57 176.25 2dlv h LYS 14 N 0.55 -0.01 -0.84 4.17 1.57 -0.88 -3.33 116.57 117.79 2dlv h LYS 14 Ca 0.45 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 59.31 2dlv h LYS 14 Cb 0.90 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.10 2dlv h LYS 14 CO -0.19 0.64 -0.47 0.91 -0.57 0.00 0.00 179.45 179.77 2dlv n TRP 15 N -4.78 -0.31 -0.29 -1.35 8.01 0.55 0.11 117.44 119.38 2dlv n TRP 15 Ca -0.09 1.05 0.29 0.00 -1.31 0.00 0.00 57.50 57.44 2dlv n TRP 15 Cb 0.33 -0.61 0.53 0.00 -2.01 0.00 0.00 31.31 29.55 2dlv n TRP 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2dlv n GLY 16 N -1.24 -0.68 0.09 6.99 0.00 -1.15 -1.56 105.19 107.63 2dlv n GLY 16 Ca 0.03 0.73 -0.02 0.00 0.00 0.00 0.00 46.02 46.75 2dlv n GLY 16 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dlv n GLU 17 N -5.01 -0.09 -4.03 1.61 1.02 0.30 -4.61 120.64 109.83 2dlv n GLU 17 Ca 0.34 0.86 -0.11 0.00 -0.02 0.00 0.00 57.16 58.23 2dlv n GLU 17 Cb 1.17 -1.28 -0.11 0.00 -0.02 0.00 0.00 31.44 31.20 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 -3.64 0.59 0.49 1.62 0.15 -0.60 -5.03 113.70 107.27 2dlv s SER 18 Ca -0.02 -0.55 0.18 0.00 0.70 0.00 0.00 55.95 56.26 2dlv s SER 18 Cb 0.02 0.07 1.20 0.00 -1.71 0.00 0.00 66.02 65.60 2dlv s SER 18 CO 0.13 -0.26 2.06 0.15 1.20 0.00 0.00 173.24 176.52 2dlv h PHE 19 N 4.49 0.00 -0.06 3.44 3.57 -1.81 -2.74 116.94 123.83 2dlv h PHE 19 Ca -0.34 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.15 2dlv h PHE 19 Cb 1.20 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.94 2dlv h PHE 19 CO 0.65 0.12 -0.01 0.38 -2.23 0.00 0.00 178.31 177.22 2dlv h ASP 20 N 0.00 0.11 -0.97 0.41 3.04 -1.96 -2.65 116.42 114.41 2dlv h ASP 20 Ca -0.00 -0.36 0.21 0.00 -3.24 0.00 0.00 57.03 53.64 2dlv h ASP 20 Cb 0.23 -0.03 -0.12 0.00 -1.04 0.00 0.00 39.33 38.37 2dlv h ASP 20 CO 0.02 0.45 0.55 0.11 -2.04 0.00 0.00 179.24 178.32 2dlv h LYS 21 N -0.22 0.59 0.43 4.15 1.57 -1.78 -0.37 116.57 120.95 2dlv h LYS 21 Ca 0.02 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2dlv h LYS 21 Cb 0.40 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2dlv h LYS 21 CO 0.01 0.39 -0.21 1.25 -0.57 0.00 0.00 179.45 180.32 2dlv h LEU 22 N 0.61 -0.49 -0.33 2.94 5.85 -1.50 -3.08 115.31 119.31 2dlv h LEU 22 Ca 0.59 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 59.29 2dlv h LEU 22 Cb 1.04 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.12 2dlv h LEU 22 CO -0.45 -0.15 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.16 2dlv h LEU 23 N -0.87 -0.90 -0.94 2.25 3.38 -0.98 -0.42 115.31 116.83 2dlv h LEU 23 Ca -0.06 0.17 0.28 0.00 0.09 0.00 0.00 57.88 58.36 2dlv h LEU 23 Cb 0.56 0.43 -0.15 0.00 0.09 0.00 0.00 40.66 41.59 2dlv h LEU 23 CO 0.10 -0.29 0.34 -1.28 0.09 0.00 0.00 178.44 177.40 2dlv h SER 24 N -0.24 0.14 -3.91 -0.43 0.87 -1.13 -3.40 113.55 105.45 2dlv h SER 24 Ca 0.16 0.21 -0.50 0.00 -1.23 0.00 0.00 61.79 60.44 2dlv h SER 24 Cb 0.50 0.25 0.03 0.00 -0.44 0.00 0.00 62.40 62.73 2dlv h SER 24 CO -0.47 -0.20 0.46 -2.28 -0.53 0.00 0.00 176.83 173.81 2dlv s HIS 25 N -5.82 3.30 -0.03 2.24 5.65 -0.17 -5.00 115.29 115.47 2dlv s HIS 25 Ca -0.11 1.63 -0.01 0.00 0.25 0.00 0.00 55.06 56.82 2dlv s HIS 25 Cb 0.28 -3.25 -0.01 0.00 -1.18 0.00 0.00 32.58 28.43 2dlv s HIS 25 CO 0.78 -0.81 0.11 -0.09 -0.65 0.00 0.00 174.74 174.08 2dlv h ARG 26 N 2.93 -0.04 -0.88 2.88 2.43 -1.81 -2.63 114.38 117.26 2dlv h ARG 26 Ca -0.48 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 58.83 2dlv h ARG 26 Cb 1.22 0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 30.63 2dlv h ARG 26 CO 0.64 -0.03 -0.37 -0.44 -1.51 0.00 0.00 179.97 178.26 2dlv h ASP 27 N -0.31 -1.36 -0.71 -3.80 3.32 -1.94 0.27 116.42 111.89 2dlv h ASP 27 Ca -0.00 0.29 0.01 0.00 0.02 0.00 0.00 57.03 57.34 2dlv h ASP 27 Cb 0.03 0.71 -0.04 0.00 0.22 0.00 0.00 39.33 40.25 2dlv h ASP 27 CO 0.01 -0.29 0.47 1.23 -1.72 0.00 0.00 179.24 178.93 2dlv h GLY 28 N -0.05 0.99 0.75 2.75 0.00 -1.84 -2.47 103.07 103.21 2dlv h GLY 28 Ca 0.31 -0.37 0.06 0.00 0.00 0.00 0.00 47.33 47.33 2dlv h GLY 28 CO -0.90 0.36 0.59 -2.00 0.00 0.00 0.00 176.54 174.58 2dlv h LEU 29 N 0.95 0.94 0.62 3.11 5.85 -0.16 -2.40 115.31 124.22 2dlv h LEU 29 Ca 0.26 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 2dlv h LEU 29 Cb -0.11 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 2dlv h LEU 29 CO -0.06 0.60 -0.42 -0.33 -0.34 0.00 0.00 178.44 177.90 2dlv h GLU 30 N 1.08 -0.95 -0.82 1.25 5.08 -0.58 -2.07 114.58 117.57 2dlv h GLU 30 Ca 0.39 0.06 0.20 0.00 -1.00 0.00 0.00 59.36 59.02 2dlv h GLU 30 Cb 0.14 0.22 -0.13 0.00 0.50 0.00 0.00 28.75 29.48 2dlv h GLU 30 CO -0.16 -0.63 0.17 0.00 -1.00 0.00 0.00 179.01 177.38 2dlv h ALA 31 N -1.25 1.09 -0.31 3.43 0.00 -1.35 0.61 119.26 121.49 2dlv h ALA 31 Ca -0.08 0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2dlv h ALA 31 Cb 0.80 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 2dlv h ALA 31 CO 0.06 -0.43 -0.00 0.35 0.00 0.00 0.00 179.25 179.23 2dlv h PHE 32 N 0.20 -0.02 -0.22 0.00 3.57 -1.17 -2.55 116.94 116.75 2dlv h PHE 32 Ca 0.49 0.02 0.06 0.00 3.53 0.00 0.00 57.97 62.07 2dlv h PHE 32 Cb 0.94 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.67 2dlv h PHE 32 CO -0.31 -0.05 -0.16 1.15 -2.23 0.00 0.00 178.31 176.71 2dlv h THR 33 N 0.09 0.55 -0.47 4.41 2.02 -0.18 -2.78 112.91 116.56 2dlv h THR 33 Ca 0.15 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.38 2dlv h THR 33 Cb 0.20 0.55 -0.08 0.00 -1.74 0.00 0.00 68.15 67.08 2dlv h THR 33 CO -0.25 0.00 -0.52 0.03 0.37 0.00 0.00 175.52 175.15 2dlv h ARG 34 N -0.15 -0.29 -0.97 6.66 3.08 -1.02 0.22 114.38 121.91 2dlv h ARG 34 Ca 0.13 0.02 0.37 0.00 0.07 0.00 0.00 59.98 60.57 2dlv h ARG 34 Cb 0.34 0.07 -0.18 0.00 0.08 0.00 0.00 29.97 30.28 2dlv h ARG 34 CO -0.32 -0.20 0.39 0.34 -1.07 0.00 0.00 179.97 179.12 2dlv n PHE 35 N -5.14 1.00 -0.02 3.04 7.35 -1.05 0.74 117.46 123.37 2dlv n PHE 35 Ca -0.02 1.16 -0.16 0.00 -0.76 0.00 0.00 57.45 57.67 2dlv n PHE 35 Cb 0.30 -1.47 -0.10 0.00 0.35 0.00 0.00 39.48 38.57 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 0.44 -0.80 -2.13 3.38 -0.62 -3.22 115.31 112.35 2dlv h LEU 36 Ca 0.77 -0.69 0.19 0.00 0.09 0.00 0.00 57.88 58.24 2dlv h LEU 36 Cb 1.94 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 42.42 2dlv h LEU 36 CO -0.79 1.06 0.09 0.11 0.09 0.00 0.00 178.44 178.99 2dlv h LYS 37 N -0.14 0.14 -0.65 1.13 1.57 0.27 0.54 116.57 119.43 2dlv h LYS 37 Ca -0.04 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2dlv h LYS 37 Cb 1.07 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.32 2dlv h LYS 37 CO 0.08 0.09 0.34 1.79 -0.57 0.00 0.00 179.45 181.19 2dlv h THR 38 N 0.14 1.20 -0.47 -0.16 1.35 -1.39 -1.18 112.91 112.39 2dlv h THR 38 Ca 0.46 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 2dlv h THR 38 Cb 0.86 0.33 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 2dlv h THR 38 CO -0.67 0.23 0.00 -0.62 -0.25 0.00 0.00 175.52 174.21 2dlv n GLU 39 N -4.37 2.62 -3.11 4.72 -0.58 0.15 -4.91 120.64 115.16 2dlv n GLU 39 Ca 0.06 -1.92 -0.21 0.00 -0.42 0.00 0.00 57.16 54.67 2dlv n GLU 39 Cb 0.11 -1.58 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 2dlv n GLU 39 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2dlv n PHE 40 N 0.82 -1.75 0.46 -0.32 3.72 0.11 -4.81 117.46 115.69 2dlv n PHE 40 Ca 0.18 0.39 0.06 0.00 -0.05 0.00 0.00 57.45 58.02 2dlv n PHE 40 Cb 0.57 -3.24 -0.07 0.00 -0.94 0.00 0.00 39.48 35.80 2dlv n PHE 40 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2dlv n SER 41 N -2.24 0.82 -0.36 4.37 7.64 0.09 -4.56 113.62 119.38 2dlv n SER 41 Ca -0.06 -0.65 0.26 0.00 1.01 0.00 0.00 58.87 59.43 2dlv n SER 41 Cb 0.57 1.09 0.52 0.00 -1.01 0.00 0.00 64.21 65.38 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 0.29 -1.05 1.43 9.09 -1.82 0.21 114.58 122.73 2dlv h GLU 42 Ca 0.00 -0.02 0.30 0.00 0.05 0.00 0.00 59.36 59.70 2dlv h GLU 42 Cb 0.32 -0.07 -0.04 0.00 -1.65 0.00 0.00 28.75 27.31 2dlv h GLU 42 CO 0.00 0.19 1.21 -0.85 0.05 0.00 0.00 179.01 179.61 2dlv n GLU 43 N -4.88 0.01 0.09 1.06 0.28 -1.26 0.25 120.64 116.20 2dlv n GLU 43 Ca 0.31 1.00 -0.07 0.00 -0.16 0.00 0.00 57.16 58.24 2dlv n GLU 43 Cb 1.05 -2.49 -0.04 0.00 1.43 0.00 0.00 31.44 31.38 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 -0.28 0.02 -1.84 2.35 -0.89 -3.28 115.58 111.67 2dlv h ASN 44 Ca 0.50 -0.11 -0.07 0.00 -0.55 0.00 0.00 56.30 56.07 2dlv h ASN 44 Cb 2.91 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 41.34 2dlv h ASN 44 CO -0.01 0.22 -0.18 -0.29 -1.65 0.00 0.00 177.43 175.52 2dlv h ILE 45 N -1.04 1.22 -0.96 2.81 6.09 -0.37 -2.82 117.51 122.44 2dlv h ILE 45 Ca -0.03 -0.99 0.20 0.00 -1.37 0.00 0.00 64.86 62.66 2dlv h ILE 45 Cb 0.37 1.28 -0.11 0.00 0.47 0.00 0.00 36.82 38.83 2dlv h ILE 45 CO 0.05 0.31 0.55 -0.33 -3.07 0.00 0.00 178.15 175.66 2dlv h GLU 46 N 0.29 0.63 -0.18 2.19 5.08 -0.72 -0.18 114.58 121.69 2dlv h GLU 46 Ca 0.05 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.19 2dlv h GLU 46 Cb 0.49 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.60 2dlv h GLU 46 CO 0.03 0.42 -0.61 0.35 -1.00 0.00 0.00 179.01 178.20 2dlv h PHE 47 N 0.65 0.97 -0.79 4.33 3.04 -1.55 -2.85 116.94 120.74 2dlv h PHE 47 Ca 0.57 -0.40 0.14 0.00 3.98 0.00 0.00 57.97 62.26 2dlv h PHE 47 Cb 0.94 -0.16 -0.09 0.00 2.56 0.00 0.00 35.95 39.20 2dlv h PHE 47 CO -0.04 1.21 0.35 2.35 -2.02 0.00 0.00 178.31 180.16 2dlv h TRP 48 N 0.46 0.61 0.22 0.41 7.01 -1.01 -2.41 115.95 121.24 2dlv h TRP 48 Ca -0.02 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 2dlv h TRP 48 Cb 1.24 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 28.15 2dlv h TRP 48 CO 0.09 0.11 -0.10 0.82 -2.79 0.00 0.00 178.44 176.56 2dlv h ILE 49 N 0.51 0.85 -0.80 2.65 2.04 -1.39 -3.16 117.51 118.21 2dlv h ILE 49 Ca 0.43 -0.76 0.31 0.00 1.00 0.00 0.00 64.86 65.84 2dlv h ILE 49 Cb 0.63 1.26 -0.15 0.00 -0.74 0.00 0.00 36.82 37.83 2dlv h ILE 49 CO -0.38 0.16 0.35 0.00 0.00 0.00 0.00 178.15 178.27 2dlv n ALA 50 N -2.45 0.74 0.37 1.87 0.00 -0.92 -0.10 120.51 120.01 2dlv n ALA 50 Ca -0.09 0.83 -0.15 0.00 0.00 0.00 0.00 53.44 54.03 2dlv n ALA 50 Cb 0.25 -0.78 -0.07 0.00 0.00 0.00 0.00 19.45 18.85 2dlv n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dlv n GLU 52 N -4.66 -0.12 -0.01 0.00 -0.58 0.85 0.20 120.64 116.32 2dlv n GLU 52 Ca -0.12 1.26 -0.09 0.00 -0.42 0.00 0.00 57.16 57.80 2dlv n GLU 52 Cb 0.39 -1.88 0.07 0.00 -0.57 0.00 0.00 31.44 29.45 2dlv n GLU 52 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2dlv h ASP 53 N 0.00 0.63 -0.64 1.62 1.82 -1.40 -2.99 116.42 115.46 2dlv h ASP 53 Ca 0.35 -0.31 0.12 0.00 -0.39 0.00 0.00 57.03 56.79 2dlv h ASP 53 Cb 0.55 -0.18 -0.04 0.00 0.68 0.00 0.00 39.33 40.34 2dlv h ASP 53 CO -0.83 1.01 0.43 0.15 -1.61 0.00 0.00 179.24 178.40 2dlv h PHE 54 N 0.46 0.44 0.00 0.28 3.04 0.53 0.78 116.94 122.47 2dlv h PHE 54 Ca 0.03 0.01 -0.13 0.00 3.98 0.00 0.00 57.97 61.86 2dlv h PHE 54 Cb 1.01 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 39.36 2dlv h PHE 54 CO 0.04 0.19 -0.60 0.87 -2.02 0.00 0.00 178.31 176.79 2dlv h LYS 55 N 0.40 0.00 -0.73 1.11 1.57 -0.97 -2.83 116.57 115.12 2dlv h LYS 55 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2dlv h LYS 55 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 2dlv h LYS 55 CO -0.09 0.60 0.00 1.63 -0.57 0.00 0.00 179.45 181.03 2dlv n LYS 56 N -3.76 1.51 -1.30 3.15 5.02 0.26 -4.89 118.16 118.15 2dlv n LYS 56 Ca -0.01 -0.46 -0.30 0.00 -2.02 0.00 0.00 58.31 55.52 2dlv n LYS 56 Cb 0.61 -1.49 0.12 0.00 -0.02 0.00 0.00 35.03 34.26 2dlv n LYS 56 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2dlv s SER 57 N -0.34 3.83 -0.05 4.39 1.04 -1.07 -5.06 113.70 116.44 2dlv s SER 57 Ca 0.08 1.48 0.03 0.00 0.48 0.00 0.00 55.95 58.02 2dlv s SER 57 Cb 0.06 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 64.01 2dlv s SER 57 CO 0.03 -2.41 -0.15 -0.54 0.98 0.00 0.00 173.24 171.15 2dlv s LYS 58 N -4.98 1.80 0.32 4.02 -0.14 -1.26 -5.01 119.74 114.49 2dlv s LYS 58 Ca 0.62 -0.54 0.00 0.00 -1.36 0.00 0.00 55.97 54.70 2dlv s LYS 58 Cb -0.17 -1.51 0.00 0.00 -1.68 0.00 0.00 37.83 34.47 2dlv s LYS 58 CO 0.56 0.15 0.00 0.41 -0.76 0.00 0.00 175.35 175.71 2dlv n GLY 59 N 3.43 -2.59 0.23 -3.33 0.00 -1.26 -3.46 105.19 98.20 2dlv n GLY 59 Ca -0.20 -1.24 0.10 0.00 0.00 0.00 0.00 46.02 44.68 2dlv n GLY 59 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlv h PRO 60 N -0.85 0.00 0.78 1.61 0.13 -2.00 -3.26 132.00 128.40 2dlv h PRO 60 Ca -0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.02 2dlv h PRO 60 Cb 0.83 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.97 2dlv h PRO 60 CO 0.03 0.23 -0.37 0.37 -0.23 0.00 0.00 178.00 178.03 2dlv h GLN 61 N 0.00 -1.01 -0.74 0.86 5.75 -2.00 -1.76 115.11 116.21 2dlv h GLN 61 Ca -0.00 0.07 0.16 0.00 -0.15 0.00 0.00 58.65 58.73 2dlv h GLN 61 Cb 0.66 0.23 -0.13 0.00 1.07 0.00 0.00 27.48 29.31 2dlv h GLN 61 CO 0.03 -0.66 -0.06 0.37 -2.65 0.00 0.00 178.83 175.85 2dlv h GLN 62 N -1.24 0.06 -0.30 1.69 5.75 -1.60 0.10 115.11 119.57 2dlv h GLN 62 Ca -0.11 -0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.41 2dlv h GLN 62 Cb 0.81 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.33 2dlv h GLN 62 CO 0.18 0.04 0.15 0.82 -2.65 0.00 0.00 178.83 177.37 2dlv h ILE 63 N 0.06 0.99 -0.74 2.39 2.04 -1.60 0.26 117.51 120.92 2dlv h ILE 63 Ca 0.39 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 66.16 2dlv h ILE 63 Cb 0.65 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 2dlv h ILE 63 CO -0.69 0.06 0.47 0.45 0.00 0.00 0.00 178.15 178.43 2dlv h HIS 64 N 0.32 0.88 0.56 1.37 3.86 0.02 0.33 115.15 122.48 2dlv h HIS 64 Ca 0.12 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.33 2dlv h HIS 64 Cb 0.04 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 28.22 2dlv h HIS 64 CO -0.09 0.51 -0.27 -0.07 0.86 0.00 0.00 177.93 178.87 2dlv h LEU 65 N 0.92 -0.64 -0.63 2.43 4.07 -0.48 -2.92 115.31 118.06 2dlv h LEU 65 Ca 0.29 0.02 0.11 0.00 0.08 0.00 0.00 57.88 58.38 2dlv h LEU 65 Cb -0.00 0.16 -0.08 0.00 1.08 0.00 0.00 40.66 41.82 2dlv h LEU 65 CO -0.10 -0.24 0.22 0.11 -1.08 0.00 0.00 178.44 177.35 2dlv h LYS 66 N -1.19 0.37 -0.25 1.13 1.57 -0.47 0.47 116.57 118.20 2dlv h LYS 66 Ca -0.08 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.74 2dlv h LYS 66 Cb 0.58 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.73 2dlv h LYS 66 CO 0.13 0.24 -0.41 0.00 -0.57 0.00 0.00 179.45 178.84 2dlv h ALA 67 N 1.46 -0.48 0.62 3.86 0.00 -0.41 0.28 119.26 124.59 2dlv h ALA 67 Ca 0.33 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 2dlv h ALA 67 Cb 0.45 0.80 0.01 0.00 0.00 0.00 0.00 17.79 19.04 2dlv h ALA 67 CO -0.35 -0.88 -0.30 0.87 0.00 0.00 0.00 179.25 178.60 2dlv h LYS 68 N -0.41 -0.81 -0.96 0.00 1.57 -1.22 0.60 116.57 115.34 2dlv h LYS 68 Ca 0.11 0.06 0.26 0.00 -1.87 0.00 0.00 60.65 59.21 2dlv h LYS 68 Cb 0.60 0.18 -0.18 0.00 0.08 0.00 0.00 32.23 32.91 2dlv h LYS 68 CO -0.47 -0.54 0.05 0.00 -0.57 0.00 0.00 179.45 177.93 2dlv h ALA 69 N -1.41 1.17 0.06 3.86 0.00 -0.81 0.58 119.26 122.71 2dlv h ALA 69 Ca -0.09 0.32 -0.26 0.00 0.00 0.00 0.00 54.91 54.89 2dlv h ALA 69 Cb 0.64 0.56 0.01 0.00 0.00 0.00 0.00 17.79 19.00 2dlv h ALA 69 CO 0.14 -0.56 -1.10 0.82 0.00 0.00 0.00 179.25 178.55 2dlv h ILE 70 N 0.03 1.39 0.89 0.00 2.04 -0.42 -3.08 117.51 118.36 2dlv h ILE 70 Ca 0.59 -2.59 -0.04 0.00 1.00 0.00 0.00 64.86 63.81 2dlv h ILE 70 Cb 1.21 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.91 2dlv h ILE 70 CO -0.88 0.77 -0.47 0.22 0.00 0.00 0.00 178.15 177.79 2dlv h TYR 71 N 0.21 -1.22 0.00 1.37 3.20 0.53 -1.31 116.97 119.74 2dlv h TYR 71 Ca -0.12 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.73 2dlv h TYR 71 Cb 1.76 0.42 0.00 0.00 1.54 0.00 0.00 36.73 40.45 2dlv h TYR 71 CO 0.08 -0.73 0.00 0.39 -1.64 0.00 0.00 178.16 176.25 2dlv n GLU 72 N -5.47 0.16 -0.05 1.82 1.02 0.69 -0.74 120.64 118.07 2dlv n GLU 72 Ca -0.15 0.14 -0.03 0.00 -0.02 0.00 0.00 57.16 57.09 2dlv n GLU 72 Cb 0.50 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.41 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 -1.22 -3.38 116.57 119.10 2dlv h LYS 73 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2dlv h LYS 73 Cb 0.05 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 -0.53 1.19 -2.27 0.00 0.00 179.45 177.84 2dlv n PHE 74 N -4.20 0.00 0.00 1.91 3.01 -0.59 -2.52 117.46 115.08 2dlv n PHE 74 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2dlv n PHE 74 Cb 0.17 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 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 -3.92 0.00 -0.65 4.37 2.08 -0.77 -3.47 119.36 117.01 2dlv n ILE 75 Ca -0.07 0.79 -0.31 0.00 0.56 0.00 0.00 62.75 63.71 2dlv n ILE 75 Cb 0.26 -1.09 0.18 0.00 -0.75 0.00 0.00 39.64 38.23 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 -1.91 -1.76 -0.09 0.38 10.64 0.08 -4.81 117.38 119.91 2dlv n GLN 76 Ca 0.00 -0.50 -0.09 0.00 -1.83 0.00 0.00 57.00 54.58 2dlv n GLN 76 Cb 0.00 -1.69 -0.14 0.00 -0.86 0.00 0.00 30.24 27.55 2dlv n GLN 76 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 2dlv n THR 77 N -4.49 1.25 0.89 -0.39 5.66 -1.26 -4.30 114.28 111.64 2dlv n THR 77 Ca 0.01 -0.77 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 2dlv n THR 77 Cb 0.61 -0.52 0.00 0.00 -1.55 0.00 0.00 70.33 68.87 2dlv n THR 77 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2dlv n ASP 78 N -2.68 0.58 -4.91 1.09 -0.08 -1.26 -4.78 116.55 104.52 2dlv n ASP 78 Ca -0.30 -1.48 -0.26 0.00 -1.51 0.00 0.00 54.79 51.25 2dlv n ASP 78 Cb 1.09 -0.29 -0.03 0.00 2.34 0.00 0.00 41.12 44.23 2dlv n ASP 78 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2dlv s ALA 79 N -1.21 3.87 0.15 -1.67 0.00 -1.26 -5.03 121.76 116.60 2dlv s ALA 79 Ca 0.00 -1.10 -0.10 0.00 0.00 0.00 0.00 51.96 50.76 2dlv s ALA 79 Cb 0.00 -1.67 -0.03 0.00 0.00 0.00 0.00 23.12 21.42 2dlv s ALA 79 CO 0.00 0.50 1.48 -1.00 0.00 0.00 0.00 175.76 176.74 2dlv h PRO 80 N 2.09 0.93 -0.65 0.00 0.13 -1.83 -3.00 132.00 129.68 2dlv h PRO 80 Ca -0.49 -0.49 0.00 0.00 -0.87 0.00 0.00 66.00 64.16 2dlv h PRO 80 Cb 1.20 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2dlv h PRO 80 CO 0.66 1.14 0.00 1.63 -0.23 0.00 0.00 178.00 181.21 2dlv n LYS 81 N -4.06 3.88 -1.53 0.86 4.76 -1.18 -4.96 118.16 115.94 2dlv n LYS 81 Ca -0.02 -2.53 -0.51 0.00 -2.87 0.00 0.00 58.31 52.38 2dlv n LYS 81 Cb 0.54 -2.01 -0.06 0.00 -1.84 0.00 0.00 35.03 31.66 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 0.67 1.34 -2.65 1.97 -0.00 -1.05 -4.40 120.64 116.54 2dlv n GLU 82 Ca 0.23 0.41 -0.23 0.00 -0.00 0.00 0.00 57.16 57.57 2dlv n GLU 82 Cb 0.94 -2.50 0.11 0.00 -0.00 0.00 0.00 31.44 29.98 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 6.34 2.06 -0.66 3.84 -7.23 -1.23 -5.01 120.40 118.51 2dlv s VAL 83 Ca 1.05 -0.64 -0.27 0.00 -1.81 0.00 0.00 61.98 60.30 2dlv s VAL 83 Cb -0.82 -2.41 0.02 0.00 0.56 0.00 0.00 36.38 33.73 2dlv s VAL 83 CO 0.51 0.00 1.34 0.20 -0.31 0.00 0.00 175.10 176.84 2dlv s ASN 84 N -4.78 6.13 -0.00 4.85 0.01 -1.26 -4.93 114.94 114.96 2dlv s ASN 84 Ca 0.67 -0.13 0.05 0.00 -0.71 0.00 0.00 52.86 52.74 2dlv s ASN 84 Cb -0.05 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.05 2dlv s ASN 84 CO 0.44 -1.79 -0.17 -0.76 -1.51 0.00 0.00 177.10 173.31 2dlv s LEU 85 N 5.94 2.06 0.39 0.60 1.43 -1.26 -4.81 118.68 123.04 2dlv s LEU 85 Ca 0.43 -0.35 -0.27 0.00 -1.03 0.00 0.00 54.13 52.91 2dlv s LEU 85 Cb -0.09 -0.86 -0.10 0.00 0.03 0.00 0.00 46.19 45.18 2dlv s LEU 85 CO 0.19 0.19 1.41 -1.81 0.23 0.00 0.00 176.35 176.56 2dlv s ASP 86 N -0.56 6.29 0.17 2.29 1.01 -1.26 -4.83 116.67 119.77 2dlv s ASP 86 Ca 0.06 2.89 -0.27 0.00 0.71 0.00 0.00 52.55 55.94 2dlv s ASP 86 Cb -0.07 -2.66 0.01 0.00 1.01 0.00 0.00 42.92 41.22 2dlv s ASP 86 CO -0.00 -0.89 1.56 0.15 0.21 0.00 0.00 175.17 176.20 2dlv h PHE 87 N 2.84 -1.43 -0.43 4.23 3.04 -2.00 -1.63 116.94 121.55 2dlv h PHE 87 Ca -0.50 0.09 0.05 0.00 3.98 0.00 0.00 57.97 61.58 2dlv h PHE 87 Cb 1.24 0.72 -0.07 0.00 2.56 0.00 0.00 35.95 40.40 2dlv h PHE 87 CO 0.53 -0.43 -0.43 1.25 -2.02 0.00 0.00 178.31 177.22 2dlv h HIS 88 N -0.20 -1.32 -0.92 0.41 2.76 -1.99 0.25 115.15 114.14 2dlv h HIS 88 Ca 0.17 0.07 0.26 0.00 -2.20 0.00 0.00 60.37 58.67 2dlv h HIS 88 Cb 0.55 0.63 -0.14 0.00 1.55 0.00 0.00 27.41 30.00 2dlv h HIS 88 CO -0.78 -0.34 0.36 1.15 -1.30 0.00 0.00 177.93 177.02 2dlv h THR 89 N -0.21 0.33 -0.33 6.26 2.02 -1.70 0.43 112.91 119.71 2dlv h THR 89 Ca 0.07 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 2dlv h THR 89 Cb 0.41 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 2dlv h THR 89 CO -0.52 0.05 0.02 0.11 0.37 0.00 0.00 175.52 175.55 2dlv h LYS 90 N 0.28 0.57 0.43 6.66 1.57 0.08 -2.52 116.57 123.64 2dlv h LYS 90 Ca 0.61 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 59.20 2dlv h LYS 90 Cb 1.27 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2dlv h LYS 90 CO -0.62 0.68 -0.21 1.49 -0.57 0.00 0.00 179.45 180.22 2dlv h GLU 91 N 0.38 -0.56 -0.98 3.15 4.81 0.25 -0.72 114.58 120.90 2dlv h GLU 91 Ca 0.09 0.04 0.24 0.00 -0.13 0.00 0.00 59.36 59.60 2dlv h GLU 91 Cb 0.41 0.13 -0.18 0.00 0.63 0.00 0.00 28.75 29.74 2dlv h GLU 91 CO 0.01 -0.37 -0.09 -0.24 -0.73 0.00 0.00 179.01 177.59 2dlv h VAL 92 N -0.79 0.02 -0.34 0.32 3.04 -0.43 0.51 116.25 118.59 2dlv h VAL 92 Ca -0.06 -0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 65.57 2dlv h VAL 92 Cb 0.45 0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 29.73 2dlv h VAL 92 CO 0.10 0.00 -0.01 0.40 -1.01 0.00 0.00 177.57 177.05 2dlv h ILE 93 N 0.01 1.26 -0.99 3.17 2.04 -1.47 0.33 117.51 121.86 2dlv h ILE 93 Ca 0.54 -0.99 0.20 0.00 1.00 0.00 0.00 64.86 65.61 2dlv h ILE 93 Cb 1.00 1.24 -0.11 0.00 -0.74 0.00 0.00 36.82 38.20 2dlv h ILE 93 CO -0.96 0.33 0.58 0.74 0.00 0.00 0.00 178.15 178.84 2dlv h THR 94 N 0.41 0.66 0.04 -0.27 2.02 0.16 0.75 112.91 116.68 2dlv h THR 94 Ca 0.09 -0.24 -0.30 0.00 0.77 0.00 0.00 66.41 66.74 2dlv h THR 94 Cb 0.47 -0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 2dlv h THR 94 CO 0.02 0.13 -1.64 0.78 0.37 0.00 0.00 175.52 175.18 2dlv h ASN 95 N 0.70 0.13 -0.30 4.18 2.35 -1.13 -3.32 115.58 118.19 2dlv h ASN 95 Ca 0.58 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 2dlv h ASN 95 Cb 0.95 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.28 2dlv h ASN 95 CO -0.41 1.21 0.00 -0.24 -1.65 0.00 0.00 177.43 176.34 2dlv n SER 96 N -3.22 3.02 0.00 5.81 2.88 0.11 -3.99 113.62 118.23 2dlv n SER 96 Ca -0.17 -2.35 0.14 0.00 -1.33 0.00 0.00 58.87 55.15 2dlv n SER 96 Cb 1.04 -0.51 0.65 0.00 -0.75 0.00 0.00 64.21 64.64 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 0.37 0.09 -0.04 2.46 0.13 0.25 -1.67 119.36 120.95 2dlv n ILE 97 Ca 0.13 0.02 0.01 0.00 -1.10 0.00 0.00 62.75 61.81 2dlv n ILE 97 Cb 0.62 -0.55 -0.12 0.00 -0.84 0.00 0.00 39.64 38.75 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 -1.39 0.49 -1.45 9.51 5.66 -1.26 -4.50 114.28 121.35 2dlv n THR 98 Ca 0.10 -0.50 0.05 0.00 -3.05 0.00 0.00 64.05 60.65 2dlv n THR 98 Cb 0.27 -0.22 0.20 0.00 -1.55 0.00 0.00 70.33 69.03 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 -2.29 1.64 -2.26 1.09 0.00 -1.20 -5.04 117.38 109.32 2dlv n GLN 99 Ca -0.13 -3.13 -0.37 0.00 0.00 0.00 0.00 57.00 53.37 2dlv n GLN 99 Cb 0.69 -1.65 -0.01 0.00 0.00 0.00 0.00 30.24 29.27 2dlv n GLN 99 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2dlv s PRO 100 N -3.16 3.78 0.53 2.61 0.04 -0.67 -5.04 135.00 133.09 2dlv s PRO 100 Ca 0.38 1.78 0.02 0.00 0.04 0.00 0.00 61.00 63.23 2dlv s PRO 100 Cb 0.36 -2.43 0.01 0.00 0.04 0.00 0.00 34.50 32.47 2dlv s PRO 100 CO -0.03 -0.53 0.11 0.95 0.04 0.00 0.00 177.00 177.53 2dlv s THR 101 N -1.53 1.23 -0.49 1.26 -4.23 -1.26 -4.90 115.64 105.72 2dlv s THR 101 Ca 0.63 -1.87 0.15 0.00 -1.18 0.00 0.00 61.69 59.42 2dlv s THR 101 Cb -0.29 -2.10 0.15 0.00 1.34 0.00 0.00 72.50 71.61 2dlv s THR 101 CO 0.35 0.00 1.46 0.18 -0.54 0.00 0.00 174.62 176.07 2dlv n LEU 102 N -1.42 0.38 -0.88 4.79 4.77 -1.26 -0.45 117.00 122.94 2dlv n LEU 102 Ca -0.15 0.67 0.08 0.00 -0.03 0.00 0.00 56.01 56.57 2dlv n LEU 102 Cb 0.66 -0.70 0.24 0.00 -2.33 0.00 0.00 43.42 41.29 2dlv n LEU 102 CO 0.38 -0.77 0.70 1.41 -1.33 0.00 0.00 177.39 177.78 2dlv n HIS 103 N -2.00 0.88 0.14 -1.77 8.25 -1.26 -4.66 115.22 114.81 2dlv n HIS 103 Ca -0.01 -0.79 -0.13 0.00 -0.26 0.00 0.00 57.72 56.53 2dlv n HIS 103 Cb 0.04 -0.26 -0.08 0.00 1.12 0.00 0.00 29.99 30.81 2dlv n HIS 103 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dlv h SER 104 N 1.93 -0.31 0.00 0.41 0.87 -1.13 -2.78 113.55 112.55 2dlv h SER 104 Ca 0.00 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 2dlv h SER 104 Cb 1.32 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.36 2dlv h SER 104 CO 0.19 0.04 0.00 0.49 -0.53 0.00 0.00 176.83 177.02 2dlv n PHE 105 N -5.11 0.00 -0.17 2.24 3.72 -1.26 -3.81 117.46 113.07 2dlv n PHE 105 Ca -0.09 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.23 2dlv n PHE 105 Cb 0.25 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.81 2dlv n PHE 105 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 2dlv h ASP 106 N 0.00 0.59 0.14 4.37 3.58 -1.78 -1.61 116.42 121.70 2dlv h ASP 106 Ca 0.00 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.40 2dlv h ASP 106 Cb 0.00 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.90 2dlv h ASP 106 CO 0.00 0.46 -0.07 0.00 -2.88 0.00 0.00 179.24 176.75 2dlv h ALA 107 N 1.16 -0.18 -0.69 -0.78 0.00 -1.77 -3.30 119.26 113.69 2dlv h ALA 107 Ca 0.18 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 54.98 2dlv h ALA 107 Cb -0.03 0.07 -0.13 0.00 0.00 0.00 0.00 17.79 17.70 2dlv h ALA 107 CO -0.04 -0.25 -0.32 0.00 0.00 0.00 0.00 179.25 178.65 2dlv h ALA 108 N -0.36 0.09 -0.88 0.00 0.00 -1.77 0.17 119.26 116.51 2dlv h ALA 108 Ca -0.02 0.21 0.24 0.00 0.00 0.00 0.00 54.91 55.34 2dlv h ALA 108 Cb 0.52 0.79 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 2dlv h ALA 108 CO 0.03 -0.62 0.17 0.37 0.00 0.00 0.00 179.25 179.20 2dlv h GLN 109 N -0.10 0.14 -0.30 0.00 4.15 -1.40 0.21 115.11 117.80 2dlv h GLN 109 Ca 0.28 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.73 2dlv h GLN 109 Cb 0.56 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.18 2dlv h GLN 109 CO -0.75 0.10 0.09 1.03 -1.93 0.00 0.00 178.83 177.36 2dlv h SER 110 N 0.15 0.08 -0.03 -0.69 0.87 -0.74 0.27 113.55 113.45 2dlv h SER 110 Ca 0.55 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 61.18 2dlv h SER 110 Cb 1.10 0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 63.04 2dlv h SER 110 CO -0.71 0.08 -0.40 -0.09 -0.53 0.00 0.00 176.83 175.18 2dlv h ARG 111 N 0.21 -0.51 -0.30 2.24 1.12 -0.35 -1.87 114.38 114.93 2dlv h ARG 111 Ca 0.14 0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 59.03 2dlv h ARG 111 Cb 0.12 0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 30.19 2dlv h ARG 111 CO -0.16 -0.34 0.13 0.28 -3.11 0.00 0.00 179.97 176.78 2dlv h VAL 112 N -0.53 1.16 -0.94 0.20 2.07 -1.23 -2.07 116.25 114.90 2dlv h VAL 112 Ca 0.06 -0.47 0.28 0.00 0.82 0.00 0.00 66.70 67.38 2dlv h VAL 112 Cb 0.63 0.93 -0.15 0.00 -1.52 0.00 0.00 31.29 31.18 2dlv h VAL 112 CO -0.33 0.17 0.39 0.22 0.02 0.00 0.00 177.57 178.04 2dlv h TYR 113 N 0.34 0.62 -0.02 1.57 3.20 -0.02 0.69 116.97 123.34 2dlv h TYR 113 Ca 0.10 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.93 2dlv h TYR 113 Cb 0.14 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.30 2dlv h TYR 113 CO -0.01 -0.20 -0.32 1.96 -1.64 0.00 0.00 178.16 177.94 2dlv h GLN 114 N 0.26 0.25 -0.94 1.82 4.20 -1.09 -2.56 115.11 117.05 2dlv h GLN 114 Ca 0.64 -0.24 0.26 0.00 0.06 0.00 0.00 58.65 59.37 2dlv h GLN 114 Cb 1.40 0.06 -0.13 0.00 0.30 0.00 0.00 27.48 29.10 2dlv h GLN 114 CO -0.64 0.94 0.45 -0.07 -0.67 0.00 0.00 178.83 178.83 2dlv h LEU 115 N -0.34 0.38 0.04 1.46 3.38 -0.20 0.35 115.31 120.38 2dlv h LEU 115 Ca -0.03 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2dlv h LEU 115 Cb 1.03 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2dlv h LEU 115 CO 0.06 -0.05 -0.02 0.24 0.09 0.00 0.00 178.44 178.77 2dlv h MET 116 N 0.38 -0.05 -1.40 1.13 2.86 -1.30 -3.30 114.93 113.25 2dlv h MET 116 Ca 0.62 0.00 0.44 0.00 -2.06 0.00 0.00 59.70 58.71 2dlv h MET 116 Cb 1.27 0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.85 2dlv h MET 116 CO -0.57 -0.03 0.96 -1.91 1.06 0.00 0.00 176.91 176.42 2dlv n GLU 117 N -2.52 -0.02 0.00 1.72 2.13 -0.97 0.87 120.64 121.87 2dlv n GLU 117 Ca -0.01 1.00 -0.02 0.00 0.66 0.00 0.00 57.16 58.80 2dlv n GLU 117 Cb 0.02 -2.11 -0.01 0.00 0.27 0.00 0.00 31.44 29.60 2dlv n GLU 117 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2dlv h GLN 118 N 0.00 -0.08 0.00 5.31 1.08 -1.01 -3.33 115.11 117.09 2dlv h GLN 118 Ca 0.77 0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.94 2dlv h GLN 118 Cb 2.77 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 30.21 2dlv h GLN 118 CO -0.23 -0.05 -1.15 -3.47 -0.95 0.00 0.00 178.83 172.98 2dlv n ASP 119 N -2.91 3.98 -0.03 1.46 2.03 -0.06 -4.53 116.55 116.50 2dlv n ASP 119 Ca -0.01 -0.01 -0.14 0.00 0.52 0.00 0.00 54.79 55.15 2dlv n ASP 119 Cb 0.05 0.12 -0.10 0.00 -0.72 0.00 0.00 41.12 40.48 2dlv n ASP 119 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2dlv h SER 120 N 0.00 -1.68 0.35 1.67 0.02 0.26 0.32 113.55 114.49 2dlv h SER 120 Ca -0.06 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 2dlv h SER 120 Cb 1.10 0.66 -0.00 0.00 0.14 0.00 0.00 62.40 64.30 2dlv h SER 120 CO -0.01 -0.45 -0.21 0.22 -1.14 0.00 0.00 176.83 175.25 2dlv h TYR 121 N -0.53 -0.55 -0.99 3.45 3.20 -1.61 0.21 116.97 120.15 2dlv h TYR 121 Ca 0.04 -0.01 0.33 0.00 3.14 0.00 0.00 58.73 62.23 2dlv h TYR 121 Cb 0.64 0.19 -0.18 0.00 1.54 0.00 0.00 36.73 38.92 2dlv h TYR 121 CO -0.60 -0.31 0.25 1.79 -1.64 0.00 0.00 178.16 177.65 2dlv h THR 122 N -0.51 0.04 0.05 1.81 1.35 -1.64 0.32 112.91 114.32 2dlv h THR 122 Ca -0.05 -0.01 -0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2dlv h THR 122 Cb 0.41 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 66.84 2dlv h THR 122 CO 0.05 0.01 -0.02 0.03 -0.25 0.00 0.00 175.52 175.34 2dlv h ARG 123 N 0.03 -0.06 -0.58 4.72 3.08 -0.13 -3.01 114.38 118.43 2dlv h ARG 123 Ca 0.70 0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.92 2dlv h ARG 123 Cb 1.62 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.66 2dlv h ARG 123 CO -0.84 0.37 0.45 0.35 -1.07 0.00 0.00 179.97 179.23 2dlv h PHE 124 N -0.50 0.00 0.00 3.04 3.57 0.28 0.40 116.94 123.73 2dlv h PHE 124 Ca -0.01 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 2dlv h PHE 124 Cb 0.45 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 2dlv h PHE 124 CO 0.07 0.00 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.06 2dlv h LEU 125 N 0.00 0.00 -0.22 0.59 3.38 -0.80 -2.28 115.31 115.99 2dlv h LEU 125 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2dlv h LEU 125 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2dlv h LEU 125 CO -0.00 0.02 -0.08 2.29 0.09 0.00 0.00 178.44 180.75 2dlv n LYS 126 N -3.44 4.91 -1.67 1.13 -0.00 0.11 -4.78 118.16 114.42 2dlv n LYS 126 Ca -0.03 -0.13 -0.45 0.00 -0.00 0.00 0.00 58.31 57.71 2dlv n LYS 126 Cb 0.11 -0.69 -0.04 0.00 -0.00 0.00 0.00 35.03 34.41 2dlv n LYS 126 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2dlv n SER 127 N -0.82 3.86 -0.22 -5.58 3.41 0.39 -4.76 113.62 109.90 2dlv n SER 127 Ca 0.01 0.94 0.08 0.00 -0.26 0.00 0.00 58.87 59.64 2dlv n SER 127 Cb 0.04 -1.47 0.16 0.00 -0.26 0.00 0.00 64.21 62.68 2dlv n SER 127 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2dlv n ASP 128 N 6.89 -0.12 -0.17 4.04 9.92 -1.26 0.14 116.55 135.99 2dlv n ASP 128 Ca 0.21 1.08 -0.04 0.00 -0.53 0.00 0.00 54.79 55.51 2dlv n ASP 128 Cb 0.36 -0.38 0.02 0.00 -0.64 0.00 0.00 41.12 40.48 2dlv n ASP 128 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2dlv h ILE 129 N 0.00 0.28 0.03 0.53 2.04 -1.91 0.54 117.51 119.02 2dlv h ILE 129 Ca 0.36 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.22 2dlv h ILE 129 Cb 0.70 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2dlv h ILE 129 CO -0.62 0.00 -0.02 0.22 0.00 0.00 0.00 178.15 177.74 2dlv h TYR 130 N -0.13 -0.04 -0.03 1.37 5.03 0.11 0.16 116.97 123.43 2dlv h TYR 130 Ca 0.23 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.55 2dlv h TYR 130 Cb 0.51 0.01 -0.00 0.00 1.55 0.00 0.00 36.73 38.80 2dlv h TYR 130 CO -0.54 -0.02 0.02 -0.07 -1.32 0.00 0.00 178.16 176.23 2dlv h LEU 131 N -0.05 0.01 0.12 2.82 3.38 -0.85 -2.83 115.31 117.91 2dlv h LEU 131 Ca -0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2dlv h LEU 131 Cb 0.04 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2dlv h LEU 131 CO 0.01 0.00 -0.06 -0.78 0.09 0.00 0.00 178.44 177.71 2dlv h ASP 132 N 0.01 -0.13 -1.13 -0.43 3.58 0.70 -0.49 116.42 118.53 2dlv h ASP 132 Ca 0.02 -0.24 0.42 0.00 0.42 0.00 0.00 57.03 57.64 2dlv h ASP 132 Cb 0.05 0.03 -0.16 0.00 1.72 0.00 0.00 39.33 40.98 2dlv h ASP 132 CO -0.00 0.45 0.66 0.17 -2.88 0.00 0.00 179.24 177.64 2dlv h LEU 133 N -0.99 0.31 0.11 2.28 8.10 -0.54 0.67 115.31 125.24 2dlv h LEU 133 Ca -0.02 0.21 -0.32 0.00 0.11 0.00 0.00 57.88 57.86 2dlv h LEU 133 Cb 0.37 0.21 -0.01 0.00 -0.44 0.00 0.00 40.66 40.78 2dlv h LEU 133 CO 0.03 -0.32 -1.68 0.00 -4.11 0.00 0.00 178.44 172.35 2dlv h MET 134 N 0.06 0.23 -6.04 0.17 -0.00 -1.58 -3.43 114.93 104.33 2dlv h MET 134 Ca 0.84 -0.39 -0.46 0.00 -0.00 0.00 0.00 59.70 59.69 2dlv h MET 134 Cb 2.34 0.15 -0.04 0.00 -0.00 0.00 0.00 31.60 34.04 2dlv h MET 134 CO -0.63 1.06 -0.72 -1.13 -0.00 0.00 0.00 176.91 175.49 2dlv n SER 135 N -3.41 -4.71 -4.93 -0.10 3.41 0.23 -4.62 113.62 99.50 2dlv n SER 135 Ca -0.21 -0.69 -0.21 0.00 -0.26 0.00 0.00 58.87 57.51 2dlv n SER 135 Cb 1.05 -3.78 0.05 0.00 -0.26 0.00 0.00 64.21 61.26 2dlv n SER 135 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dlv s GLY 136 N -3.15 1.82 -0.74 5.00 0.00 -1.26 -5.00 107.32 103.99 2dlv s GLY 136 Ca 0.60 -1.47 -0.26 0.00 0.00 0.00 0.00 44.72 43.59 2dlv s GLY 136 CO 0.74 -1.14 1.90 2.56 0.00 0.00 0.00 173.10 177.16 2dlv s PRO 137 N -4.79 2.60 -0.15 2.90 0.04 -1.26 -4.77 135.00 129.57 2dlv s PRO 137 Ca 0.59 0.22 0.16 0.00 0.04 0.00 0.00 61.00 62.00 2dlv s PRO 137 Cb -0.09 -4.68 0.56 0.00 0.04 0.00 0.00 34.50 30.32 2dlv s PRO 137 CO 0.39 -3.01 1.46 0.45 0.04 0.00 0.00 177.00 176.33 2dlv n SER 138 N 13.28 4.09 -4.92 6.66 2.88 -1.26 -5.00 113.62 129.35 2dlv n SER 138 Ca 0.29 -2.79 -0.26 0.00 -1.33 0.00 0.00 58.87 54.78 2dlv n SER 138 Cb 0.50 -0.52 -0.02 0.00 -0.75 0.00 0.00 64.21 63.42 2dlv n SER 138 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dlv s SER 139 N -1.52 6.34 0.00 -3.46 1.04 -1.26 -5.27 113.70 109.57 2dlv s SER 139 Ca 0.42 0.60 0.00 0.00 0.48 0.00 0.00 55.95 57.44 2dlv s SER 139 Cb 0.32 -2.09 0.00 0.00 0.10 0.00 0.00 66.02 64.34 2dlv s SER 139 CO 0.12 -0.29 0.21 0.61 0.98 0.00 0.00 173.24 174.88