#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 0.52 0.86 1.61 0.02 -2.08 -3.35 113.55 111.13 2dlv h SER 2 Ca 0.00 -0.66 -0.04 0.00 -0.84 0.00 0.00 61.79 60.24 2dlv h SER 2 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2dlv h SER 2 CO 0.00 1.10 -0.46 -1.28 -1.14 0.00 0.00 176.83 175.05 2dlv h SER 3 N -0.03 -1.12 -3.32 3.07 0.87 -2.12 -3.42 113.55 107.49 2dlv h SER 3 Ca -0.04 0.05 -0.66 0.00 -1.23 0.00 0.00 61.79 59.92 2dlv h SER 3 Cb 1.11 0.31 -0.27 0.00 -0.44 0.00 0.00 62.40 63.10 2dlv h SER 3 CO 0.09 -0.75 -0.77 -0.83 -0.53 0.00 0.00 176.83 174.05 2dlv s GLY 4 N -1.94 1.53 -0.27 5.77 0.00 -1.26 -5.09 107.32 106.07 2dlv s GLY 4 Ca -0.18 -0.93 -0.05 0.00 0.00 0.00 0.00 44.72 43.56 2dlv s GLY 4 CO 0.56 -0.12 0.54 -0.45 0.00 0.00 0.00 173.10 173.63 2dlv s SER 5 N 0.48 -0.82 -0.01 1.64 0.15 -1.26 -4.53 113.70 109.36 2dlv s SER 5 Ca -0.09 1.01 0.05 0.00 0.70 0.00 0.00 55.95 57.61 2dlv s SER 5 Cb -0.16 1.88 -0.01 0.00 -1.71 0.00 0.00 66.02 66.02 2dlv s SER 5 CO 0.04 -0.25 -0.15 -0.44 1.20 0.00 0.00 173.24 173.65 2dlv s SER 6 N 2.77 1.74 -0.15 5.45 0.01 -1.26 -4.97 113.70 117.30 2dlv s SER 6 Ca 0.07 -0.28 -0.02 0.00 1.31 0.00 0.00 55.95 57.03 2dlv s SER 6 Cb -0.14 -0.19 0.01 0.00 0.21 0.00 0.00 66.02 65.91 2dlv s SER 6 CO -0.18 0.17 0.03 0.61 0.41 0.00 0.00 173.24 174.28 2dlv n GLY 7 N 2.64 -3.77 3.69 3.44 0.00 -1.26 -5.02 105.19 104.91 2dlv n GLY 7 Ca -0.15 0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.76 5.84 0.43 1.61 1.04 -1.26 -4.98 113.70 115.62 2dlv s SER 8 Ca -0.04 0.17 0.30 0.00 0.48 0.00 0.00 55.95 56.86 2dlv s SER 8 Cb 0.00 -1.98 1.23 0.00 0.10 0.00 0.00 66.02 65.38 2dlv s SER 8 CO 0.42 0.21 1.88 1.55 0.98 0.00 0.00 173.24 178.28 2dlv h PRO 9 N 6.41 0.00 -0.20 4.02 0.13 -1.96 -2.92 132.00 137.48 2dlv h PRO 9 Ca -0.41 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.57 2dlv h PRO 9 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2dlv h PRO 9 CO 0.70 0.00 -0.52 1.49 -0.23 0.00 0.00 178.00 179.43 2dlv h GLU 10 N 0.00 0.58 -0.09 0.86 4.81 -1.94 -3.07 114.58 115.73 2dlv h GLU 10 Ca 0.00 -0.35 -0.21 0.00 -0.13 0.00 0.00 59.36 58.67 2dlv h GLU 10 Cb 0.43 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2dlv h GLU 10 CO 0.00 0.96 -0.80 0.93 -0.73 0.00 0.00 179.01 179.36 2dlv h GLU 11 N 0.45 0.58 0.34 1.92 4.39 -1.94 -3.27 114.58 117.05 2dlv h GLU 11 Ca 0.01 -0.51 -0.01 0.00 0.34 0.00 0.00 59.36 59.20 2dlv h GLU 11 Cb 1.06 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 2dlv h GLU 11 CO 0.10 1.13 -0.35 0.00 -1.16 0.00 0.00 179.01 178.73 2dlv h ALA 12 N 0.72 -1.03 -1.11 3.43 0.00 -1.52 0.36 119.26 120.11 2dlv h ALA 12 Ca -0.05 -0.13 0.37 0.00 0.00 0.00 0.00 54.91 55.09 2dlv h ALA 12 Cb 1.42 0.58 -0.14 0.00 0.00 0.00 0.00 17.79 19.65 2dlv h ALA 12 CO 0.15 -1.05 0.67 -0.24 0.00 0.00 0.00 179.25 178.78 2dlv h VAL 13 N -0.69 0.22 -0.05 0.00 3.04 -1.65 0.48 116.25 117.61 2dlv h VAL 13 Ca -0.04 -0.07 -0.20 0.00 -1.01 0.00 0.00 66.70 65.38 2dlv h VAL 13 Cb 0.60 -0.00 0.01 0.00 -2.01 0.00 0.00 31.29 29.89 2dlv h VAL 13 CO -0.04 0.04 -0.74 0.11 -1.01 0.00 0.00 177.57 175.92 2dlv h LYS 14 N 0.21 0.59 -1.01 4.17 1.57 -1.44 -3.25 116.57 117.41 2dlv h LYS 14 Ca 0.76 -0.57 0.32 0.00 -1.87 0.00 0.00 60.65 59.29 2dlv h LYS 14 Cb 2.03 0.15 -0.14 0.00 0.08 0.00 0.00 32.23 34.34 2dlv h LYS 14 CO -0.53 1.19 0.58 -1.49 -0.57 0.00 0.00 179.45 178.63 2dlv h TRP 15 N 0.21 0.92 -0.67 -1.35 6.55 0.41 0.66 115.95 122.68 2dlv h TRP 15 Ca -0.08 0.04 0.13 0.00 0.95 0.00 0.00 58.89 59.92 2dlv h TRP 15 Cb 1.41 -0.25 -0.04 0.00 -0.86 0.00 0.00 29.16 29.42 2dlv h TRP 15 CO 0.12 -0.14 0.45 0.78 -1.05 0.00 0.00 178.44 178.59 2dlv h GLY 16 N 0.35 0.60 -0.79 1.49 0.00 -1.52 -2.63 103.07 100.57 2dlv h GLY 16 Ca 0.72 -0.16 0.18 0.00 0.00 0.00 0.00 47.33 48.08 2dlv h GLY 16 CO -0.58 0.08 -0.10 1.18 0.00 0.00 0.00 176.54 177.12 2dlv n GLU 17 N -4.47 -0.07 -3.48 4.80 -0.58 0.23 -4.63 120.64 112.45 2dlv n GLU 17 Ca 0.12 1.21 -0.12 0.00 -0.42 0.00 0.00 57.16 57.95 2dlv n GLU 17 Cb 0.46 -1.85 -0.03 0.00 -0.57 0.00 0.00 31.44 29.45 2dlv n GLU 17 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2dlv s SER 18 N -5.12 -0.51 0.15 1.62 0.01 -0.99 -5.04 113.70 103.82 2dlv s SER 18 Ca -0.11 0.18 -0.17 0.00 1.31 0.00 0.00 55.95 57.16 2dlv s SER 18 Cb 0.22 0.50 0.04 0.00 0.21 0.00 0.00 66.02 66.99 2dlv s SER 18 CO 0.61 -0.74 1.75 0.15 0.41 0.00 0.00 173.24 175.43 2dlv h PHE 19 N 2.25 0.23 -0.26 2.43 3.57 -1.82 -2.67 116.94 120.66 2dlv h PHE 19 Ca -0.28 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.30 2dlv h PHE 19 Cb 1.24 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.87 2dlv h PHE 19 CO 0.27 0.10 -0.14 0.22 -2.23 0.00 0.00 178.31 176.53 2dlv h ASP 20 N 0.28 -0.47 -0.84 0.41 3.58 -1.97 -1.89 116.42 115.53 2dlv h ASP 20 Ca 0.15 0.11 0.19 0.00 0.42 0.00 0.00 57.03 57.90 2dlv h ASP 20 Cb 0.11 0.25 -0.15 0.00 1.72 0.00 0.00 39.33 41.26 2dlv h ASP 20 CO -0.15 -0.18 -0.08 0.11 -2.88 0.00 0.00 179.24 176.07 2dlv h LYS 21 N -0.11 0.04 0.05 0.28 1.79 -1.75 0.25 116.57 117.11 2dlv h LYS 21 Ca 0.14 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.62 2dlv h LYS 21 Cb 0.32 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 2dlv h LYS 21 CO -0.33 0.03 -0.12 1.25 -1.08 0.00 0.00 179.45 179.19 2dlv h LEU 22 N 0.04 -0.34 -0.09 2.94 5.85 -1.26 -2.89 115.31 119.57 2dlv h LEU 22 Ca 0.45 0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.23 2dlv h LEU 22 Cb 0.78 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 2dlv h LEU 22 CO -0.80 -0.18 -0.04 -0.07 -0.34 0.00 0.00 178.44 177.02 2dlv h LEU 23 N -0.23 -0.12 -0.86 2.25 3.38 -0.56 -2.46 115.31 116.70 2dlv h LEU 23 Ca 0.03 0.03 0.29 0.00 0.09 0.00 0.00 57.88 58.32 2dlv h LEU 23 Cb 0.26 0.07 -0.16 0.00 0.09 0.00 0.00 40.66 40.92 2dlv h LEU 23 CO -0.09 -0.05 0.22 -0.24 0.09 0.00 0.00 178.44 178.37 2dlv n SER 24 N -5.16 0.08 -4.83 -0.43 2.88 0.64 -4.16 113.62 102.64 2dlv n SER 24 Ca -0.05 1.45 -0.38 0.00 -1.33 0.00 0.00 58.87 58.56 2dlv n SER 24 Cb 0.09 -0.61 -0.06 0.00 -0.75 0.00 0.00 64.21 62.88 2dlv n SER 24 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2dlv s HIS 25 N -5.59 3.75 0.03 0.66 5.65 -0.94 -5.02 115.29 113.84 2dlv s HIS 25 Ca -0.10 1.07 -0.29 0.00 0.25 0.00 0.00 55.06 55.99 2dlv s HIS 25 Cb 0.27 -2.35 -0.17 0.00 -1.18 0.00 0.00 32.58 29.16 2dlv s HIS 25 CO 0.67 0.63 1.32 -0.09 -0.65 0.00 0.00 174.74 176.62 2dlv h ARG 26 N 4.63 -0.87 -0.66 2.88 9.65 -1.81 -2.47 114.38 125.73 2dlv h ARG 26 Ca -0.51 0.06 0.09 0.00 -1.10 0.00 0.00 59.98 58.52 2dlv h ARG 26 Cb 1.22 0.20 -0.11 0.00 -1.39 0.00 0.00 29.97 29.89 2dlv h ARG 26 CO 0.62 -0.54 -0.48 -0.44 2.80 0.00 0.00 179.97 181.93 2dlv h ASP 27 N -1.09 -1.66 -0.14 -3.80 3.32 -1.93 0.15 116.42 111.26 2dlv h ASP 27 Ca -0.09 0.27 0.05 0.00 0.02 0.00 0.00 57.03 57.27 2dlv h ASP 27 Cb 0.72 0.75 -0.07 0.00 0.22 0.00 0.00 39.33 40.96 2dlv h ASP 27 CO 0.15 -0.33 -0.35 1.23 -1.72 0.00 0.00 179.24 178.23 2dlv h GLY 28 N -0.20 -0.50 0.42 2.75 0.00 -1.75 -1.51 103.07 102.29 2dlv h GLY 28 Ca 0.17 0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.93 2dlv h GLY 28 CO -0.74 -0.22 -0.47 -2.00 0.00 0.00 0.00 176.54 173.11 2dlv h LEU 29 N -0.41 -1.32 -0.69 3.11 5.85 -0.78 -1.12 115.31 119.95 2dlv h LEU 29 Ca 0.09 0.12 0.07 0.00 0.84 0.00 0.00 57.88 59.00 2dlv h LEU 29 Cb 0.57 0.46 -0.10 0.00 0.37 0.00 0.00 40.66 41.96 2dlv h LEU 29 CO -0.37 -0.59 -0.55 -0.33 -0.34 0.00 0.00 178.44 176.26 2dlv h GLU 30 N -0.86 -0.18 -0.67 1.25 4.39 -0.50 0.15 114.58 118.17 2dlv h GLU 30 Ca -0.03 0.01 0.13 0.00 0.34 0.00 0.00 59.36 59.81 2dlv h GLU 30 Cb 0.79 0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 29.38 2dlv h GLU 30 CO -0.14 -0.12 0.17 0.00 -1.16 0.00 0.00 179.01 177.76 2dlv h ALA 31 N 0.18 0.84 -0.43 3.43 0.00 -1.10 -0.87 119.26 121.30 2dlv h ALA 31 Ca 0.11 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.23 2dlv h ALA 31 Cb 0.48 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 2dlv h ALA 31 CO -0.74 -0.30 0.12 0.35 0.00 0.00 0.00 179.25 178.67 2dlv h PHE 32 N 0.29 0.20 -0.30 0.00 3.57 0.52 -2.35 116.94 118.87 2dlv h PHE 32 Ca 0.36 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.90 2dlv h PHE 32 Cb 0.57 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2dlv h PHE 32 CO -0.24 0.05 0.18 1.15 -2.23 0.00 0.00 178.31 177.21 2dlv h THR 33 N 0.26 1.04 -0.73 4.41 2.02 0.30 -2.80 112.91 117.41 2dlv h THR 33 Ca 0.21 -0.12 0.15 0.00 0.77 0.00 0.00 66.41 67.41 2dlv h THR 33 Cb 0.24 0.64 -0.14 0.00 -1.74 0.00 0.00 68.15 67.15 2dlv h THR 33 CO -0.25 0.07 -0.20 0.03 0.37 0.00 0.00 175.52 175.54 2dlv h ARG 34 N 0.36 -0.01 -0.73 6.66 3.08 -0.75 0.30 114.38 123.30 2dlv h ARG 34 Ca 0.12 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.30 2dlv h ARG 34 Cb -0.01 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 29.95 2dlv h ARG 34 CO -0.05 -0.01 0.28 0.35 -1.07 0.00 0.00 179.97 179.48 2dlv h PHE 35 N -0.01 0.49 -0.28 3.04 3.57 -1.30 -1.39 116.94 121.05 2dlv h PHE 35 Ca 0.35 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.78 2dlv h PHE 35 Cb 0.54 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2dlv h PHE 35 CO -0.60 0.07 -0.22 -0.07 -2.23 0.00 0.00 178.31 175.26 2dlv h LEU 36 N 0.44 0.68 -0.74 0.59 3.38 -0.53 -3.14 115.31 115.99 2dlv h LEU 36 Ca 0.39 -0.45 0.16 0.00 0.09 0.00 0.00 57.88 58.08 2dlv h LEU 36 Cb 0.58 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.02 2dlv h LEU 36 CO -0.39 0.99 0.15 0.11 0.09 0.00 0.00 178.44 179.39 2dlv h LYS 37 N 0.39 0.22 -0.44 1.13 1.57 0.39 0.34 116.57 120.17 2dlv h LYS 37 Ca 0.05 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2dlv h LYS 37 Cb 0.77 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 2dlv h LYS 37 CO 0.06 0.15 0.18 1.79 -0.57 0.00 0.00 179.45 181.06 2dlv h THR 38 N 0.23 1.17 -0.47 -0.16 1.35 -1.37 -1.11 112.91 112.54 2dlv h THR 38 Ca 0.42 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 2dlv h THR 38 Cb 0.73 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2dlv h THR 38 CO -0.54 0.20 0.00 -0.62 -0.25 0.00 0.00 175.52 174.31 2dlv n GLU 39 N -4.37 2.75 -3.16 4.72 -0.58 0.90 -4.91 120.64 116.00 2dlv n GLU 39 Ca 0.03 -1.98 -0.22 0.00 -0.42 0.00 0.00 57.16 54.58 2dlv n GLU 39 Cb 0.15 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.39 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 0.80 -1.78 0.25 -0.32 3.72 0.39 -4.81 117.46 115.71 2dlv n PHE 40 Ca 0.18 0.42 0.04 0.00 -0.05 0.00 0.00 57.45 58.04 2dlv n PHE 40 Cb 0.61 -3.28 -0.06 0.00 -0.94 0.00 0.00 39.48 35.81 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 -2.28 1.40 -0.53 4.37 7.64 0.27 -4.60 113.62 119.89 2dlv n SER 41 Ca -0.05 -0.43 0.43 0.00 1.01 0.00 0.00 58.87 59.83 2dlv n SER 41 Cb 0.57 1.17 0.72 0.00 -1.01 0.00 0.00 64.21 65.66 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 0.02 -1.10 1.43 9.09 -1.81 0.26 114.58 122.47 2dlv h GLU 42 Ca 0.00 -0.00 0.44 0.00 0.05 0.00 0.00 59.36 59.85 2dlv h GLU 42 Cb 0.30 -0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 27.22 2dlv h GLU 42 CO 0.00 0.01 0.63 -0.85 0.05 0.00 0.00 179.01 178.85 2dlv n GLU 43 N -4.50 -0.05 0.40 1.06 0.28 -1.26 0.02 120.64 116.58 2dlv n GLU 43 Ca 0.41 1.35 -0.18 0.00 -0.16 0.00 0.00 57.16 58.57 2dlv n GLU 43 Cb 1.67 -2.48 -0.09 0.00 1.43 0.00 0.00 31.44 31.96 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 -0.83 -0.10 -1.84 4.21 -0.76 -2.69 115.58 113.57 2dlv h ASN 44 Ca 0.86 0.03 -0.02 0.00 1.21 0.00 0.00 56.30 58.38 2dlv h ASN 44 Cb 2.41 0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 39.82 2dlv h ASN 44 CO -0.69 -0.59 0.01 -0.29 -1.29 0.00 0.00 177.43 174.58 2dlv h ILE 45 N -0.98 1.11 -0.84 2.81 6.09 -0.58 -2.41 117.51 122.70 2dlv h ILE 45 Ca -0.10 -0.39 0.09 0.00 -1.37 0.00 0.00 64.86 63.09 2dlv h ILE 45 Cb 0.75 0.96 -0.07 0.00 0.47 0.00 0.00 36.82 38.93 2dlv h ILE 45 CO 0.16 0.13 0.49 -0.33 -3.07 0.00 0.00 178.15 175.54 2dlv h GLU 46 N 0.24 0.81 -0.16 2.19 4.39 -0.54 -1.69 114.58 119.82 2dlv h GLU 46 Ca 0.06 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.64 2dlv h GLU 46 Cb 0.15 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2dlv h GLU 46 CO 0.00 0.53 -0.18 0.35 -1.16 0.00 0.00 179.01 178.56 2dlv h PHE 47 N 0.83 0.49 -1.00 4.33 3.57 -1.17 -2.82 116.94 121.17 2dlv h PHE 47 Ca 0.40 -0.15 0.17 0.00 3.53 0.00 0.00 57.97 61.92 2dlv h PHE 47 Cb 0.35 -0.10 -0.10 0.00 2.79 0.00 0.00 35.95 38.89 2dlv h PHE 47 CO -0.05 0.80 0.62 2.35 -2.23 0.00 0.00 178.31 179.79 2dlv h TRP 48 N 0.05 1.07 0.23 0.41 7.01 -1.24 -2.62 115.95 120.85 2dlv h TRP 48 Ca 0.02 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 2dlv h TRP 48 Cb 0.72 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.45 2dlv h TRP 48 CO 0.08 0.30 -0.11 0.82 -2.79 0.00 0.00 178.44 176.75 2dlv h ILE 49 N 0.82 0.00 -1.56 2.65 2.04 -1.28 -3.07 117.51 117.12 2dlv h ILE 49 Ca 0.55 -0.12 0.46 0.00 1.00 0.00 0.00 64.86 66.75 2dlv h ILE 49 Cb 0.78 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.79 2dlv h ILE 49 CO -0.33 0.00 1.11 0.00 0.00 0.00 0.00 178.15 178.93 2dlv n ALA 50 N -2.24 1.50 0.09 1.87 0.00 -1.07 -0.35 120.51 120.30 2dlv n ALA 50 Ca -0.04 0.54 -0.04 0.00 0.00 0.00 0.00 53.44 53.91 2dlv n ALA 50 Cb 0.12 -0.91 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2dlv n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dlv h GLU 52 N -0.35 0.05 0.13 0.00 -0.00 -0.61 1.06 114.58 114.86 2dlv h GLU 52 Ca -0.02 -0.00 -0.31 0.00 -0.00 0.00 0.00 59.36 59.02 2dlv h GLU 52 Cb 0.18 -0.01 -0.00 0.00 -0.00 0.00 0.00 28.75 28.91 2dlv h GLU 52 CO 0.04 0.03 -1.53 0.22 -0.00 0.00 0.00 179.01 177.77 2dlv h ASP 53 N 0.05 0.43 -0.89 3.06 1.82 -1.42 -3.34 116.42 116.13 2dlv h ASP 53 Ca 0.81 -0.58 0.13 0.00 -0.39 0.00 0.00 57.03 57.00 2dlv h ASP 53 Cb 2.90 -0.14 -0.09 0.00 0.68 0.00 0.00 39.33 42.68 2dlv h ASP 53 CO -0.20 1.48 0.50 0.15 -1.61 0.00 0.00 179.24 179.56 2dlv h PHE 54 N 0.07 0.88 -0.07 0.28 3.57 0.53 0.14 116.94 122.34 2dlv h PHE 54 Ca -0.25 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.27 2dlv h PHE 54 Cb 2.03 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 40.50 2dlv h PHE 54 CO 0.07 0.27 -0.02 0.87 -2.23 0.00 0.00 178.31 177.28 2dlv h LYS 55 N 0.74 0.10 -0.44 1.11 1.57 -1.53 -0.43 116.57 117.70 2dlv h LYS 55 Ca 0.47 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 2dlv h LYS 55 Cb 0.58 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2dlv h LYS 55 CO -0.32 0.13 0.00 1.63 -0.57 0.00 0.00 179.45 180.32 2dlv n LYS 56 N -4.46 0.99 -1.64 3.15 5.02 0.47 -4.87 118.16 116.82 2dlv n LYS 56 Ca -0.02 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.95 2dlv n LYS 56 Cb 0.14 -1.22 0.05 0.00 -0.02 0.00 0.00 35.03 33.98 2dlv n LYS 56 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2dlv s SER 57 N -0.57 5.10 -0.14 4.39 0.01 -0.17 -5.05 113.70 117.27 2dlv s SER 57 Ca 0.00 1.86 0.02 0.00 1.31 0.00 0.00 55.95 59.14 2dlv s SER 57 Cb 0.00 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.71 2dlv s SER 57 CO 0.00 -1.63 -0.20 -0.75 0.41 0.00 0.00 173.24 171.07 2dlv s LYS 58 N -4.45 2.81 0.10 12.44 2.47 -1.26 -4.98 119.74 126.88 2dlv s LYS 58 Ca 0.63 -0.77 0.00 0.00 -1.56 0.00 0.00 55.97 54.27 2dlv s LYS 58 Cb -0.18 -2.34 0.00 0.00 -1.46 0.00 0.00 37.83 33.86 2dlv s LYS 58 CO 0.47 -0.08 0.00 0.41 0.16 0.00 0.00 175.35 176.31 2dlv n GLY 59 N 4.26 -2.00 0.23 5.54 0.00 -1.26 -3.86 105.19 108.10 2dlv n GLY 59 Ca -0.20 -1.42 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 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 -0.31 0.58 0.13 1.61 0.13 -1.99 -3.21 132.00 128.93 2dlv h PRO 60 Ca -0.02 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2dlv h PRO 60 Cb 0.30 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.42 2dlv h PRO 60 CO 0.01 0.89 -0.30 0.37 -0.23 0.00 0.00 178.00 178.74 2dlv h GLN 61 N 0.47 -0.46 -0.74 0.86 5.75 -1.99 0.16 115.11 119.16 2dlv h GLN 61 Ca 0.04 0.03 0.17 0.00 -0.15 0.00 0.00 58.65 58.74 2dlv h GLN 61 Cb 0.93 0.10 -0.12 0.00 1.07 0.00 0.00 27.48 29.47 2dlv h GLN 61 CO 0.08 -0.30 0.08 0.37 -2.65 0.00 0.00 178.83 176.41 2dlv h GLN 62 N -0.47 0.16 -0.55 1.69 5.75 -1.67 0.27 115.11 120.28 2dlv h GLN 62 Ca -0.01 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.50 2dlv h GLN 62 Cb 0.46 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.93 2dlv h GLN 62 CO -0.13 0.10 0.33 0.82 -2.65 0.00 0.00 178.83 177.30 2dlv h ILE 63 N 0.16 1.06 0.17 2.39 2.04 -1.44 0.08 117.51 121.98 2dlv h ILE 63 Ca 0.42 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 2dlv h ILE 63 Cb 0.73 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2dlv h ILE 63 CO -0.60 0.12 -0.08 0.45 0.00 0.00 0.00 178.15 178.04 2dlv h HIS 64 N 0.66 -0.21 0.32 1.37 3.86 0.17 0.15 115.15 121.47 2dlv h HIS 64 Ca 0.22 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.42 2dlv h HIS 64 Cb 0.02 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 2dlv h HIS 64 CO -0.06 0.08 -0.32 -0.07 0.86 0.00 0.00 177.93 178.42 2dlv h LEU 65 N -0.50 -0.89 -0.81 2.43 4.07 -0.44 0.82 115.31 119.99 2dlv h LEU 65 Ca -0.02 0.07 0.13 0.00 0.08 0.00 0.00 57.88 58.14 2dlv h LEU 65 Cb 0.39 0.29 -0.09 0.00 1.08 0.00 0.00 40.66 42.33 2dlv h LEU 65 CO 0.04 -0.42 0.41 0.11 -1.08 0.00 0.00 178.44 177.49 2dlv h LYS 66 N -0.64 0.60 0.45 1.13 1.57 -1.07 -1.19 116.57 117.42 2dlv h LYS 66 Ca -0.04 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2dlv h LYS 66 Cb 0.56 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 2dlv h LYS 66 CO -0.04 0.40 -0.37 0.00 -0.57 0.00 0.00 179.45 178.86 2dlv h ALA 67 N 1.52 -0.85 -0.34 3.86 0.00 -0.63 0.12 119.26 122.95 2dlv h ALA 67 Ca 0.43 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.26 2dlv h ALA 67 Cb 0.57 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 2dlv h ALA 67 CO -0.34 -1.01 -0.08 -0.22 0.00 0.00 0.00 179.25 177.60 2dlv h LYS 68 N -0.82 0.01 0.32 0.00 3.64 -0.32 0.36 116.57 119.76 2dlv h LYS 68 Ca -0.04 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2dlv h LYS 68 Cb 0.71 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.53 2dlv h LYS 68 CO -0.02 0.01 -0.20 0.00 -2.27 0.00 0.00 179.45 176.97 2dlv h ALA 69 N 1.34 -1.04 -1.00 5.00 0.00 -1.03 -0.79 119.26 121.73 2dlv h ALA 69 Ca 0.16 -0.10 0.22 0.00 0.00 0.00 0.00 54.91 55.19 2dlv h ALA 69 Cb 0.25 0.32 -0.10 0.00 0.00 0.00 0.00 17.79 18.25 2dlv h ALA 69 CO -0.35 -1.03 0.62 0.82 0.00 0.00 0.00 179.25 179.32 2dlv h ILE 70 N -0.48 0.63 0.56 0.00 2.04 -0.65 0.88 117.51 120.49 2dlv h ILE 70 Ca -0.04 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 2dlv h ILE 70 Cb 0.39 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2dlv h ILE 70 CO 0.04 0.11 -0.28 0.22 0.00 0.00 0.00 178.15 178.24 2dlv h TYR 71 N 0.60 -0.73 0.00 1.37 3.20 -0.03 0.19 116.97 121.56 2dlv h TYR 71 Ca 0.58 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.43 2dlv h TYR 71 Cb 1.13 0.25 0.00 0.00 1.54 0.00 0.00 36.73 39.65 2dlv h TYR 71 CO -0.00 -0.45 0.00 0.39 -1.64 0.00 0.00 178.16 176.46 2dlv n GLU 72 N -4.11 0.41 -0.01 1.82 1.02 -0.32 -0.38 120.64 119.06 2dlv n GLU 72 Ca -0.10 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.03 2dlv n GLU 72 Cb 0.31 -1.47 -0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2dlv n GLU 72 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2dlv n LYS 73 N -0.97 0.07 -0.07 3.49 4.81 0.26 -4.58 118.16 121.18 2dlv n LYS 73 Ca 0.09 0.11 -0.06 0.00 -0.87 0.00 0.00 58.31 57.57 2dlv n LYS 73 Cb 0.04 -0.70 -0.02 0.00 0.02 0.00 0.00 35.03 34.37 2dlv n LYS 73 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2dlv n PHE 74 N -2.71 0.14 -0.03 5.64 3.01 0.59 -2.55 117.46 121.55 2dlv n PHE 74 Ca -0.02 0.06 -0.01 0.00 1.01 0.00 0.00 57.45 58.50 2dlv n PHE 74 Cb 0.06 -0.44 -0.01 0.00 -0.01 0.00 0.00 39.48 39.08 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 -4.02 -0.05 -1.41 4.37 2.08 -1.01 -3.16 119.36 116.15 2dlv n ILE 75 Ca -0.10 0.96 -0.36 0.00 0.56 0.00 0.00 62.75 63.82 2dlv n ILE 75 Cb 0.36 -1.26 0.08 0.00 -0.75 0.00 0.00 39.64 38.07 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 -2.86 0.60 -0.02 0.38 10.64 0.49 -4.78 117.38 121.82 2dlv n GLN 76 Ca 0.00 0.26 -0.11 0.00 -1.83 0.00 0.00 57.00 55.32 2dlv n GLN 76 Cb 0.02 -2.26 -0.14 0.00 -0.86 0.00 0.00 30.24 27.00 2dlv n GLN 76 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 2dlv n THR 77 N -2.40 1.63 0.79 -0.39 -1.04 -1.26 -3.95 114.28 107.65 2dlv n THR 77 Ca 0.13 -0.77 0.00 0.00 -2.04 0.00 0.00 64.05 61.37 2dlv n THR 77 Cb 0.49 -1.13 0.00 0.00 -1.82 0.00 0.00 70.33 67.87 2dlv n THR 77 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2dlv n ASP 78 N -3.11 0.53 -4.86 8.00 2.03 -1.26 -4.74 116.55 113.13 2dlv n ASP 78 Ca -0.21 -1.32 -0.21 0.00 0.52 0.00 0.00 54.79 53.57 2dlv n ASP 78 Cb 1.06 -0.26 -0.04 0.00 -0.72 0.00 0.00 41.12 41.16 2dlv n ASP 78 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dlv s ALA 79 N -1.20 3.73 0.04 -1.67 0.00 -1.25 -5.05 121.76 116.36 2dlv s ALA 79 Ca 0.00 -1.45 -0.20 0.00 0.00 0.00 0.00 51.96 50.31 2dlv s ALA 79 Cb 0.00 -1.35 -0.14 0.00 0.00 0.00 0.00 23.12 21.63 2dlv s ALA 79 CO 0.00 0.18 1.35 -1.00 0.00 0.00 0.00 175.76 176.29 2dlv h PRO 80 N 1.36 0.37 -0.70 0.00 0.13 -1.86 -3.05 132.00 128.24 2dlv h PRO 80 Ca -0.48 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2dlv h PRO 80 Cb 1.24 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2dlv h PRO 80 CO 0.60 0.75 0.00 1.63 -0.23 0.00 0.00 178.00 180.75 2dlv n LYS 81 N -4.54 2.79 -1.65 0.86 4.76 -1.23 -4.94 118.16 114.20 2dlv n LYS 81 Ca -0.06 -1.57 -0.52 0.00 -2.87 0.00 0.00 58.31 53.29 2dlv n LYS 81 Cb 0.37 -1.78 -0.06 0.00 -1.84 0.00 0.00 35.03 31.72 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 0.38 1.64 -3.10 1.97 -0.00 -1.06 -4.29 120.64 116.19 2dlv n GLU 82 Ca 0.14 0.58 -0.18 0.00 -0.00 0.00 0.00 57.16 57.70 2dlv n GLU 82 Cb 0.66 -2.44 0.01 0.00 -0.00 0.00 0.00 31.44 29.66 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 4.53 2.85 -0.59 3.84 -7.23 -1.19 -4.95 120.40 117.66 2dlv s VAL 83 Ca 0.98 -1.05 -0.28 0.00 -1.81 0.00 0.00 61.98 59.82 2dlv s VAL 83 Cb -0.84 -2.90 0.02 0.00 0.56 0.00 0.00 36.38 33.21 2dlv s VAL 83 CO 0.56 0.00 1.38 0.21 -0.31 0.00 0.00 175.10 176.94 2dlv s ASN 84 N -4.35 6.15 0.22 4.85 2.47 -1.26 -4.89 114.94 118.12 2dlv s ASN 84 Ca 0.55 0.17 0.07 0.00 0.42 0.00 0.00 52.86 54.07 2dlv s ASN 84 Cb -0.09 -2.55 -0.05 0.00 -1.45 0.00 0.00 41.25 37.12 2dlv s ASN 84 CO 0.33 -1.71 -0.13 -0.76 -3.72 0.00 0.00 177.10 171.11 2dlv s LEU 85 N 5.96 2.53 0.37 3.21 1.43 -1.26 -4.76 118.68 126.16 2dlv s LEU 85 Ca 0.49 -1.05 -0.26 0.00 -1.03 0.00 0.00 54.13 52.28 2dlv s LEU 85 Cb -0.10 -0.65 -0.09 0.00 0.03 0.00 0.00 46.19 45.38 2dlv s LEU 85 CO 0.24 -0.21 1.11 -0.62 0.23 0.00 0.00 176.35 177.10 2dlv s ASP 86 N -3.34 6.81 0.16 2.29 2.15 -1.26 -4.90 116.67 118.58 2dlv s ASP 86 Ca 0.24 2.22 -0.27 0.00 0.43 0.00 0.00 52.55 55.16 2dlv s ASP 86 Cb 0.00 -2.61 -0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2dlv s ASP 86 CO 0.08 -0.46 1.57 0.15 -0.17 0.00 0.00 175.17 176.33 2dlv h PHE 87 N 2.91 -1.34 0.18 -5.34 3.57 -2.00 -0.74 116.94 114.19 2dlv h PHE 87 Ca -0.48 0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.10 2dlv h PHE 87 Cb 1.22 0.65 -0.03 0.00 2.79 0.00 0.00 35.95 40.58 2dlv h PHE 87 CO 0.57 -0.44 -0.41 1.25 -2.23 0.00 0.00 178.31 177.05 2dlv h HIS 88 N -0.29 -1.17 -0.99 0.41 2.76 -1.98 0.23 115.15 114.11 2dlv h HIS 88 Ca 0.15 0.03 0.36 0.00 -2.20 0.00 0.00 60.37 58.70 2dlv h HIS 88 Cb 0.58 0.49 -0.16 0.00 1.55 0.00 0.00 27.41 29.86 2dlv h HIS 88 CO -0.68 -0.48 0.51 1.15 -1.30 0.00 0.00 177.93 177.13 2dlv h THR 89 N -0.64 0.16 -0.12 6.26 2.02 -1.82 0.73 112.91 119.50 2dlv h THR 89 Ca -0.02 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 67.00 2dlv h THR 89 Cb 0.62 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 2dlv h THR 89 CO -0.18 0.03 -0.35 0.11 0.37 0.00 0.00 175.52 175.50 2dlv h LYS 90 N 0.16 0.45 0.53 6.66 1.57 -0.15 -2.98 116.57 122.81 2dlv h LYS 90 Ca 0.77 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 59.20 2dlv h LYS 90 Cb 1.87 0.05 0.01 0.00 0.08 0.00 0.00 32.23 34.24 2dlv h LYS 90 CO -0.69 0.94 -0.26 1.49 -0.57 0.00 0.00 179.45 180.36 2dlv h GLU 91 N 0.03 -0.69 -0.97 3.15 4.81 0.32 -1.72 114.58 119.51 2dlv h GLU 91 Ca -0.01 0.05 0.25 0.00 -0.13 0.00 0.00 59.36 59.52 2dlv h GLU 91 Cb 0.97 0.16 -0.18 0.00 0.63 0.00 0.00 28.75 30.33 2dlv h GLU 91 CO 0.08 -0.46 -0.02 -0.24 -0.73 0.00 0.00 179.01 177.64 2dlv h VAL 92 N -0.98 0.04 -0.43 0.32 3.04 0.06 0.60 116.25 118.89 2dlv h VAL 92 Ca -0.07 -0.01 -0.05 0.00 -1.01 0.00 0.00 66.70 65.56 2dlv h VAL 92 Cb 0.55 0.03 -0.02 0.00 -2.01 0.00 0.00 31.29 29.84 2dlv h VAL 92 CO 0.12 0.00 0.08 0.40 -1.01 0.00 0.00 177.57 177.16 2dlv h ILE 93 N 0.02 1.24 -0.88 3.17 2.04 -1.54 0.63 117.51 122.18 2dlv h ILE 93 Ca 0.57 -0.87 0.12 0.00 1.00 0.00 0.00 64.86 65.68 2dlv h ILE 93 Cb 1.11 0.97 -0.08 0.00 -0.74 0.00 0.00 36.82 38.08 2dlv h ILE 93 CO -0.92 0.30 0.51 0.74 0.00 0.00 0.00 178.15 178.78 2dlv h THR 94 N 0.57 0.85 0.07 -0.27 2.02 0.11 1.03 112.91 117.30 2dlv h THR 94 Ca 0.13 -0.27 -0.29 0.00 0.77 0.00 0.00 66.41 66.75 2dlv h THR 94 Cb 0.36 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2dlv h THR 94 CO 0.01 0.14 -1.53 0.78 0.37 0.00 0.00 175.52 175.29 2dlv h ASN 95 N 0.79 0.24 -0.37 4.18 2.35 -1.05 -3.30 115.58 118.42 2dlv h ASN 95 Ca 0.45 -0.36 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2dlv h ASN 95 Cb 0.50 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.79 2dlv h ASN 95 CO -0.29 1.31 0.00 -0.24 -1.65 0.00 0.00 177.43 176.56 2dlv n SER 96 N -3.34 3.45 0.08 5.81 2.88 0.22 -4.20 113.62 118.52 2dlv n SER 96 Ca -0.15 -2.41 0.09 0.00 -1.33 0.00 0.00 58.87 55.07 2dlv n SER 96 Cb 1.03 -0.53 0.39 0.00 -0.75 0.00 0.00 64.21 64.35 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 0.49 1.08 0.31 2.46 0.13 0.35 -1.76 119.36 122.42 2dlv n ILE 97 Ca 0.16 0.36 0.08 0.00 -1.10 0.00 0.00 62.75 62.26 2dlv n ILE 97 Cb 0.70 -1.26 -0.12 0.00 -0.84 0.00 0.00 39.64 38.12 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 -1.93 0.00 -1.58 9.51 5.66 -1.26 -4.42 114.28 120.26 2dlv n THR 98 Ca 0.02 -0.28 0.02 0.00 -3.05 0.00 0.00 64.05 60.76 2dlv n THR 98 Cb 0.15 0.47 0.20 0.00 -1.55 0.00 0.00 70.33 69.59 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 -1.81 1.73 -2.27 1.09 6.02 -0.73 -5.06 117.38 116.36 2dlv n GLN 99 Ca -0.01 -3.31 -0.36 0.00 -0.01 0.00 0.00 57.00 53.31 2dlv n GLN 99 Cb 0.37 -1.70 -0.00 0.00 1.02 0.00 0.00 30.24 29.92 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 -3.26 3.50 0.36 -1.09 0.04 -0.72 -5.03 135.00 128.80 2dlv s PRO 100 Ca 0.40 1.66 0.05 0.00 0.04 0.00 0.00 61.00 63.15 2dlv s PRO 100 Cb 0.38 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2dlv s PRO 100 CO -0.05 -0.74 0.18 0.95 0.04 0.00 0.00 177.00 177.38 2dlv s THR 101 N -1.70 0.36 0.31 1.26 -4.23 -1.26 -4.93 115.64 105.44 2dlv s THR 101 Ca 0.70 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.33 2dlv s THR 101 Cb -0.25 -2.42 0.04 0.00 1.34 0.00 0.00 72.50 71.21 2dlv s THR 101 CO 0.29 0.00 1.72 -0.07 -0.54 0.00 0.00 174.62 176.02 2dlv h LEU 102 N 1.98 0.00 -3.16 4.79 3.38 -1.96 -2.66 115.31 117.68 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 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2dlv h LEU 102 CO 0.49 0.49 0.00 1.41 0.09 0.00 0.00 178.44 180.92 2dlv n HIS 103 N -3.90 1.68 -0.05 1.13 8.25 -1.26 -4.37 115.22 116.70 2dlv n HIS 103 Ca -0.01 -0.62 -0.04 0.00 -0.26 0.00 0.00 57.72 56.79 2dlv n HIS 103 Cb 0.51 -0.36 -0.01 0.00 1.12 0.00 0.00 29.99 31.25 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 0.82 1.15 -0.31 0.41 2.88 -1.00 -4.45 113.62 113.11 2dlv n SER 104 Ca 0.25 0.39 0.14 0.00 -1.33 0.00 0.00 58.87 58.32 2dlv n SER 104 Cb 0.99 -0.70 0.38 0.00 -0.75 0.00 0.00 64.21 64.13 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 -0.62 0.89 -0.64 0.66 0.04 -1.78 -2.08 116.94 113.41 2dlv h PHE 105 Ca 0.00 0.03 0.23 0.00 2.80 0.00 0.00 57.97 61.03 2dlv h PHE 105 Cb 0.42 -0.27 -0.12 0.00 2.20 0.00 0.00 35.95 38.18 2dlv h PHE 105 CO -0.18 0.25 0.20 -3.47 -0.60 0.00 0.00 178.31 174.51 2dlv n ASP 106 N -4.64 0.10 0.22 2.17 2.03 -1.26 0.15 116.55 115.31 2dlv n ASP 106 Ca 0.21 1.07 -0.15 0.00 0.52 0.00 0.00 54.79 56.44 2dlv n ASP 106 Cb 0.57 -0.47 -0.07 0.00 -0.72 0.00 0.00 41.12 40.43 2dlv n ASP 106 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dlv h ALA 107 N 1.28 -0.60 -0.31 -1.67 0.00 -1.63 -2.30 119.26 114.03 2dlv h ALA 107 Ca 0.48 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.32 2dlv h ALA 107 Cb 1.17 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 19.26 2dlv h ALA 107 CO -0.54 -0.86 0.08 0.00 0.00 0.00 0.00 179.25 177.94 2dlv h ALA 108 N -0.02 0.34 -0.95 0.00 0.00 0.11 -2.01 119.26 116.73 2dlv h ALA 108 Ca -0.03 0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.14 2dlv h ALA 108 Cb 0.52 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.24 2dlv h ALA 108 CO 0.01 -0.32 0.52 0.37 0.00 0.00 0.00 179.25 179.82 2dlv h GLN 109 N 0.20 0.56 -0.58 0.00 4.15 -1.12 0.62 115.11 118.94 2dlv h GLN 109 Ca 0.14 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.52 2dlv h GLN 109 Cb 0.13 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 2dlv h GLN 109 CO -0.17 0.37 0.34 1.03 -1.93 0.00 0.00 178.83 178.47 2dlv h SER 110 N 0.58 0.71 0.22 -0.69 0.87 -0.79 0.30 113.55 114.75 2dlv h SER 110 Ca 0.58 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 61.07 2dlv h SER 110 Cb 1.01 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.76 2dlv h SER 110 CO -0.45 0.57 -0.35 -0.09 -0.53 0.00 0.00 176.83 175.98 2dlv h ARG 111 N 0.78 -0.62 0.22 2.24 9.65 -0.67 -2.27 114.38 123.71 2dlv h ARG 111 Ca 0.21 0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.12 2dlv h ARG 111 Cb 0.01 0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 2dlv h ARG 111 CO -0.04 -0.41 -0.11 0.28 2.80 0.00 0.00 179.97 182.49 2dlv h VAL 112 N -0.64 0.86 -0.96 0.20 2.07 -1.35 -2.34 116.25 114.08 2dlv h VAL 112 Ca 0.01 -0.56 0.39 0.00 0.82 0.00 0.00 66.70 67.36 2dlv h VAL 112 Cb 0.63 1.18 -0.17 0.00 -1.52 0.00 0.00 31.29 31.40 2dlv h VAL 112 CO -0.14 0.12 0.49 0.00 0.02 0.00 0.00 177.57 178.06 2dlv n TYR 113 N -5.09 1.09 -0.01 1.57 9.36 0.10 -0.21 117.16 123.98 2dlv n TYR 113 Ca -0.09 1.13 -0.10 0.00 3.32 0.00 0.00 57.90 62.16 2dlv n TYR 113 Cb 0.23 -1.52 -0.08 0.00 -0.63 0.00 0.00 39.34 37.34 2dlv n TYR 113 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 2dlv h GLN 114 N 0.00 -0.09 -0.89 2.98 1.08 -1.30 -2.77 115.11 114.12 2dlv h GLN 114 Ca 0.80 0.01 0.19 0.00 -1.45 0.00 0.00 58.65 58.20 2dlv h GLN 114 Cb 2.10 0.02 -0.17 0.00 -0.05 0.00 0.00 27.48 29.38 2dlv h GLN 114 CO -0.75 0.46 -0.17 1.28 -0.95 0.00 0.00 178.83 178.71 2dlv n LEU 115 N -4.80 -0.27 0.24 1.46 4.77 0.71 -0.23 117.00 118.88 2dlv n LEU 115 Ca -0.07 1.53 -0.10 0.00 -0.03 0.00 0.00 56.01 57.33 2dlv n LEU 115 Cb 0.29 -0.48 -0.05 0.00 -2.33 0.00 0.00 43.42 40.85 2dlv n LEU 115 CO 0.25 -1.49 0.28 0.24 -1.33 0.00 0.00 177.39 175.35 2dlv h MET 116 N 0.00 -0.63 -1.11 3.23 2.86 -1.48 -2.89 114.93 114.92 2dlv h MET 116 Ca 0.45 0.04 0.32 0.00 -2.06 0.00 0.00 59.70 58.46 2dlv h MET 116 Cb 0.76 0.14 -0.04 0.00 0.06 0.00 0.00 31.60 32.52 2dlv h MET 116 CO -0.90 -0.42 1.07 1.49 1.06 0.00 0.00 176.91 179.22 2dlv h GLU 117 N -1.08 0.00 0.08 1.72 4.22 -0.83 0.21 114.58 118.89 2dlv h GLU 117 Ca -0.07 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.37 2dlv h GLU 117 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2dlv h GLU 117 CO 0.11 0.00 -0.04 1.96 -2.18 0.00 0.00 179.01 178.86 2dlv h GLN 118 N 0.00 -0.10 0.00 1.92 1.08 -0.52 -3.39 115.11 114.11 2dlv h GLN 118 Ca 0.53 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.73 2dlv h GLN 118 Cb 2.67 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 30.12 2dlv h GLN 118 CO -0.01 -0.06 -0.36 -0.25 -0.95 0.00 0.00 178.83 177.20 2dlv n ASP 119 N -2.77 0.76 -0.23 1.46 8.00 -0.45 -4.07 116.55 119.25 2dlv n ASP 119 Ca -0.01 0.18 -0.06 0.00 0.71 0.00 0.00 54.79 55.61 2dlv n ASP 119 Cb 0.04 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 40.48 2dlv n ASP 119 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2dlv n SER 120 N -3.26 -0.58 0.06 -2.24 7.64 0.22 0.26 113.62 115.72 2dlv n SER 120 Ca -0.05 1.03 -0.07 0.00 1.01 0.00 0.00 58.87 60.78 2dlv n SER 120 Cb 0.18 -0.15 -0.04 0.00 -1.01 0.00 0.00 64.21 63.19 2dlv n SER 120 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2dlv h TYR 121 N 0.00 -0.64 -0.43 1.43 3.20 -0.92 0.49 116.97 120.09 2dlv h TYR 121 Ca 0.09 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.04 2dlv h TYR 121 Cb 0.22 0.27 -0.09 0.00 1.54 0.00 0.00 36.73 38.68 2dlv h TYR 121 CO -0.61 -0.26 -0.49 1.79 -1.64 0.00 0.00 178.16 176.96 2dlv h THR 122 N -0.33 0.06 -0.96 1.81 1.35 -1.03 0.12 112.91 113.92 2dlv h THR 122 Ca -0.01 0.00 0.13 0.00 -0.55 0.00 0.00 66.41 65.98 2dlv h THR 122 Cb 0.33 0.06 -0.09 0.00 -1.73 0.00 0.00 68.15 66.72 2dlv h THR 122 CO -0.11 0.00 0.58 -0.09 -0.25 0.00 0.00 175.52 175.65 2dlv h ARG 123 N -0.35 0.87 -0.90 4.72 9.65 -0.02 -0.71 114.38 127.64 2dlv h ARG 123 Ca 0.12 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 2dlv h ARG 123 Cb 0.59 -0.20 -0.04 0.00 -1.39 0.00 0.00 29.97 28.93 2dlv h ARG 123 CO -0.60 0.57 0.51 0.35 2.80 0.00 0.00 179.97 183.60 2dlv h PHE 124 N 0.89 1.22 -0.85 2.20 3.57 0.24 -2.18 116.94 122.04 2dlv h PHE 124 Ca 0.49 -0.02 0.15 0.00 3.53 0.00 0.00 57.97 62.11 2dlv h PHE 124 Cb 0.54 -0.39 -0.06 0.00 2.79 0.00 0.00 35.95 38.82 2dlv h PHE 124 CO -0.02 0.84 0.55 -0.07 -2.23 0.00 0.00 178.31 177.38 2dlv h LEU 125 N 1.26 0.57 -2.82 0.59 3.38 0.64 0.37 115.31 119.30 2dlv h LEU 125 Ca 0.32 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2dlv h LEU 125 Cb 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2dlv h LEU 125 CO -0.05 0.29 0.00 2.29 0.09 0.00 0.00 178.44 181.05 2dlv n LYS 126 N -4.53 3.70 -3.41 1.13 2.85 -0.84 -4.45 118.16 112.61 2dlv n LYS 126 Ca 0.16 -2.38 -0.36 0.00 -1.05 0.00 0.00 58.31 54.68 2dlv n LYS 126 Cb 0.49 -1.97 -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 -0.69 6.80 0.16 -5.58 1.04 0.13 -4.96 113.70 110.60 2dlv s SER 127 Ca 0.42 1.02 -0.21 0.00 0.48 0.00 0.00 55.95 57.65 2dlv s SER 127 Cb 0.30 -2.27 0.06 0.00 0.10 0.00 0.00 66.02 64.21 2dlv s SER 127 CO 0.15 0.15 1.63 -0.78 0.98 0.00 0.00 173.24 175.37 2dlv h ASP 128 N 3.78 -0.78 -0.85 7.02 3.58 -1.92 -1.16 116.42 126.10 2dlv h ASP 128 Ca -0.49 0.15 0.20 0.00 0.42 0.00 0.00 57.03 57.31 2dlv h ASP 128 Cb 1.20 0.38 -0.15 0.00 1.72 0.00 0.00 39.33 42.47 2dlv h ASP 128 CO 0.65 -0.27 -0.06 0.40 -2.88 0.00 0.00 179.24 177.09 2dlv h ILE 129 N -0.21 0.20 0.24 2.25 2.04 -1.94 -1.13 117.51 118.96 2dlv h ILE 129 Ca 0.16 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 2dlv h ILE 129 Cb 0.46 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2dlv h ILE 129 CO -0.44 0.01 -0.11 0.22 0.00 0.00 0.00 178.15 177.83 2dlv h TYR 130 N 0.05 -0.30 -0.63 1.37 3.20 -1.49 -3.30 116.97 115.88 2dlv h TYR 130 Ca 0.46 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.38 2dlv h TYR 130 Cb 0.81 0.10 -0.08 0.00 1.54 0.00 0.00 36.73 39.11 2dlv h TYR 130 CO -0.52 -0.19 -0.37 1.28 -1.64 0.00 0.00 178.16 176.72 2dlv n LEU 131 N -3.16 -0.67 -0.26 2.82 4.77 -0.55 0.12 117.00 120.08 2dlv n LEU 131 Ca -0.04 1.18 0.10 0.00 -0.03 0.00 0.00 56.01 57.23 2dlv n LEU 131 Cb 0.13 -0.18 0.21 0.00 -2.33 0.00 0.00 43.42 41.25 2dlv n LEU 131 CO 0.10 -0.94 0.59 -0.67 -1.33 0.00 0.00 177.39 175.13 2dlv n ASP 132 N -4.67 -0.11 -0.34 -1.43 2.03 -0.47 0.84 116.55 112.40 2dlv n ASP 132 Ca 0.01 1.28 0.09 0.00 0.52 0.00 0.00 54.79 56.69 2dlv n ASP 132 Cb 0.16 -0.46 0.18 0.00 -0.72 0.00 0.00 41.12 40.29 2dlv n ASP 132 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2dlv n LEU 133 N -5.07 -0.27 -0.06 -2.67 4.77 0.34 -1.53 117.00 112.51 2dlv n LEU 133 Ca 0.17 1.65 -0.18 0.00 -0.03 0.00 0.00 56.01 57.62 2dlv n LEU 133 Cb 0.56 -0.53 -0.13 0.00 -2.33 0.00 0.00 43.42 40.98 2dlv n LEU 133 CO -0.06 -1.61 -1.02 1.15 -1.33 0.00 0.00 177.39 174.51 2dlv n MET 134 N -5.52 0.70 -3.88 3.23 0.00 0.25 -3.90 117.12 107.99 2dlv n MET 134 Ca 0.18 0.20 -0.30 0.00 0.00 0.00 0.00 57.70 57.77 2dlv n MET 134 Cb 0.57 -1.63 0.01 0.00 0.00 0.00 0.00 33.22 32.17 2dlv n MET 134 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2dlv n SER 135 N -3.30 -4.52 -3.30 3.17 7.64 0.98 -4.82 113.62 109.47 2dlv n SER 135 Ca -0.36 -0.76 -0.32 0.00 1.01 0.00 0.00 58.87 58.44 2dlv n SER 135 Cb 1.03 -3.63 -0.00 0.00 -1.01 0.00 0.00 64.21 60.60 2dlv n SER 135 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dlv n GLY 136 N -1.58 -2.14 0.00 0.23 0.00 -1.26 -4.71 105.19 95.73 2dlv n GLY 136 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2dlv n GLY 136 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dlv n PRO 137 N 1.04 0.49 -3.71 1.61 -0.04 -1.26 -4.57 135.00 128.57 2dlv n PRO 137 Ca 0.08 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.43 2dlv n PRO 137 Cb 0.31 -1.14 -0.12 0.00 -0.04 0.00 0.00 33.50 32.52 2dlv n PRO 137 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dlv s SER 138 N -1.65 -0.32 0.62 3.54 0.15 -1.26 -5.17 113.70 109.62 2dlv s SER 138 Ca 0.06 0.71 0.04 0.00 0.70 0.00 0.00 55.95 57.46 2dlv s SER 138 Cb 0.03 0.63 0.09 0.00 -1.71 0.00 0.00 66.02 65.06 2dlv s SER 138 CO 0.05 -0.19 0.86 -0.55 1.20 0.00 0.00 173.24 174.61 2dlv s SER 139 N 1.48 4.85 0.00 5.45 0.15 -1.26 -5.11 113.70 119.26 2dlv s SER 139 Ca -0.08 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2dlv s SER 139 Cb -0.10 -0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 2dlv s SER 139 CO -0.11 -1.49 0.00 0.61 1.20 0.00 0.00 173.24 173.45