#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 0.23 -2.79 1.61 4.64 -2.11 -3.46 113.55 111.66 2dlv h SER 2 Ca 0.00 -0.94 -0.50 0.00 -0.47 0.00 0.00 61.79 59.88 2dlv h SER 2 Cb 0.00 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.01 2dlv h SER 2 CO 0.00 1.25 -0.26 -0.44 -0.87 0.00 0.00 176.83 176.51 2dlv s SER 3 N -6.64 6.34 0.26 4.97 0.01 -1.26 -5.11 113.70 112.27 2dlv s SER 3 Ca -0.17 0.42 0.09 0.00 1.31 0.00 0.00 55.95 57.60 2dlv s SER 3 Cb -0.00 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.17 2dlv s SER 3 CO 0.75 -0.18 -0.00 -0.83 0.41 0.00 0.00 173.24 173.39 2dlv s GLY 4 N -3.65 1.65 -0.11 3.44 0.00 -1.26 -5.03 107.32 102.35 2dlv s GLY 4 Ca 0.39 -1.63 0.14 0.00 0.00 0.00 0.00 44.72 43.62 2dlv s GLY 4 CO 0.32 -1.69 1.33 -1.26 0.00 0.00 0.00 173.10 171.80 2dlv n SER 5 N -0.86 3.40 -4.12 1.64 2.88 -1.26 -4.97 113.62 110.34 2dlv n SER 5 Ca -0.07 -2.67 -0.26 0.00 -1.33 0.00 0.00 58.87 54.54 2dlv n SER 5 Cb 0.59 -0.42 -0.16 0.00 -0.75 0.00 0.00 64.21 63.47 2dlv n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dlv s SER 6 N -1.68 2.16 0.00 -3.46 0.01 -1.26 -5.04 113.70 104.42 2dlv s SER 6 Ca 0.34 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.24 2dlv s SER 6 Cb 0.26 -0.69 0.00 0.00 0.21 0.00 0.00 66.02 65.80 2dlv s SER 6 CO 0.10 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.50 2dlv n GLY 7 N 3.27 2.28 3.41 3.44 0.00 -1.26 -5.16 105.19 111.17 2dlv n GLY 7 Ca -0.19 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.24 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 0.00 3.59 0.28 1.61 0.15 -1.26 -5.03 113.70 113.05 2dlv s SER 8 Ca 0.00 -0.40 0.06 0.00 0.70 0.00 0.00 55.95 56.31 2dlv s SER 8 Cb 0.00 -0.56 0.41 0.00 -1.71 0.00 0.00 66.02 64.16 2dlv s SER 8 CO 0.00 0.29 1.67 1.55 1.20 0.00 0.00 173.24 177.95 2dlv h PRO 9 N 4.99 0.23 -1.40 5.44 0.13 -1.94 -3.10 132.00 136.34 2dlv h PRO 9 Ca -0.46 -0.12 0.41 0.00 -0.87 0.00 0.00 66.00 64.96 2dlv h PRO 9 Cb 1.14 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.20 2dlv h PRO 9 CO 0.48 0.65 0.98 1.49 -0.23 0.00 0.00 178.00 181.36 2dlv h GLU 10 N 0.19 0.06 0.22 0.86 4.81 -1.95 0.51 114.58 119.28 2dlv h GLU 10 Ca 0.01 -0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 58.89 2dlv h GLU 10 Cb 0.89 -0.01 0.02 0.00 0.63 0.00 0.00 28.75 30.28 2dlv h GLU 10 CO 0.07 0.04 -1.63 0.93 -0.73 0.00 0.00 179.01 177.69 2dlv h GLU 11 N 0.06 0.47 -0.07 1.92 4.39 -1.98 -3.36 114.58 116.01 2dlv h GLU 11 Ca 0.71 -0.80 0.04 0.00 0.34 0.00 0.00 59.36 59.65 2dlv h GLU 11 Cb 2.62 0.30 -0.06 0.00 -0.10 0.00 0.00 28.75 31.51 2dlv h GLU 11 CO -0.11 1.38 -0.33 0.00 -1.16 0.00 0.00 179.01 178.79 2dlv h ALA 12 N 0.14 -0.43 -1.16 3.43 0.00 -0.08 0.21 119.26 121.37 2dlv h ALA 12 Ca -0.30 0.00 0.34 0.00 0.00 0.00 0.00 54.91 54.94 2dlv h ALA 12 Cb 2.14 0.60 -0.11 0.00 0.00 0.00 0.00 17.79 20.42 2dlv h ALA 12 CO 0.23 -0.82 0.75 -0.24 0.00 0.00 0.00 179.25 179.16 2dlv h VAL 13 N -0.44 0.36 0.14 0.00 3.04 -1.55 0.12 116.25 117.93 2dlv h VAL 13 Ca 0.08 -0.09 -0.19 0.00 -1.01 0.00 0.00 66.70 65.49 2dlv h VAL 13 Cb 0.56 0.08 0.02 0.00 -2.01 0.00 0.00 31.29 29.94 2dlv h VAL 13 CO -0.32 0.05 -0.85 0.11 -1.01 0.00 0.00 177.57 175.55 2dlv h LYS 14 N 0.25 0.32 -1.35 4.17 1.57 -1.26 -3.29 116.57 116.99 2dlv h LYS 14 Ca 0.68 -0.54 0.40 0.00 -1.87 0.00 0.00 60.65 59.32 2dlv h LYS 14 Cb 1.96 0.20 -0.08 0.00 0.08 0.00 0.00 32.23 34.39 2dlv h LYS 14 CO -0.34 1.25 0.94 -1.49 -0.57 0.00 0.00 179.45 179.25 2dlv h TRP 15 N -0.33 0.22 0.00 -1.35 4.06 0.21 1.17 115.95 119.93 2dlv h TRP 15 Ca -0.15 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.81 2dlv h TRP 15 Cb 1.67 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 29.77 2dlv h TRP 15 CO 0.19 -0.03 0.00 0.41 -3.56 0.00 0.00 178.44 175.45 2dlv n GLY 16 N -1.70 0.33 0.11 1.49 0.00 -0.97 -3.53 105.19 100.91 2dlv n GLY 16 Ca 0.32 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.18 0.55 -3.52 1.61 1.02 0.40 -5.06 120.64 115.47 2dlv n GLU 17 Ca 0.00 0.39 -0.15 0.00 -0.02 0.00 0.00 57.16 57.38 2dlv n GLU 17 Cb 0.12 -1.59 -0.05 0.00 -0.02 0.00 0.00 31.44 29.90 2dlv n GLU 17 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2dlv s SER 18 N -6.79 -0.54 0.23 1.62 1.04 -1.23 -5.05 113.70 102.98 2dlv s SER 18 Ca -0.31 0.32 -0.07 0.00 0.48 0.00 0.00 55.95 56.38 2dlv s SER 18 Cb 0.08 0.53 0.31 0.00 0.10 0.00 0.00 66.02 67.05 2dlv s SER 18 CO 0.47 -0.74 1.83 0.15 0.98 0.00 0.00 173.24 175.94 2dlv h PHE 19 N 2.69 0.87 -0.08 5.02 3.57 -1.97 -2.84 116.94 124.20 2dlv h PHE 19 Ca -0.30 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.25 2dlv h PHE 19 Cb 1.21 -0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.61 2dlv h PHE 19 CO 0.34 0.42 -0.53 0.38 -2.23 0.00 0.00 178.31 176.69 2dlv h ASP 20 N 0.86 -1.66 -1.00 0.41 2.03 -1.96 -0.81 116.42 114.29 2dlv h ASP 20 Ca 0.35 0.19 0.34 0.00 -0.73 0.00 0.00 57.03 57.18 2dlv h ASP 20 Cb 0.20 0.64 -0.18 0.00 -0.83 0.00 0.00 39.33 39.16 2dlv h ASP 20 CO -0.18 -0.50 0.25 0.11 -1.03 0.00 0.00 179.24 177.89 2dlv h LYS 21 N -0.61 0.01 -0.21 4.15 1.57 -1.87 0.79 116.57 120.40 2dlv h LYS 21 Ca 0.03 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2dlv h LYS 21 Cb 0.70 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2dlv h LYS 21 CO -0.40 0.01 0.12 1.25 -0.57 0.00 0.00 179.45 179.86 2dlv h LEU 22 N 0.01 0.25 -0.95 2.94 5.85 -1.17 -1.12 115.31 121.12 2dlv h LEU 22 Ca 0.71 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 59.28 2dlv h LEU 22 Cb 1.67 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.62 2dlv h LEU 22 CO -0.86 0.24 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.14 2dlv h LEU 23 N 0.25 0.45 -0.59 2.25 3.38 0.83 -1.25 115.31 120.63 2dlv h LEU 23 Ca 0.07 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 2dlv h LEU 23 Cb 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2dlv h LEU 23 CO -0.01 0.71 0.13 0.28 0.09 0.00 0.00 178.44 179.64 2dlv h SER 24 N 0.39 0.90 -3.54 -0.43 0.02 0.03 -3.41 113.55 107.52 2dlv h SER 24 Ca 0.06 -0.24 -0.62 0.00 -0.84 0.00 0.00 61.79 60.14 2dlv h SER 24 Cb 0.68 -0.24 -0.12 0.00 0.14 0.00 0.00 62.40 62.85 2dlv h SER 24 CO 0.05 0.91 0.23 -2.28 -1.14 0.00 0.00 176.83 174.60 2dlv s HIS 25 N -5.28 3.15 0.07 3.45 5.65 -0.46 -4.97 115.29 116.91 2dlv s HIS 25 Ca -0.12 0.47 -0.15 0.00 0.25 0.00 0.00 55.06 55.50 2dlv s HIS 25 Cb 0.13 -3.21 -0.04 0.00 -1.18 0.00 0.00 32.58 28.28 2dlv s HIS 25 CO 0.82 -0.64 1.26 -0.09 -0.65 0.00 0.00 174.74 175.45 2dlv h ARG 26 N 8.41 -0.05 -0.94 2.88 2.43 -1.79 0.21 114.38 125.52 2dlv h ARG 26 Ca -0.26 0.00 0.25 0.00 -0.81 0.00 0.00 59.98 59.16 2dlv h ARG 26 Cb 1.11 0.01 -0.17 0.00 -0.42 0.00 0.00 29.97 30.49 2dlv h ARG 26 CO 0.86 -0.03 0.02 -0.44 -1.51 0.00 0.00 179.97 178.86 2dlv h ASP 27 N -0.05 -0.46 -0.59 -3.80 5.19 -1.93 0.54 116.42 115.31 2dlv h ASP 27 Ca 0.07 0.26 -0.01 0.00 -0.62 0.00 0.00 57.03 56.73 2dlv h ASP 27 Cb 0.22 0.46 -0.03 0.00 0.18 0.00 0.00 39.33 40.17 2dlv h ASP 27 CO -0.41 -0.31 0.32 1.23 -3.12 0.00 0.00 179.24 176.94 2dlv h GLY 28 N 0.04 0.89 0.79 2.75 0.00 -0.84 -0.80 103.07 105.90 2dlv h GLY 28 Ca 0.56 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 2dlv h GLY 28 CO -0.87 0.39 0.01 -2.00 0.00 0.00 0.00 176.54 174.07 2dlv h LEU 29 N 0.80 0.26 0.70 3.11 5.85 0.18 -2.22 115.31 123.99 2dlv h LEU 29 Ca 0.21 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 2dlv h LEU 29 Cb 0.06 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 2dlv h LEU 29 CO -0.03 0.49 -0.43 -0.33 -0.34 0.00 0.00 178.44 177.80 2dlv h GLU 30 N 0.01 -1.03 -0.88 1.25 5.08 -0.56 -2.36 114.58 116.09 2dlv h GLU 30 Ca 0.04 0.07 0.20 0.00 -1.00 0.00 0.00 59.36 58.67 2dlv h GLU 30 Cb 0.36 0.23 -0.11 0.00 0.50 0.00 0.00 28.75 29.73 2dlv h GLU 30 CO 0.01 -0.68 0.42 0.00 -1.00 0.00 0.00 179.01 177.75 2dlv h ALA 31 N -0.87 1.40 0.11 3.43 0.00 -1.20 -1.32 119.26 120.81 2dlv h ALA 31 Ca -0.09 0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2dlv h ALA 31 Cb 0.86 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 2dlv h ALA 31 CO 0.09 -0.25 -0.26 0.35 0.00 0.00 0.00 179.25 179.18 2dlv h PHE 32 N 0.48 -0.69 -0.56 0.00 3.57 -1.07 -2.63 116.94 116.04 2dlv h PHE 32 Ca 0.53 0.01 0.11 0.00 3.53 0.00 0.00 57.97 62.16 2dlv h PHE 32 Cb 0.93 0.29 -0.11 0.00 2.79 0.00 0.00 35.95 39.85 2dlv h PHE 32 CO -0.12 -0.36 -0.15 1.15 -2.23 0.00 0.00 178.31 176.60 2dlv h THR 33 N -0.46 0.42 -0.58 4.41 2.02 -0.73 -2.29 112.91 115.70 2dlv h THR 33 Ca 0.03 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.27 2dlv h THR 33 Cb 0.49 0.42 -0.08 0.00 -1.74 0.00 0.00 68.15 67.24 2dlv h THR 33 CO -0.15 0.00 -0.44 0.03 0.37 0.00 0.00 175.52 175.32 2dlv h ARG 34 N -0.01 -0.12 -1.13 6.66 3.08 -1.14 0.63 114.38 122.35 2dlv h ARG 34 Ca 0.27 0.01 0.34 0.00 0.07 0.00 0.00 59.98 60.67 2dlv h ARG 34 Cb 0.42 0.03 -0.12 0.00 0.08 0.00 0.00 29.97 30.38 2dlv h ARG 34 CO -0.58 -0.08 0.70 0.35 -1.07 0.00 0.00 179.97 179.29 2dlv h PHE 35 N -0.13 0.69 -0.01 3.04 3.57 -1.34 0.41 116.94 123.18 2dlv h PHE 35 Ca 0.09 0.03 -0.24 0.00 3.53 0.00 0.00 57.97 61.38 2dlv h PHE 35 Cb 0.38 -0.19 0.02 0.00 2.79 0.00 0.00 35.95 38.95 2dlv h PHE 35 CO -0.88 -0.10 -0.94 -0.07 -2.23 0.00 0.00 178.31 174.09 2dlv h LEU 36 N 0.27 0.84 -0.84 0.59 3.38 0.14 -3.25 115.31 116.42 2dlv h LEU 36 Ca 0.72 -0.74 0.15 0.00 0.09 0.00 0.00 57.88 58.10 2dlv h LEU 36 Cb 1.93 -0.26 -0.10 0.00 0.09 0.00 0.00 40.66 42.33 2dlv h LEU 36 CO -0.43 1.46 0.43 0.11 0.09 0.00 0.00 178.44 180.10 2dlv h LYS 37 N 0.30 0.58 -0.67 1.13 1.57 0.44 0.90 116.57 120.82 2dlv h LYS 37 Ca -0.11 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 2dlv h LYS 37 Cb 1.60 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.75 2dlv h LYS 37 CO 0.18 0.39 0.32 1.79 -0.57 0.00 0.00 179.45 181.56 2dlv h THR 38 N 0.60 1.22 -0.44 -0.16 1.35 -1.43 -1.38 112.91 112.68 2dlv h THR 38 Ca 0.46 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 2dlv h THR 38 Cb 0.67 0.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 2dlv h THR 38 CO -0.37 0.25 0.00 -0.62 -0.25 0.00 0.00 175.52 174.53 2dlv n GLU 39 N -4.34 2.63 -2.76 4.72 -0.58 0.09 -4.90 120.64 115.50 2dlv n GLU 39 Ca 0.06 -1.83 -0.15 0.00 -0.42 0.00 0.00 57.16 54.82 2dlv n GLU 39 Cb 0.13 -1.60 -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 1.97 -0.48 0.00 0.00 177.13 178.62 2dlv n PHE 40 N 0.71 -1.59 0.51 -0.32 -1.74 0.04 -4.79 117.46 110.28 2dlv n PHE 40 Ca 0.17 0.17 0.06 0.00 -0.56 0.00 0.00 57.45 57.29 2dlv n PHE 40 Cb 0.57 -2.75 -0.08 0.00 1.52 0.00 0.00 39.48 38.75 2dlv n PHE 40 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 2dlv n SER 41 N -1.96 0.81 -0.33 5.98 3.41 0.06 -4.59 113.62 117.00 2dlv n SER 41 Ca -0.09 -0.68 0.19 0.00 -0.26 0.00 0.00 58.87 58.03 2dlv n SER 41 Cb 0.58 1.09 0.38 0.00 -0.26 0.00 0.00 64.21 66.00 2dlv n SER 41 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2dlv h GLU 42 N 0.00 0.05 -1.08 4.33 -0.00 -1.80 0.25 114.58 116.33 2dlv h GLU 42 Ca 0.00 -0.00 0.35 0.00 -0.00 0.00 0.00 59.36 59.71 2dlv h GLU 42 Cb 0.35 -0.01 -0.08 0.00 -0.00 0.00 0.00 28.75 29.01 2dlv h GLU 42 CO 0.00 0.03 0.73 -0.85 -0.00 0.00 0.00 179.01 178.92 2dlv n GLU 43 N -5.37 -0.02 0.43 1.06 0.28 -1.26 0.11 120.64 115.87 2dlv n GLU 43 Ca 0.27 0.82 -0.19 0.00 -0.16 0.00 0.00 57.16 57.90 2dlv n GLU 43 Cb 0.90 -1.69 -0.09 0.00 1.43 0.00 0.00 31.44 31.99 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 -0.91 0.13 -1.84 2.35 -0.78 -2.75 115.58 111.78 2dlv h ASN 44 Ca 0.61 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.36 2dlv h ASN 44 Cb 2.15 0.24 -0.00 0.00 0.05 0.00 0.00 38.32 40.75 2dlv h ASN 44 CO -0.22 -0.63 -0.11 -0.29 -1.65 0.00 0.00 177.43 174.54 2dlv h ILE 45 N -1.12 0.99 -0.49 2.81 6.09 0.58 -2.61 117.51 123.77 2dlv h ILE 45 Ca -0.11 -0.39 0.05 0.00 -1.37 0.00 0.00 64.86 63.04 2dlv h ILE 45 Cb 0.83 1.22 -0.05 0.00 0.47 0.00 0.00 36.82 39.29 2dlv h ILE 45 CO 0.18 0.11 0.23 -0.33 -3.07 0.00 0.00 178.15 175.27 2dlv h GLU 46 N 0.00 0.44 -0.45 2.19 5.08 -1.02 -1.83 114.58 119.00 2dlv h GLU 46 Ca -0.00 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 2dlv h GLU 46 Cb 0.21 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2dlv h GLU 46 CO 0.01 0.29 -0.11 0.35 -1.00 0.00 0.00 179.01 178.56 2dlv h PHE 47 N 0.45 0.89 -0.84 4.33 3.57 -1.20 -0.45 116.94 123.70 2dlv h PHE 47 Ca 0.22 -0.16 0.02 0.00 3.53 0.00 0.00 57.97 61.58 2dlv h PHE 47 Cb 0.15 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 2dlv h PHE 47 CO -0.11 0.87 0.55 2.35 -2.23 0.00 0.00 178.31 179.74 2dlv h TRP 48 N 0.73 1.03 0.03 0.41 7.01 -1.26 -2.68 115.95 121.22 2dlv h TRP 48 Ca 0.12 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.10 2dlv h TRP 48 Cb 0.60 -0.35 0.01 0.00 -2.10 0.00 0.00 29.16 27.32 2dlv h TRP 48 CO 0.03 0.63 -0.21 0.82 -2.79 0.00 0.00 178.44 176.92 2dlv h ILE 49 N 1.09 1.71 -0.97 2.65 2.04 -1.11 -3.33 117.51 119.59 2dlv h ILE 49 Ca 0.32 -2.34 0.32 0.00 1.00 0.00 0.00 64.86 64.16 2dlv h ILE 49 Cb -0.06 3.28 -0.16 0.00 -0.74 0.00 0.00 36.82 39.14 2dlv h ILE 49 CO -0.08 0.62 0.37 0.00 0.00 0.00 0.00 178.15 179.07 2dlv h ALA 50 N 0.05 1.69 0.12 1.87 0.00 -0.95 0.14 119.26 122.18 2dlv h ALA 50 Ca -0.04 0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2dlv h ALA 50 Cb 1.14 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 2dlv h ALA 50 CO 0.04 -0.65 -0.26 0.00 0.00 0.00 0.00 179.25 178.39 2dlv h GLU 52 N -0.46 -0.29 -0.66 0.00 4.39 -0.84 0.24 114.58 116.95 2dlv h GLU 52 Ca 0.03 0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 2dlv h GLU 52 Cb 0.49 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.18 2dlv h GLU 52 CO -0.15 -0.20 0.22 0.22 -1.16 0.00 0.00 179.01 177.94 2dlv h ASP 53 N -0.31 0.93 0.58 1.42 3.58 -1.26 -1.08 116.42 120.28 2dlv h ASP 53 Ca 0.15 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.42 2dlv h ASP 53 Cb 0.57 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.38 2dlv h ASP 53 CO -0.56 0.86 -0.36 0.15 -2.88 0.00 0.00 179.24 176.45 2dlv h PHE 54 N 0.97 -0.94 -0.32 0.28 3.04 0.16 -2.17 116.94 117.95 2dlv h PHE 54 Ca 0.22 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.14 2dlv h PHE 54 Cb 0.26 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.09 2dlv h PHE 54 CO 0.02 -0.54 0.11 1.57 -2.02 0.00 0.00 178.31 177.45 2dlv h LYS 55 N -0.89 0.46 0.00 1.11 2.10 -0.55 -0.85 116.57 117.95 2dlv h LYS 55 Ca -0.07 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2dlv h LYS 55 Cb 0.72 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 2dlv h LYS 55 CO 0.07 0.40 0.00 0.87 -2.00 0.00 0.00 179.45 178.79 2dlv h LYS 56 N 0.46 0.00 -6.88 0.07 1.57 -0.81 -3.45 116.57 107.53 2dlv h LYS 56 Ca 0.11 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.43 2dlv h LYS 56 Cb 0.12 0.00 0.22 0.00 0.08 0.00 0.00 32.23 32.66 2dlv h LYS 56 CO -0.01 0.00 -0.57 0.43 -0.57 0.00 0.00 179.45 178.73 2dlv n SER 57 N -2.64 -1.94 -3.83 0.86 7.64 -0.33 -5.02 113.62 108.36 2dlv n SER 57 Ca -0.00 -0.04 -0.26 0.00 1.01 0.00 0.00 58.87 59.57 2dlv n SER 57 Cb 0.17 -1.13 -0.17 0.00 -1.01 0.00 0.00 64.21 62.07 2dlv n SER 57 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2dlv s LYS 58 N -3.87 1.07 0.00 1.43 -0.14 -1.26 -5.02 119.74 111.94 2dlv s LYS 58 Ca 0.61 -0.25 0.00 0.00 -1.36 0.00 0.00 55.97 54.98 2dlv s LYS 58 Cb -0.18 -1.61 0.00 0.00 -1.68 0.00 0.00 37.83 34.36 2dlv s LYS 58 CO 0.65 -0.39 0.00 0.41 -0.76 0.00 0.00 175.35 175.27 2dlv n GLY 59 N 5.00 2.03 0.08 -3.33 0.00 -1.26 -4.69 105.19 103.03 2dlv n GLY 59 Ca -0.10 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 43.82 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 0.00 -0.07 -0.39 1.61 0.13 -1.99 -3.18 132.00 128.11 2dlv h PRO 60 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.17 2dlv h PRO 60 Cb 0.00 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 31.10 2dlv h PRO 60 CO 0.00 0.39 -0.23 0.94 -0.23 0.00 0.00 178.00 178.87 2dlv n GLN 61 N -4.89 -0.17 -0.03 0.86 0.00 -1.26 0.04 117.38 111.92 2dlv n GLN 61 Ca -0.08 1.05 -0.11 0.00 -0.00 0.00 0.00 57.00 57.86 2dlv n GLN 61 Cb 0.25 -1.56 -0.05 0.00 0.00 0.00 0.00 30.24 28.88 2dlv n GLN 61 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 2dlv h GLN 62 N 0.00 -0.42 -0.71 3.69 5.75 -1.84 0.20 115.11 121.79 2dlv h GLN 62 Ca 0.06 0.03 0.16 0.00 -0.15 0.00 0.00 58.65 58.75 2dlv h GLN 62 Cb 0.16 0.10 -0.12 0.00 1.07 0.00 0.00 27.48 28.69 2dlv h GLN 62 CO -0.37 -0.28 0.04 0.82 -2.65 0.00 0.00 178.83 176.39 2dlv h ILE 63 N -0.43 0.42 0.59 2.39 2.04 -0.95 0.80 117.51 122.37 2dlv h ILE 63 Ca 0.10 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 2dlv h ILE 63 Cb 0.60 0.27 0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2dlv h ILE 63 CO -0.44 0.03 -0.28 0.45 0.00 0.00 0.00 178.15 177.90 2dlv h HIS 64 N 0.14 -0.74 0.31 1.37 3.86 0.78 -0.03 115.15 120.83 2dlv h HIS 64 Ca 0.39 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.58 2dlv h HIS 64 Cb 0.66 0.24 -0.03 0.00 1.06 0.00 0.00 27.41 29.35 2dlv h HIS 64 CO -0.37 -0.41 -0.35 -0.07 0.86 0.00 0.00 177.93 177.59 2dlv h LEU 65 N -0.98 -0.97 -0.42 2.43 4.07 0.03 -1.20 115.31 118.26 2dlv h LEU 65 Ca -0.08 0.09 0.08 0.00 0.08 0.00 0.00 57.88 58.05 2dlv h LEU 65 Cb 0.66 0.34 -0.08 0.00 1.08 0.00 0.00 40.66 42.67 2dlv h LEU 65 CO 0.13 -0.48 -0.06 0.11 -1.08 0.00 0.00 178.44 177.06 2dlv h LYS 66 N -0.70 0.04 -0.14 1.13 1.79 0.54 -0.40 116.57 118.83 2dlv h LYS 66 Ca -0.01 -0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.50 2dlv h LYS 66 Cb 0.65 -0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.23 2dlv h LYS 66 CO -0.09 0.03 -0.25 0.00 -1.08 0.00 0.00 179.45 178.05 2dlv h ALA 67 N 1.40 -0.24 0.39 3.86 0.00 -0.68 0.22 119.26 124.21 2dlv h ALA 67 Ca 0.20 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2dlv h ALA 67 Cb 0.31 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2dlv h ALA 67 CO -0.40 -0.72 -0.38 -0.22 0.00 0.00 0.00 179.25 177.54 2dlv h LYS 68 N -0.32 -0.76 0.18 0.00 3.64 -0.61 0.30 116.57 119.01 2dlv h LYS 68 Ca 0.10 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2dlv h LYS 68 Cb 0.47 0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.44 2dlv h LYS 68 CO -0.32 -0.50 -0.35 0.00 -2.27 0.00 0.00 179.45 176.01 2dlv h ALA 69 N -0.37 -0.92 -0.73 5.00 0.00 -0.82 0.36 119.26 121.77 2dlv h ALA 69 Ca -0.03 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 54.93 2dlv h ALA 69 Cb 0.70 0.68 -0.10 0.00 0.00 0.00 0.00 17.79 19.07 2dlv h ALA 69 CO -0.05 -0.98 0.24 0.82 0.00 0.00 0.00 179.25 179.28 2dlv h ILE 70 N -0.57 0.60 0.48 0.00 2.04 -0.55 0.23 117.51 119.75 2dlv h ILE 70 Ca -0.02 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2dlv h ILE 70 Cb 0.53 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 2dlv h ILE 70 CO -0.13 0.07 -0.40 0.22 0.00 0.00 0.00 178.15 177.90 2dlv h TYR 71 N 0.36 -1.11 0.00 1.37 3.20 0.07 -0.07 116.97 120.79 2dlv h TYR 71 Ca 0.41 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.28 2dlv h TYR 71 Cb 0.65 0.42 0.00 0.00 1.54 0.00 0.00 36.73 39.34 2dlv h TYR 71 CO -0.21 -0.56 0.00 0.39 -1.64 0.00 0.00 178.16 176.15 2dlv n GLU 72 N -4.89 0.10 -0.00 1.82 1.02 0.07 -0.01 120.64 118.76 2dlv n GLU 72 Ca -0.10 0.19 -0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2dlv n GLU 72 Cb 0.38 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.30 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 0.59 -3.43 116.57 120.86 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 0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2dlv h LYS 73 CO 0.00 0.00 -0.66 1.19 -2.27 0.00 0.00 179.45 177.71 2dlv n PHE 74 N -2.35 0.10 -0.07 1.91 3.01 -0.19 -2.58 117.46 117.28 2dlv n PHE 74 Ca -0.00 0.04 -0.02 0.00 1.01 0.00 0.00 57.45 58.48 2dlv n PHE 74 Cb 0.01 -0.40 -0.02 0.00 -0.01 0.00 0.00 39.48 39.07 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 -3.90 -0.11 -1.63 4.37 2.08 -0.90 -3.34 119.36 115.93 2dlv n ILE 75 Ca -0.09 1.17 -0.45 0.00 0.56 0.00 0.00 62.75 63.95 2dlv n ILE 75 Cb 0.34 -1.53 -0.02 0.00 -0.75 0.00 0.00 39.64 37.69 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 -3.20 1.64 -1.89 0.38 10.64 0.99 -4.78 117.38 121.16 2dlv n GLN 76 Ca 0.00 0.58 -0.31 0.00 -1.83 0.00 0.00 57.00 55.44 2dlv n GLN 76 Cb 0.04 -2.07 0.01 0.00 -0.86 0.00 0.00 30.24 27.37 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 -0.76 4.71 -1.39 -0.39 2.01 -1.26 -3.95 115.64 114.61 2dlv s THR 77 Ca 0.62 0.86 -0.02 0.00 0.31 0.00 0.00 61.69 63.46 2dlv s THR 77 Cb -0.68 -3.87 0.00 0.00 0.01 0.00 0.00 72.50 67.96 2dlv s THR 77 CO 0.58 -1.14 0.20 0.47 -0.69 0.00 0.00 174.62 174.03 2dlv n ASP 78 N -2.74 -5.14 -4.90 3.53 8.00 -1.26 -5.00 116.55 109.03 2dlv n ASP 78 Ca 0.06 -0.10 -0.22 0.00 0.71 0.00 0.00 54.79 55.24 2dlv n ASP 78 Cb 0.54 -4.13 -0.01 0.00 -0.02 0.00 0.00 41.12 37.49 2dlv n ASP 78 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dlv s ALA 79 N -2.94 4.24 0.29 2.24 0.00 -1.25 -5.01 121.76 119.32 2dlv s ALA 79 Ca 0.10 -1.77 0.08 0.00 0.00 0.00 0.00 51.96 50.36 2dlv s ALA 79 Cb -0.04 -1.02 0.44 0.00 0.00 0.00 0.00 23.12 22.50 2dlv s ALA 79 CO 0.12 -0.35 1.68 -1.00 0.00 0.00 0.00 175.76 176.21 2dlv h PRO 80 N 0.86 0.17 -0.06 0.00 0.13 -1.88 -3.15 132.00 128.07 2dlv h PRO 80 Ca -0.39 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2dlv h PRO 80 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2dlv h PRO 80 CO 0.55 0.61 0.00 1.63 -0.23 0.00 0.00 178.00 180.56 2dlv n LYS 81 N -3.98 1.92 -1.63 0.86 4.76 -1.16 -4.94 118.16 113.99 2dlv n LYS 81 Ca -0.02 -2.42 -0.48 0.00 -2.87 0.00 0.00 58.31 52.52 2dlv n LYS 81 Cb 0.51 -1.47 -0.04 0.00 -1.84 0.00 0.00 35.03 32.19 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 -1.04 1.68 -4.66 1.97 -0.00 -1.07 -4.03 120.64 113.50 2dlv n GLU 82 Ca 0.14 0.60 -0.30 0.00 -0.00 0.00 0.00 57.16 57.60 2dlv n GLU 82 Cb 0.61 -2.26 -0.10 0.00 -0.00 0.00 0.00 31.44 29.70 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 0.33 1.68 -0.64 3.84 -7.23 -1.21 -4.88 120.40 112.29 2dlv s VAL 83 Ca 0.76 -1.99 -0.26 0.00 -1.81 0.00 0.00 61.98 58.68 2dlv s VAL 83 Cb -0.77 -2.67 0.04 0.00 0.56 0.00 0.00 36.38 33.53 2dlv s VAL 83 CO 0.46 0.00 1.12 0.20 -0.31 0.00 0.00 175.10 176.57 2dlv s ASN 84 N -3.78 6.28 0.32 4.85 0.01 -1.26 -4.91 114.94 116.45 2dlv s ASN 84 Ca 0.24 -0.38 0.08 0.00 -0.71 0.00 0.00 52.86 52.08 2dlv s ASN 84 Cb 0.07 -2.50 -0.06 0.00 0.41 0.00 0.00 41.25 39.16 2dlv s ASN 84 CO 0.12 -1.53 -0.06 -0.76 -1.51 0.00 0.00 177.10 173.37 2dlv s LEU 85 N 4.79 2.60 0.51 0.60 1.43 -1.26 -4.81 118.68 122.54 2dlv s LEU 85 Ca 0.34 -1.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.09 2dlv s LEU 85 Cb -0.11 -0.79 -0.06 0.00 0.03 0.00 0.00 46.19 45.27 2dlv s LEU 85 CO 0.18 -0.32 0.92 -0.62 0.23 0.00 0.00 176.35 176.74 2dlv s ASP 86 N -3.54 6.45 0.07 2.29 2.15 -1.26 -4.94 116.67 117.89 2dlv s ASP 86 Ca 0.32 1.34 -0.37 0.00 0.43 0.00 0.00 52.55 54.27 2dlv s ASP 86 Cb 0.04 -2.42 -0.20 0.00 -0.30 0.00 0.00 42.92 40.04 2dlv s ASP 86 CO 0.15 -0.62 1.58 0.15 -0.17 0.00 0.00 175.17 176.26 2dlv h PHE 87 N 0.58 -1.20 -0.31 -5.34 3.57 -2.01 -1.12 116.94 111.11 2dlv h PHE 87 Ca -0.46 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.05 2dlv h PHE 87 Cb 1.19 0.41 -0.05 0.00 2.79 0.00 0.00 35.95 40.29 2dlv h PHE 87 CO 0.63 -0.72 -0.28 1.25 -2.23 0.00 0.00 178.31 176.96 2dlv h HIS 88 N -1.22 -0.88 -0.49 0.41 2.76 -1.99 0.22 115.15 113.96 2dlv h HIS 88 Ca -0.12 0.05 0.10 0.00 -2.20 0.00 0.00 60.37 58.20 2dlv h HIS 88 Cb 0.95 0.43 -0.10 0.00 1.55 0.00 0.00 27.41 30.24 2dlv h HIS 88 CO -0.04 -0.22 -0.24 1.15 -1.30 0.00 0.00 177.93 177.27 2dlv h THR 89 N -0.13 0.32 -0.65 6.26 2.02 -1.97 0.27 112.91 119.04 2dlv h THR 89 Ca 0.05 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.35 2dlv h THR 89 Cb 0.26 0.32 -0.09 0.00 -1.74 0.00 0.00 68.15 66.90 2dlv h THR 89 CO -0.36 0.00 0.19 0.11 0.37 0.00 0.00 175.52 175.84 2dlv h LYS 90 N -0.13 0.33 0.64 6.66 1.57 -0.08 -1.54 116.57 124.02 2dlv h LYS 90 Ca 0.23 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2dlv h LYS 90 Cb 0.49 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.73 2dlv h LYS 90 CO -0.57 0.22 -0.31 1.49 -0.57 0.00 0.00 179.45 179.70 2dlv h GLU 91 N 0.34 -0.83 -0.99 3.15 4.57 0.12 -1.96 114.58 118.98 2dlv h GLU 91 Ca 0.34 0.06 0.33 0.00 -1.18 0.00 0.00 59.36 58.91 2dlv h GLU 91 Cb 0.50 0.19 -0.18 0.00 -0.16 0.00 0.00 28.75 29.10 2dlv h GLU 91 CO -0.39 -0.53 0.25 0.28 -1.18 0.00 0.00 179.01 177.44 2dlv h VAL 92 N -1.18 0.05 -0.18 0.32 2.07 -0.28 0.51 116.25 117.56 2dlv h VAL 92 Ca -0.09 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 2dlv h VAL 92 Cb 0.69 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2dlv h VAL 92 CO 0.15 0.01 -0.11 0.40 0.02 0.00 0.00 177.57 178.03 2dlv h ILE 93 N 0.03 1.32 -0.92 4.57 2.04 -1.25 0.72 117.51 124.02 2dlv h ILE 93 Ca 0.69 -1.19 0.17 0.00 1.00 0.00 0.00 64.86 65.53 2dlv h ILE 93 Cb 1.62 1.71 -0.10 0.00 -0.74 0.00 0.00 36.82 39.31 2dlv h ILE 93 CO -0.83 0.36 0.51 0.74 0.00 0.00 0.00 178.15 178.92 2dlv h THR 94 N 0.07 0.70 0.03 -0.27 2.02 0.79 0.95 112.91 117.20 2dlv h THR 94 Ca 0.04 -0.23 -0.30 0.00 0.77 0.00 0.00 66.41 66.69 2dlv h THR 94 Cb 0.61 -0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 2dlv h THR 94 CO 0.03 0.12 -1.68 0.78 0.37 0.00 0.00 175.52 175.14 2dlv h ASN 95 N 0.67 0.10 -0.35 4.18 2.35 -1.19 -3.32 115.58 118.02 2dlv h ASN 95 Ca 0.52 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 2dlv h ASN 95 Cb 0.79 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2dlv h ASN 95 CO -0.38 1.17 0.00 -0.24 -1.65 0.00 0.00 177.43 176.33 2dlv n SER 96 N -3.17 3.41 0.00 5.81 2.88 0.25 -4.07 113.62 118.73 2dlv n SER 96 Ca -0.18 -2.42 0.12 0.00 -1.33 0.00 0.00 58.87 55.05 2dlv n SER 96 Cb 1.04 -0.54 0.54 0.00 -0.75 0.00 0.00 64.21 64.50 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 0.43 0.32 -0.02 2.46 0.13 0.32 -1.69 119.36 121.31 2dlv n ILE 97 Ca 0.15 0.08 0.05 0.00 -1.10 0.00 0.00 62.75 61.94 2dlv n ILE 97 Cb 0.70 -0.67 -0.13 0.00 -0.84 0.00 0.00 39.64 38.71 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 -1.45 0.20 -1.41 9.51 5.66 -1.26 -4.46 114.28 121.06 2dlv n THR 98 Ca 0.07 -0.42 0.05 0.00 -3.05 0.00 0.00 64.05 60.70 2dlv n THR 98 Cb 0.26 -0.01 0.20 0.00 -1.55 0.00 0.00 70.33 69.23 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 -2.16 1.66 -2.25 1.09 10.64 -1.16 -5.05 117.38 120.14 2dlv n GLN 99 Ca -0.07 -3.09 -0.40 0.00 -1.83 0.00 0.00 57.00 51.61 2dlv n GLN 99 Cb 0.53 -1.65 -0.02 0.00 -0.86 0.00 0.00 30.24 28.24 2dlv n GLN 99 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 2dlv s PRO 100 N -3.14 4.30 0.54 2.61 0.04 -0.68 -5.04 135.00 133.63 2dlv s PRO 100 Ca 0.38 1.99 0.04 0.00 0.04 0.00 0.00 61.00 63.45 2dlv s PRO 100 Cb 0.36 -2.95 0.02 0.00 0.04 0.00 0.00 34.50 31.97 2dlv s PRO 100 CO -0.02 -0.15 0.26 0.95 0.04 0.00 0.00 177.00 178.07 2dlv s THR 101 N -1.24 1.44 0.60 1.26 -4.23 -1.26 -4.79 115.64 107.42 2dlv s THR 101 Ca 0.51 -1.68 0.37 0.00 -1.18 0.00 0.00 61.69 59.71 2dlv s THR 101 Cb -0.35 -2.11 0.37 0.00 1.34 0.00 0.00 72.50 71.74 2dlv s THR 101 CO 0.45 0.00 2.12 -0.07 -0.54 0.00 0.00 174.62 176.58 2dlv h LEU 102 N 0.95 0.00 -3.23 4.79 3.38 -1.93 0.37 115.31 119.63 2dlv h LEU 102 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2dlv h LEU 102 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2dlv h LEU 102 CO 0.63 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.16 2dlv n HIS 103 N -2.92 1.04 0.19 1.13 1.44 -1.26 -4.26 115.22 110.58 2dlv n HIS 103 Ca -0.02 -0.78 -0.14 0.00 -2.01 0.00 0.00 57.72 54.76 2dlv n HIS 103 Cb 0.20 -0.29 -0.07 0.00 0.12 0.00 0.00 29.99 29.95 2dlv n HIS 103 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2dlv h SER 104 N 2.27 -0.64 0.00 4.39 0.87 -0.62 -1.09 113.55 118.74 2dlv h SER 104 Ca 0.00 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2dlv h SER 104 Cb 1.40 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 63.57 2dlv h SER 104 CO 0.22 -0.36 0.00 0.49 -0.53 0.00 0.00 176.83 176.65 2dlv n PHE 105 N -5.37 0.00 0.18 2.24 3.72 -1.26 -4.07 117.46 112.90 2dlv n PHE 105 Ca -0.09 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.17 2dlv n PHE 105 Cb 0.28 -0.05 -0.07 0.00 -0.94 0.00 0.00 39.48 38.70 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 0.01 -0.57 0.30 4.37 3.58 -1.50 -0.55 116.42 122.06 2dlv h ASP 106 Ca 0.00 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 2dlv h ASP 106 Cb 0.23 0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.46 2dlv h ASP 106 CO 0.00 -0.33 -0.14 0.00 -2.88 0.00 0.00 179.24 175.88 2dlv h ALA 107 N 0.16 -0.40 -0.55 -0.78 0.00 -1.77 -3.14 119.26 112.78 2dlv h ALA 107 Ca -0.02 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.80 2dlv h ALA 107 Cb 0.45 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 2dlv h ALA 107 CO -0.01 -0.56 -0.40 0.00 0.00 0.00 0.00 179.25 178.28 2dlv h ALA 108 N -0.16 -0.24 -0.69 0.00 0.00 -1.80 -0.82 119.26 115.54 2dlv h ALA 108 Ca -0.04 0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2dlv h ALA 108 Cb 0.49 0.88 -0.13 0.00 0.00 0.00 0.00 17.79 19.04 2dlv h ALA 108 CO 0.07 -0.78 -0.31 0.37 0.00 0.00 0.00 179.25 178.60 2dlv h GLN 109 N -0.22 -0.10 -0.73 0.00 4.15 -1.14 0.18 115.11 117.25 2dlv h GLN 109 Ca 0.19 0.01 0.16 0.00 0.77 0.00 0.00 58.65 59.77 2dlv h GLN 109 Cb 0.56 0.02 -0.11 0.00 0.21 0.00 0.00 27.48 28.17 2dlv h GLN 109 CO -0.66 -0.06 0.18 1.03 -1.93 0.00 0.00 178.83 177.39 2dlv h SER 110 N -0.10 0.03 0.58 -0.69 0.87 -1.10 0.20 113.55 113.33 2dlv h SER 110 Ca 0.28 0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.96 2dlv h SER 110 Cb 0.56 0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.70 2dlv h SER 110 CO -0.75 -0.03 -0.45 -0.09 -0.53 0.00 0.00 176.83 174.98 2dlv h ARG 111 N 0.28 -0.96 0.04 2.24 9.65 -0.29 -2.99 114.38 122.34 2dlv h ARG 111 Ca 0.41 0.07 0.03 0.00 -1.10 0.00 0.00 59.98 59.38 2dlv h ARG 111 Cb 0.70 0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 29.46 2dlv h ARG 111 CO -0.50 -0.64 -0.24 0.28 2.80 0.00 0.00 179.97 181.66 2dlv h VAL 112 N -1.00 0.45 -0.73 0.20 2.07 -0.81 -2.13 116.25 114.29 2dlv h VAL 112 Ca -0.08 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.69 2dlv h VAL 112 Cb 0.83 0.45 -0.13 0.00 -1.52 0.00 0.00 31.29 30.91 2dlv h VAL 112 CO 0.01 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.77 2dlv n TYR 113 N -5.37 0.63 -0.03 1.57 9.36 0.66 0.12 117.16 124.10 2dlv n TYR 113 Ca -0.05 0.88 -0.13 0.00 3.32 0.00 0.00 57.90 61.91 2dlv n TYR 113 Cb 0.28 -1.15 -0.11 0.00 -0.63 0.00 0.00 39.34 37.73 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 0.04 -0.75 2.98 4.20 -1.25 -3.03 115.11 117.30 2dlv h GLN 114 Ca 0.52 -0.03 0.24 0.00 0.06 0.00 0.00 58.65 59.44 2dlv h GLN 114 Cb 1.21 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 28.86 2dlv h GLN 114 CO -0.64 0.68 0.14 1.28 -0.67 0.00 0.00 178.83 179.61 2dlv n LEU 115 N -4.74 0.02 0.01 1.46 4.77 0.31 0.37 117.00 119.20 2dlv n LEU 115 Ca -0.09 1.27 -0.01 0.00 -0.03 0.00 0.00 56.01 57.15 2dlv n LEU 115 Cb 0.34 -0.51 -0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2dlv n LEU 115 CO 0.35 -1.33 0.12 0.24 -1.33 0.00 0.00 177.39 175.44 2dlv h MET 116 N 0.00 -0.04 -0.91 3.23 2.86 -1.53 -3.28 114.93 115.26 2dlv h MET 116 Ca 0.51 0.00 0.27 0.00 -2.06 0.00 0.00 59.70 58.42 2dlv h MET 116 Cb 1.17 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.81 2dlv h MET 116 CO -0.67 -0.03 1.15 1.49 1.06 0.00 0.00 176.91 179.92 2dlv h GLU 117 N -0.15 0.00 0.06 1.72 4.81 -1.11 0.44 114.58 120.35 2dlv h GLU 117 Ca -0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2dlv h GLU 117 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 2dlv h GLU 117 CO 0.01 0.00 -0.03 1.96 -0.73 0.00 0.00 179.01 180.21 2dlv h GLN 118 N 0.00 -0.08 0.00 1.92 1.08 -0.14 -3.39 115.11 114.50 2dlv h GLN 118 Ca 0.43 0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.60 2dlv h GLN 118 Cb 2.73 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 30.17 2dlv h GLN 118 CO -0.00 -0.06 -1.14 -0.40 -0.95 0.00 0.00 178.83 176.28 2dlv n ASP 119 N -2.32 3.97 -0.10 1.46 5.75 -0.36 -4.58 116.55 120.37 2dlv n ASP 119 Ca -0.01 -0.01 -0.08 0.00 -0.01 0.00 0.00 54.79 54.68 2dlv n ASP 119 Cb 0.04 0.10 -0.01 0.00 -1.03 0.00 0.00 41.12 40.21 2dlv n ASP 119 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2dlv h SER 120 N 0.00 -1.02 0.48 -1.12 0.02 -0.38 0.38 113.55 111.92 2dlv h SER 120 Ca -0.06 0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2dlv h SER 120 Cb 1.10 0.48 -0.01 0.00 0.14 0.00 0.00 62.40 64.10 2dlv h SER 120 CO -0.01 -0.31 -0.40 0.22 -1.14 0.00 0.00 176.83 175.19 2dlv h TYR 121 N -0.25 -1.09 -1.01 3.45 3.20 -1.56 0.36 116.97 120.07 2dlv h TYR 121 Ca 0.17 0.00 0.23 0.00 3.14 0.00 0.00 58.73 62.27 2dlv h TYR 121 Cb 0.53 0.41 -0.10 0.00 1.54 0.00 0.00 36.73 39.11 2dlv h TYR 121 CO -0.51 -0.55 0.63 1.79 -1.64 0.00 0.00 178.16 177.88 2dlv h THR 122 N -0.86 0.60 -0.25 1.81 1.35 -1.69 0.70 112.91 114.57 2dlv h THR 122 Ca -0.06 -0.18 -0.13 0.00 -0.55 0.00 0.00 66.41 65.49 2dlv h THR 122 Cb 0.72 0.02 -0.00 0.00 -1.73 0.00 0.00 68.15 67.16 2dlv h THR 122 CO -0.00 0.10 -0.35 -0.09 -0.25 0.00 0.00 175.52 174.92 2dlv h ARG 123 N 0.53 0.67 -0.47 4.72 2.43 0.27 -3.09 114.38 119.44 2dlv h ARG 123 Ca 0.58 -0.39 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2dlv h ARG 123 Cb 1.25 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.81 2dlv h ARG 123 CO -0.33 1.01 0.27 0.35 -1.51 0.00 0.00 179.97 179.75 2dlv h PHE 124 N 0.39 0.61 -0.48 2.20 3.57 0.19 0.73 116.94 124.16 2dlv h PHE 124 Ca 0.03 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2dlv h PHE 124 Cb 0.93 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2dlv h PHE 124 CO 0.08 0.42 0.24 -0.07 -2.23 0.00 0.00 178.31 176.75 2dlv h LEU 125 N 0.64 0.61 -3.05 0.59 3.38 -1.11 -2.38 115.31 113.99 2dlv h LEU 125 Ca 0.17 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2dlv h LEU 125 Cb -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2dlv h LEU 125 CO -0.03 0.56 0.00 2.29 0.09 0.00 0.00 178.44 181.35 2dlv n LYS 126 N -4.64 4.01 -3.21 1.13 2.85 -0.92 -4.52 118.16 112.85 2dlv n LYS 126 Ca 0.02 -2.66 -0.35 0.00 -1.05 0.00 0.00 58.31 54.26 2dlv n LYS 126 Cb 0.11 -2.03 -0.06 0.00 -0.65 0.00 0.00 35.03 32.40 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 -0.75 6.91 0.16 -5.58 1.04 0.21 -4.94 113.70 110.75 2dlv s SER 127 Ca 0.47 1.25 -0.23 0.00 0.48 0.00 0.00 55.95 57.92 2dlv s SER 127 Cb 0.33 -2.36 0.05 0.00 0.10 0.00 0.00 66.02 64.14 2dlv s SER 127 CO 0.17 0.02 1.61 -0.78 0.98 0.00 0.00 173.24 175.24 2dlv h ASP 128 N 3.25 -0.98 -0.67 7.02 1.82 -1.88 0.72 116.42 125.69 2dlv h ASP 128 Ca -0.48 0.17 0.08 0.00 -0.39 0.00 0.00 57.03 56.41 2dlv h ASP 128 Cb 1.19 0.46 -0.11 0.00 0.68 0.00 0.00 39.33 41.55 2dlv h ASP 128 CO 0.66 -0.31 -0.52 0.40 -1.61 0.00 0.00 179.24 177.85 2dlv h ILE 129 N -0.26 0.03 -0.17 2.25 2.04 -1.94 0.35 117.51 119.81 2dlv h ILE 129 Ca 0.16 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.02 2dlv h ILE 129 Cb 0.52 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2dlv h ILE 129 CO -0.48 0.00 0.09 0.22 0.00 0.00 0.00 178.15 177.98 2dlv h TYR 130 N -0.21 0.17 -0.97 1.37 5.03 -1.59 -2.34 116.97 118.43 2dlv h TYR 130 Ca 0.15 0.01 0.16 0.00 2.58 0.00 0.00 58.73 61.63 2dlv h TYR 130 Cb 0.53 -0.05 -0.09 0.00 1.55 0.00 0.00 36.73 38.67 2dlv h TYR 130 CO -0.82 0.10 0.61 -0.07 -1.32 0.00 0.00 178.16 176.66 2dlv h LEU 131 N 0.19 0.75 -0.08 2.82 3.38 0.59 -1.64 115.31 121.31 2dlv h LEU 131 Ca 0.06 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.13 2dlv h LEU 131 Cb -0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2dlv h LEU 131 CO -0.03 0.34 -0.14 -0.78 0.09 0.00 0.00 178.44 177.91 2dlv h ASP 132 N 0.77 -0.43 -0.86 -0.43 3.58 0.19 0.26 116.42 119.51 2dlv h ASP 132 Ca 0.51 0.08 0.19 0.00 0.42 0.00 0.00 57.03 58.23 2dlv h ASP 132 Cb 0.78 0.20 -0.16 0.00 1.72 0.00 0.00 39.33 41.87 2dlv h ASP 132 CO -0.28 -0.19 -0.16 0.18 -2.88 0.00 0.00 179.24 175.90 2dlv n LEU 133 N -5.28 -0.26 0.09 2.28 4.32 -0.62 0.50 117.00 118.03 2dlv n LEU 133 Ca -0.04 1.48 -0.19 0.00 -0.02 0.00 0.00 56.01 57.24 2dlv n LEU 133 Cb 0.20 -0.47 -0.15 0.00 -1.62 0.00 0.00 43.42 41.39 2dlv n LEU 133 CO 0.24 -1.43 -0.26 0.00 -1.22 0.00 0.00 177.39 174.71 2dlv h MET 134 N 0.00 0.34 -6.36 3.23 -0.00 -1.51 -3.36 114.93 107.26 2dlv h MET 134 Ca 0.44 -0.58 -0.48 0.00 -0.00 0.00 0.00 59.70 59.07 2dlv h MET 134 Cb 0.73 0.22 -0.06 0.00 -0.00 0.00 0.00 31.60 32.49 2dlv h MET 134 CO -0.87 1.24 -0.78 -1.13 -0.00 0.00 0.00 176.91 175.37 2dlv n SER 135 N -3.55 -3.96 0.00 -0.10 3.41 0.18 -4.32 113.62 105.28 2dlv n SER 135 Ca -0.15 -0.83 0.00 0.00 -0.26 0.00 0.00 58.87 57.62 2dlv n SER 135 Cb 1.06 -3.68 0.00 0.00 -0.26 0.00 0.00 64.21 61.32 2dlv n SER 135 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dlv n GLY 136 N -1.65 3.42 3.56 5.00 0.00 -1.26 -4.67 105.19 109.59 2dlv n GLY 136 Ca -0.01 -1.91 -0.31 0.00 0.00 0.00 0.00 46.02 43.79 2dlv n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlv s PRO 137 N -3.00 2.58 -0.92 1.61 0.04 -1.26 -3.20 135.00 130.85 2dlv s PRO 137 Ca 0.00 0.06 -0.05 0.00 0.04 0.00 0.00 61.00 61.04 2dlv s PRO 137 Cb 0.00 -4.81 0.01 0.00 0.04 0.00 0.00 34.50 29.74 2dlv s PRO 137 CO 0.00 -3.14 0.80 0.45 0.04 0.00 0.00 177.00 175.15 2dlv n SER 138 N 13.54 -4.64 -3.62 6.66 2.88 -1.26 -2.86 113.62 124.33 2dlv n SER 138 Ca 0.33 -0.38 -0.23 0.00 -1.33 0.00 0.00 58.87 57.26 2dlv n SER 138 Cb 0.49 -3.63 0.07 0.00 -0.75 0.00 0.00 64.21 60.39 2dlv n SER 138 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dlv n SER 139 N -1.72 -4.97 0.00 -3.46 2.88 -1.19 -5.19 113.62 99.98 2dlv n SER 139 Ca -0.02 -0.61 0.00 0.00 -1.33 0.00 0.00 58.87 56.91 2dlv n SER 139 Cb 0.55 -4.83 0.00 0.00 -0.75 0.00 0.00 64.21 59.18 2dlv n SER 139 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42