#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 -1.72 -0.34 1.61 0.02 -2.00 -1.17 113.55 109.96 2dlv h SER 2 Ca 0.00 0.25 0.01 0.00 -0.84 0.00 0.00 61.79 61.21 2dlv h SER 2 Cb 0.00 0.73 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 2dlv h SER 2 CO 0.00 -0.37 0.20 0.28 -1.14 0.00 0.00 176.83 175.79 2dlv h SER 3 N -0.32 0.32 -2.95 3.07 0.02 -2.02 -3.31 113.55 108.35 2dlv h SER 3 Ca 0.12 0.00 -0.76 0.00 -0.84 0.00 0.00 61.79 60.31 2dlv h SER 3 Cb 0.58 -0.06 -0.22 0.00 0.14 0.00 0.00 62.40 62.83 2dlv h SER 3 CO -0.64 0.23 0.76 -0.83 -1.14 0.00 0.00 176.83 175.22 2dlv s GLY 4 N -2.55 2.65 -0.17 -3.77 0.00 -0.45 -4.77 107.32 98.26 2dlv s GLY 4 Ca -0.13 -3.42 -0.15 0.00 0.00 0.00 0.00 44.72 41.01 2dlv s GLY 4 CO 0.71 1.67 0.28 1.48 0.00 0.00 0.00 173.10 177.25 2dlv h SER 5 N 7.37 0.18 -0.73 1.64 4.64 -1.64 -3.38 113.55 121.62 2dlv h SER 5 Ca 0.21 -0.69 0.15 0.00 -0.47 0.00 0.00 61.79 60.99 2dlv h SER 5 Cb 0.93 -0.06 -0.10 0.00 -0.31 0.00 0.00 62.40 62.85 2dlv h SER 5 CO 1.06 1.65 0.22 -1.28 -0.87 0.00 0.00 176.83 177.61 2dlv h SER 6 N -0.55 0.10 -3.05 4.97 0.87 -1.91 -3.43 113.55 110.55 2dlv h SER 6 Ca -0.38 0.13 -0.48 0.00 -1.23 0.00 0.00 61.79 59.83 2dlv h SER 6 Cb 1.61 0.16 -0.14 0.00 -0.44 0.00 0.00 62.40 63.59 2dlv h SER 6 CO -0.09 0.01 -0.66 -0.83 -0.53 0.00 0.00 176.83 174.74 2dlv s GLY 7 N -3.50 1.87 -0.12 5.77 0.00 -1.26 -5.07 107.32 105.01 2dlv s GLY 7 Ca -0.13 -1.94 0.01 0.00 0.00 0.00 0.00 44.72 42.67 2dlv s GLY 7 CO 0.76 -1.83 -0.17 -0.45 0.00 0.00 0.00 173.10 171.41 2dlv s SER 8 N -3.45 3.69 0.11 1.64 0.15 -1.26 -4.77 113.70 109.81 2dlv s SER 8 Ca 0.31 -0.41 0.18 0.00 0.70 0.00 0.00 55.95 56.74 2dlv s SER 8 Cb 0.05 -1.52 0.77 0.00 -1.71 0.00 0.00 66.02 63.61 2dlv s SER 8 CO 0.12 0.17 1.57 -0.81 1.20 0.00 0.00 173.24 175.49 2dlv n PRO 9 N 3.50 0.08 0.02 5.44 -0.04 -1.26 -2.62 135.00 140.12 2dlv n PRO 9 Ca -0.18 0.33 -0.19 0.00 -0.04 0.00 0.00 63.50 63.42 2dlv n PRO 9 Cb 0.53 -1.66 -0.11 0.00 -0.04 0.00 0.00 33.50 32.21 2dlv n PRO 9 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2dlv h GLU 10 N 0.00 0.52 0.03 0.54 4.81 -2.00 -3.04 114.58 115.44 2dlv h GLU 10 Ca 0.00 -0.57 -0.27 0.00 -0.13 0.00 0.00 59.36 58.39 2dlv h GLU 10 Cb 0.29 0.17 0.02 0.00 0.63 0.00 0.00 28.75 29.86 2dlv h GLU 10 CO 0.00 1.20 -1.08 0.93 -0.73 0.00 0.00 179.01 179.33 2dlv h GLU 11 N 0.07 0.64 -0.07 1.92 4.39 -1.96 -3.28 114.58 116.30 2dlv h GLU 11 Ca -0.10 -0.73 0.04 0.00 0.34 0.00 0.00 59.36 58.90 2dlv h GLU 11 Cb 1.49 0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 30.31 2dlv h GLU 11 CO 0.16 1.31 -0.18 0.00 -1.16 0.00 0.00 179.01 179.14 2dlv h ALA 12 N 0.43 -0.16 -0.71 3.43 0.00 -1.61 0.16 119.26 120.81 2dlv h ALA 12 Ca -0.14 0.03 0.18 0.00 0.00 0.00 0.00 54.91 54.99 2dlv h ALA 12 Cb 1.74 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 19.83 2dlv h ALA 12 CO 0.21 -0.65 0.49 -0.24 0.00 0.00 0.00 179.25 179.06 2dlv h VAL 13 N -0.25 0.70 0.02 0.00 3.04 -1.63 -1.82 116.25 116.31 2dlv h VAL 13 Ca 0.08 -0.04 -0.04 0.00 -1.01 0.00 0.00 66.70 65.68 2dlv h VAL 13 Cb 0.36 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 30.20 2dlv h VAL 13 CO -0.22 0.02 -0.18 0.11 -1.01 0.00 0.00 177.57 176.29 2dlv h LYS 14 N 0.13 0.08 -0.89 4.17 1.57 -1.23 -3.32 116.57 117.07 2dlv h LYS 14 Ca 0.34 -0.12 0.31 0.00 -1.87 0.00 0.00 60.65 59.31 2dlv h LYS 14 Cb 1.17 0.04 -0.16 0.00 0.08 0.00 0.00 32.23 33.36 2dlv h LYS 14 CO -0.04 1.00 0.24 0.91 -0.57 0.00 0.00 179.45 180.99 2dlv n TRP 15 N -4.52 0.79 -0.32 -1.35 8.01 0.44 0.16 117.44 120.65 2dlv n TRP 15 Ca -0.11 1.06 0.05 0.00 -1.31 0.00 0.00 57.50 57.20 2dlv n TRP 15 Cb 0.53 -1.31 0.20 0.00 -2.01 0.00 0.00 31.31 28.73 2dlv n TRP 15 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 2dlv h GLY 16 N 0.00 1.44 -0.52 6.99 0.00 -1.64 -2.96 103.07 106.39 2dlv h GLY 16 Ca 0.64 -0.35 0.05 0.00 0.00 0.00 0.00 47.33 47.67 2dlv h GLY 16 CO -0.76 0.12 -0.31 1.18 0.00 0.00 0.00 176.54 176.77 2dlv n GLU 17 N -4.71 -0.23 -3.98 4.80 1.02 0.43 -4.66 120.64 113.31 2dlv n GLU 17 Ca 0.16 1.17 -0.09 0.00 -0.02 0.00 0.00 57.16 58.38 2dlv n GLU 17 Cb 0.33 -1.73 -0.10 0.00 -0.02 0.00 0.00 31.44 29.92 2dlv n GLU 17 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2dlv s SER 18 N -4.41 0.26 0.23 1.62 0.01 -1.12 -5.05 113.70 105.24 2dlv s SER 18 Ca -0.06 -0.58 -0.07 0.00 1.31 0.00 0.00 55.95 56.54 2dlv s SER 18 Cb 0.06 0.16 0.22 0.00 0.21 0.00 0.00 66.02 66.67 2dlv s SER 18 CO 0.32 -0.42 1.90 0.15 0.41 0.00 0.00 173.24 175.60 2dlv h PHE 19 N 4.08 1.18 0.37 2.43 3.57 -1.83 -2.99 116.94 123.75 2dlv h PHE 19 Ca -0.32 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.19 2dlv h PHE 19 Cb 1.19 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 2dlv h PHE 19 CO 0.60 0.76 -0.37 0.38 -2.23 0.00 0.00 178.31 177.45 2dlv h ASP 20 N 1.25 -1.02 -1.00 0.41 2.03 -1.97 -2.50 116.42 113.63 2dlv h ASP 20 Ca 0.33 0.09 0.25 0.00 -0.73 0.00 0.00 57.03 56.97 2dlv h ASP 20 Cb -0.10 0.34 -0.19 0.00 -0.83 0.00 0.00 39.33 38.55 2dlv h ASP 20 CO -0.07 -0.52 -0.07 0.11 -1.03 0.00 0.00 179.24 177.66 2dlv h LYS 21 N -0.77 0.00 0.47 4.15 1.57 -1.83 0.15 116.57 120.32 2dlv h LYS 21 Ca -0.03 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2dlv h LYS 21 Cb 0.69 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 2dlv h LYS 21 CO -0.07 0.00 -0.47 1.25 -0.57 0.00 0.00 179.45 179.60 2dlv h LEU 22 N 0.00 -1.27 -0.34 2.94 5.85 -1.44 -2.83 115.31 118.22 2dlv h LEU 22 Ca 0.56 0.10 0.07 0.00 0.84 0.00 0.00 57.88 59.45 2dlv h LEU 22 Cb 1.07 0.42 -0.06 0.00 0.37 0.00 0.00 40.66 42.46 2dlv h LEU 22 CO -0.97 -0.63 -0.08 -0.07 -0.34 0.00 0.00 178.44 176.35 2dlv h LEU 23 N -0.94 -0.31 -0.97 2.25 3.38 -0.60 -1.91 115.31 116.20 2dlv h LEU 23 Ca -0.05 0.10 0.26 0.00 0.09 0.00 0.00 57.88 58.27 2dlv h LEU 23 Cb 0.83 0.21 -0.18 0.00 0.09 0.00 0.00 40.66 41.60 2dlv h LEU 23 CO -0.06 -0.11 -0.03 -0.24 0.09 0.00 0.00 178.44 178.09 2dlv n SER 24 N -5.27 -0.15 -4.81 -0.43 2.88 0.16 -4.33 113.62 101.67 2dlv n SER 24 Ca 0.01 1.66 -0.34 0.00 -1.33 0.00 0.00 58.87 58.86 2dlv n SER 24 Cb 0.19 -0.59 -0.06 0.00 -0.75 0.00 0.00 64.21 63.00 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 -6.02 3.34 -0.09 0.66 5.65 -0.72 -5.01 115.29 113.11 2dlv s HIS 25 Ca -0.13 1.65 -0.16 0.00 0.25 0.00 0.00 55.06 56.67 2dlv s HIS 25 Cb 0.28 -2.92 -0.13 0.00 -1.18 0.00 0.00 32.58 28.63 2dlv s HIS 25 CO 0.76 -0.18 0.54 -0.09 -0.65 0.00 0.00 174.74 175.11 2dlv h ARG 26 N 2.18 -0.09 -0.70 2.88 9.65 -1.82 -2.87 114.38 123.61 2dlv h ARG 26 Ca -0.49 0.01 0.13 0.00 -1.10 0.00 0.00 59.98 58.53 2dlv h ARG 26 Cb 1.19 0.02 -0.13 0.00 -1.39 0.00 0.00 29.97 29.66 2dlv h ARG 26 CO 0.62 0.35 -0.28 -0.44 2.80 0.00 0.00 179.97 183.02 2dlv h ASP 27 N -0.96 -0.98 0.43 -3.80 5.19 -1.94 -0.56 116.42 113.80 2dlv h ASP 27 Ca -0.01 0.23 -0.02 0.00 -0.62 0.00 0.00 57.03 56.61 2dlv h ASP 27 Cb 0.49 0.54 0.00 0.00 0.18 0.00 0.00 39.33 40.54 2dlv h ASP 27 CO 0.02 -0.28 -0.21 1.23 -3.12 0.00 0.00 179.24 176.88 2dlv h GLY 28 N -0.08 -0.61 -0.34 2.75 0.00 -1.80 -2.62 103.07 100.38 2dlv h GLY 28 Ca 0.30 0.22 0.09 0.00 0.00 0.00 0.00 47.33 47.94 2dlv h GLY 28 CO -0.75 -0.22 -0.35 -2.00 0.00 0.00 0.00 176.54 173.22 2dlv h LEU 29 N -0.61 -1.19 -0.26 3.11 5.85 -1.07 0.16 115.31 121.30 2dlv h LEU 29 Ca -0.06 0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.94 2dlv h LEU 29 Cb 0.46 0.57 -0.08 0.00 0.37 0.00 0.00 40.66 41.98 2dlv h LEU 29 CO 0.10 -0.32 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.21 2dlv h GLU 30 N -0.21 -0.32 -0.43 1.25 4.39 -1.07 -0.68 114.58 117.50 2dlv h GLU 30 Ca 0.20 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.98 2dlv h GLU 30 Cb 0.55 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.23 2dlv h GLU 30 CO -0.63 -0.21 0.15 0.00 -1.16 0.00 0.00 179.01 177.16 2dlv h ALA 31 N 0.55 0.51 -0.47 3.43 0.00 -0.87 -2.35 119.26 120.07 2dlv h ALA 31 Ca 0.13 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.18 2dlv h ALA 31 Cb 0.55 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 2dlv h ALA 31 CO -0.45 -0.24 0.04 0.35 0.00 0.00 0.00 179.25 178.95 2dlv h PHE 32 N 0.32 0.04 -0.17 0.00 3.57 0.24 -2.30 116.94 118.64 2dlv h PHE 32 Ca 0.20 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.78 2dlv h PHE 32 Cb 0.19 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.92 2dlv h PHE 32 CO -0.15 -0.07 -0.23 1.15 -2.23 0.00 0.00 178.31 176.79 2dlv h THR 33 N 0.15 0.44 -0.94 4.41 2.02 -0.63 -2.40 112.91 115.96 2dlv h THR 33 Ca 0.24 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.56 2dlv h THR 33 Cb 0.34 0.44 -0.15 0.00 -1.74 0.00 0.00 68.15 67.03 2dlv h THR 33 CO -0.36 0.00 -0.38 0.54 0.37 0.00 0.00 175.52 175.69 2dlv n ARG 34 N -5.36 -0.23 -0.30 6.66 1.74 -0.87 0.12 116.66 118.42 2dlv n ARG 34 Ca -0.02 1.44 0.11 0.00 -0.77 0.00 0.00 57.85 58.61 2dlv n ARG 34 Cb 0.28 -2.14 0.28 0.00 -1.02 0.00 0.00 32.46 29.85 2dlv n ARG 34 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2dlv h PHE 35 N 0.00 0.60 -0.06 -1.55 3.57 -1.39 -1.14 116.94 116.96 2dlv h PHE 35 Ca 0.31 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.79 2dlv h PHE 35 Cb 0.55 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.16 2dlv h PHE 35 CO -0.83 -0.02 -0.21 -0.07 -2.23 0.00 0.00 178.31 174.95 2dlv h LEU 36 N 0.41 0.29 -0.99 0.59 3.38 0.95 -3.22 115.31 116.72 2dlv h LEU 36 Ca 0.53 -0.62 0.35 0.00 0.09 0.00 0.00 57.88 58.23 2dlv h LEU 36 Cb 0.95 -0.09 -0.17 0.00 0.09 0.00 0.00 40.66 41.45 2dlv h LEU 36 CO -0.51 0.86 0.43 0.11 0.09 0.00 0.00 178.44 179.42 2dlv h LYS 37 N -0.26 0.10 -0.42 1.13 1.57 0.74 1.42 116.57 120.86 2dlv h LYS 37 Ca -0.01 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 2dlv h LYS 37 Cb 0.84 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 2dlv h LYS 37 CO 0.04 0.07 -0.03 1.79 -0.57 0.00 0.00 179.45 180.75 2dlv h THR 38 N 0.11 1.24 -0.53 -0.16 1.35 -1.46 -2.17 112.91 111.28 2dlv h THR 38 Ca 0.75 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 2dlv h THR 38 Cb 1.81 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 2dlv h THR 38 CO -0.74 0.34 0.00 -0.62 -0.25 0.00 0.00 175.52 174.25 2dlv n GLU 39 N -4.22 2.50 -2.95 4.72 1.02 0.45 -4.91 120.64 117.26 2dlv n GLU 39 Ca 0.02 -2.01 -0.19 0.00 -0.02 0.00 0.00 57.16 54.96 2dlv n GLU 39 Cb 0.30 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 2dlv n GLU 39 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2dlv n PHE 40 N 1.00 -1.67 0.14 -0.32 3.72 0.80 -4.81 117.46 116.32 2dlv n PHE 40 Ca 0.19 0.29 0.07 0.00 -0.05 0.00 0.00 57.45 57.95 2dlv n PHE 40 Cb 0.53 -3.13 -0.10 0.00 -0.94 0.00 0.00 39.48 35.85 2dlv n PHE 40 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2dlv n SER 41 N -2.14 1.64 -0.32 4.37 2.88 -0.84 -4.58 113.62 114.64 2dlv n SER 41 Ca -0.08 -0.19 0.23 0.00 -1.33 0.00 0.00 58.87 57.50 2dlv n SER 41 Cb 0.58 1.47 0.44 0.00 -0.75 0.00 0.00 64.21 65.95 2dlv n SER 41 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2dlv n GLU 42 N -1.81 -0.07 -0.40 -1.46 -0.00 -1.24 0.09 120.64 115.76 2dlv n GLU 42 Ca -0.01 1.36 0.31 0.00 -0.00 0.00 0.00 57.16 58.83 2dlv n GLU 42 Cb 0.31 -2.32 0.50 0.00 -0.00 0.00 0.00 31.44 29.94 2dlv n GLU 42 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 2dlv n GLU 43 N -5.27 -0.01 0.39 3.44 0.28 -1.26 0.11 120.64 118.31 2dlv n GLU 43 Ca 0.30 0.79 -0.17 0.00 -0.16 0.00 0.00 57.16 57.93 2dlv n GLU 43 Cb 1.01 -1.68 -0.08 0.00 1.43 0.00 0.00 31.44 32.12 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 -0.85 0.01 -1.84 2.35 -0.65 -2.97 115.58 111.64 2dlv h ASN 44 Ca 0.62 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.37 2dlv h ASN 44 Cb 2.22 0.22 -0.00 0.00 0.05 0.00 0.00 38.32 40.81 2dlv h ASN 44 CO -0.17 -0.51 -0.01 -0.29 -1.65 0.00 0.00 177.43 174.80 2dlv h ILE 45 N -1.17 0.99 -0.64 2.81 6.09 0.57 -2.35 117.51 123.81 2dlv h ILE 45 Ca -0.10 -0.03 0.10 0.00 -1.37 0.00 0.00 64.86 63.45 2dlv h ILE 45 Cb 0.79 1.02 -0.07 0.00 0.47 0.00 0.00 36.82 39.02 2dlv h ILE 45 CO 0.17 0.01 0.26 -0.33 -3.07 0.00 0.00 178.15 175.19 2dlv h GLU 46 N 0.00 0.44 -0.15 2.19 4.39 -1.12 -1.43 114.58 118.90 2dlv h GLU 46 Ca -0.00 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 2dlv h GLU 46 Cb 0.02 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.57 2dlv h GLU 46 CO 0.00 0.29 -0.08 0.35 -1.16 0.00 0.00 179.01 178.41 2dlv h PHE 47 N 0.45 0.37 -0.97 4.33 3.04 -1.34 -2.53 116.94 120.28 2dlv h PHE 47 Ca 0.32 -0.09 0.21 0.00 3.98 0.00 0.00 57.97 62.38 2dlv h PHE 47 Cb 0.39 -0.08 -0.09 0.00 2.56 0.00 0.00 35.95 38.73 2dlv h PHE 47 CO -0.15 0.65 0.62 2.35 -2.02 0.00 0.00 178.31 179.75 2dlv h TRP 48 N -0.02 0.81 0.23 0.41 7.01 -1.30 -2.04 115.95 121.05 2dlv h TRP 48 Ca 0.03 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 2dlv h TRP 48 Cb 0.56 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.37 2dlv h TRP 48 CO 0.07 0.18 -0.11 0.82 -2.79 0.00 0.00 178.44 176.61 2dlv h ILE 49 N 0.58 0.71 -1.23 2.65 2.04 -1.17 -3.19 117.51 117.90 2dlv h ILE 49 Ca 0.54 -0.93 0.40 0.00 1.00 0.00 0.00 64.86 65.87 2dlv h ILE 49 Cb 1.09 1.15 -0.13 0.00 -0.74 0.00 0.00 36.82 38.19 2dlv h ILE 49 CO -0.29 0.17 0.78 0.00 0.00 0.00 0.00 178.15 178.81 2dlv h ALA 50 N -0.37 2.56 0.90 1.87 0.00 -0.95 -0.12 119.26 123.15 2dlv h ALA 50 Ca -0.03 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2dlv h ALA 50 Cb 0.51 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.49 2dlv h ALA 50 CO 0.05 -1.16 -0.43 0.00 0.00 0.00 0.00 179.25 177.71 2dlv h GLU 52 N -1.24 0.22 0.10 0.00 4.39 -1.04 0.68 114.58 117.68 2dlv h GLU 52 Ca -0.12 -0.01 -0.28 0.00 0.34 0.00 0.00 59.36 59.28 2dlv h GLU 52 Cb 0.92 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.51 2dlv h GLU 52 CO 0.20 0.15 -1.36 0.22 -1.16 0.00 0.00 179.01 177.06 2dlv h ASP 53 N 0.23 0.32 -0.42 1.42 1.82 -1.19 -3.15 116.42 115.44 2dlv h ASP 53 Ca 0.75 -0.39 0.02 0.00 -0.39 0.00 0.00 57.03 57.01 2dlv h ASP 53 Cb 2.02 -0.10 -0.03 0.00 0.68 0.00 0.00 39.33 41.90 2dlv h ASP 53 CO -0.48 1.32 0.24 0.15 -1.61 0.00 0.00 179.24 178.86 2dlv h PHE 54 N 0.06 0.45 -0.48 0.28 3.04 0.64 -2.48 116.94 118.45 2dlv h PHE 54 Ca -0.17 0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.69 2dlv h PHE 54 Cb 1.96 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 40.31 2dlv h PHE 54 CO 0.05 0.26 -0.12 1.57 -2.02 0.00 0.00 178.31 178.05 2dlv h LYS 55 N 0.49 0.89 -0.85 1.11 2.10 -1.23 -2.74 116.57 116.34 2dlv h LYS 55 Ca 0.17 -0.32 0.24 0.00 -2.00 0.00 0.00 60.65 58.74 2dlv h LYS 55 Cb 0.02 -0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 31.25 2dlv h LYS 55 CO -0.08 0.96 0.60 0.87 -2.00 0.00 0.00 179.45 179.80 2dlv h LYS 56 N 0.79 0.08 -6.82 0.07 1.57 -1.40 -3.42 116.57 107.44 2dlv h LYS 56 Ca 0.13 -0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.34 2dlv h LYS 56 Cb 0.64 -0.02 0.13 0.00 0.08 0.00 0.00 32.23 33.07 2dlv h LYS 56 CO 0.04 0.05 0.38 0.43 -0.57 0.00 0.00 179.45 179.78 2dlv n SER 57 N -4.33 2.00 -4.14 0.86 7.64 -1.03 -4.98 113.62 109.63 2dlv n SER 57 Ca 0.18 1.02 -0.34 0.00 1.01 0.00 0.00 58.87 60.73 2dlv n SER 57 Cb 0.87 -1.46 -0.14 0.00 -1.01 0.00 0.00 64.21 62.47 2dlv n SER 57 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2dlv s LYS 58 N -2.36 2.24 0.00 1.43 2.36 -1.26 -4.98 119.74 117.16 2dlv s LYS 58 Ca 0.66 -1.44 0.00 0.00 -2.55 0.00 0.00 55.97 52.64 2dlv s LYS 58 Cb -0.49 -3.23 0.00 0.00 -1.05 0.00 0.00 37.83 33.06 2dlv s LYS 58 CO 0.55 -0.73 0.00 0.41 1.55 0.00 0.00 175.35 177.12 2dlv n GLY 59 N 4.56 3.04 0.08 5.54 0.00 -1.26 -4.83 105.19 112.32 2dlv n GLY 59 Ca -0.09 -2.01 -0.13 0.00 0.00 0.00 0.00 46.02 43.78 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 0.00 1.61 0.13 -1.97 -3.22 132.00 128.48 2dlv h PRO 60 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2dlv h PRO 60 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 2dlv h PRO 60 CO 0.00 0.39 0.00 0.94 -0.23 0.00 0.00 178.00 179.10 2dlv n GLN 61 N -4.90 0.00 -0.28 0.86 0.00 -1.26 -0.67 117.38 111.13 2dlv n GLN 61 Ca -0.08 0.90 -0.02 0.00 -0.00 0.00 0.00 57.00 57.80 2dlv n GLN 61 Cb 0.25 -1.37 0.04 0.00 0.00 0.00 0.00 30.24 29.17 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 -0.07 -0.37 3.69 5.75 -1.88 0.21 115.11 122.44 2dlv h GLN 62 Ca 0.00 0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.58 2dlv h GLN 62 Cb 0.00 0.01 -0.09 0.00 1.07 0.00 0.00 27.48 28.48 2dlv h GLN 62 CO 0.00 -0.04 -0.31 0.82 -2.65 0.00 0.00 178.83 176.64 2dlv h ILE 63 N -0.07 0.25 -0.37 2.39 2.04 -0.94 -1.30 117.51 119.51 2dlv h ILE 63 Ca 0.31 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.25 2dlv h ILE 63 Cb 0.58 0.25 -0.08 0.00 -0.74 0.00 0.00 36.82 36.83 2dlv h ILE 63 CO -0.82 0.00 -0.17 0.45 0.00 0.00 0.00 178.15 177.60 2dlv h HIS 64 N -0.25 -0.43 0.07 1.37 3.86 0.11 0.56 115.15 120.45 2dlv h HIS 64 Ca 0.17 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 2dlv h HIS 64 Cb 0.53 0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.23 2dlv h HIS 64 CO -0.51 -0.25 -0.16 -0.07 0.86 0.00 0.00 177.93 177.80 2dlv h LEU 65 N -0.11 -0.46 0.23 2.43 3.38 -0.46 -1.16 115.31 119.16 2dlv h LEU 65 Ca 0.18 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.21 2dlv h LEU 65 Cb 0.39 0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2dlv h LEU 65 CO -0.44 -0.18 -0.44 0.11 0.09 0.00 0.00 178.44 177.59 2dlv h LYS 66 N -0.25 -0.72 -0.94 1.13 1.57 -1.09 -1.96 116.57 114.30 2dlv h LYS 66 Ca -0.01 0.05 0.29 0.00 -1.87 0.00 0.00 60.65 59.11 2dlv h LYS 66 Cb 0.24 0.16 -0.17 0.00 0.08 0.00 0.00 32.23 32.54 2dlv h LYS 66 CO -0.06 -0.48 0.12 0.00 -0.57 0.00 0.00 179.45 178.45 2dlv n ALA 67 N -2.81 0.58 0.16 3.86 0.00 0.19 0.19 120.51 122.68 2dlv n ALA 67 Ca -0.09 1.00 -0.14 0.00 0.00 0.00 0.00 53.44 54.21 2dlv n ALA 67 Cb 0.40 -0.78 -0.08 0.00 0.00 0.00 0.00 19.45 18.98 2dlv n ALA 67 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2dlv h LYS 68 N 0.00 -0.35 0.66 0.00 3.64 -0.46 -0.19 116.57 119.87 2dlv h LYS 68 Ca 0.62 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.99 2dlv h LYS 68 Cb 1.37 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.27 2dlv h LYS 68 CO -0.85 -0.13 -0.38 0.00 -2.27 0.00 0.00 179.45 175.81 2dlv h ALA 69 N 0.19 -1.22 -1.00 5.00 0.00 0.25 -1.46 119.26 121.01 2dlv h ALA 69 Ca -0.04 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.89 2dlv h ALA 69 Cb 0.37 0.47 -0.12 0.00 0.00 0.00 0.00 17.79 18.51 2dlv h ALA 69 CO 0.06 -1.17 0.60 0.82 0.00 0.00 0.00 179.25 179.56 2dlv h ILE 70 N -0.96 0.62 0.33 0.00 2.04 -0.72 0.29 117.51 119.10 2dlv h ILE 70 Ca -0.09 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 2dlv h ILE 70 Cb 0.76 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2dlv h ILE 70 CO 0.11 0.12 -0.17 0.22 0.00 0.00 0.00 178.15 178.43 2dlv h TYR 71 N 0.67 -0.44 0.00 1.37 3.20 -0.76 0.14 116.97 121.14 2dlv h TYR 71 Ca 0.61 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.48 2dlv h TYR 71 Cb 1.07 0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.49 2dlv h TYR 71 CO -0.01 -0.27 0.00 0.39 -1.64 0.00 0.00 178.16 176.64 2dlv n GLU 72 N -3.27 0.31 -0.05 1.82 1.02 -0.57 -0.75 120.64 119.14 2dlv n GLU 72 Ca -0.06 0.04 -0.04 0.00 -0.02 0.00 0.00 57.16 57.08 2dlv n GLU 72 Cb 0.18 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 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 -1.06 0.34 -0.04 3.49 4.81 0.99 -4.37 118.16 122.32 2dlv n LYS 73 Ca 0.08 0.38 -0.05 0.00 -0.87 0.00 0.00 58.31 57.84 2dlv n LYS 73 Cb 0.05 -1.37 -0.02 0.00 0.02 0.00 0.00 35.03 33.71 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 -3.95 0.00 0.00 5.64 3.01 0.42 -2.27 117.46 120.31 2dlv n PHE 74 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.40 2dlv n PHE 74 Cb 0.24 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 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 -3.68 0.00 -1.08 4.37 2.08 -0.88 -3.11 119.36 117.05 2dlv n ILE 75 Ca -0.07 0.87 -0.34 0.00 0.56 0.00 0.00 62.75 63.76 2dlv n ILE 75 Cb 0.28 -1.17 0.11 0.00 -0.75 0.00 0.00 39.64 38.11 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 -2.40 0.12 -0.03 0.38 10.64 0.08 -4.75 117.38 121.41 2dlv n GLN 76 Ca 0.00 0.10 -0.09 0.00 -1.83 0.00 0.00 57.00 55.18 2dlv n GLN 76 Cb 0.00 -2.14 -0.14 0.00 -0.86 0.00 0.00 30.24 27.09 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 -3.10 1.60 0.77 -0.39 -1.04 -1.26 -3.95 114.28 106.90 2dlv n THR 77 Ca 0.11 -0.80 0.00 0.00 -2.04 0.00 0.00 64.05 61.33 2dlv n THR 77 Cb 0.51 -1.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 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 -3.04 0.52 -4.83 8.00 2.03 -1.26 -4.76 116.55 113.21 2dlv n ASP 78 Ca -0.19 -1.28 -0.24 0.00 0.52 0.00 0.00 54.79 53.60 2dlv n ASP 78 Cb 1.06 -0.26 -0.05 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 3.64 0.14 -1.67 0.00 -1.25 -5.04 121.76 116.38 2dlv s ALA 79 Ca 0.00 -1.26 -0.11 0.00 0.00 0.00 0.00 51.96 50.58 2dlv s ALA 79 Cb 0.00 -1.41 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 2dlv s ALA 79 CO 0.00 0.41 1.47 -1.00 0.00 0.00 0.00 175.76 176.64 2dlv h PRO 80 N 2.01 0.91 -0.65 0.00 0.13 -1.85 -3.01 132.00 129.55 2dlv h PRO 80 Ca -0.48 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.16 2dlv h PRO 80 Cb 1.21 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2dlv h PRO 80 CO 0.63 1.13 0.00 1.63 -0.23 0.00 0.00 178.00 181.16 2dlv n LYS 81 N -4.09 3.73 -1.68 0.86 4.76 -1.20 -4.97 118.16 115.57 2dlv n LYS 81 Ca -0.02 -2.41 -0.52 0.00 -2.87 0.00 0.00 58.31 52.49 2dlv n LYS 81 Cb 0.54 -1.97 -0.06 0.00 -1.84 0.00 0.00 35.03 31.70 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 0.65 1.72 -3.45 1.97 -0.00 -0.96 -4.33 120.64 116.24 2dlv n GLU 82 Ca 0.21 0.63 -0.22 0.00 -0.00 0.00 0.00 57.16 57.78 2dlv n GLU 82 Cb 0.89 -2.39 0.01 0.00 -0.00 0.00 0.00 31.44 29.96 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 3.28 2.12 -0.61 3.84 -7.23 -1.18 -4.99 120.40 115.63 2dlv s VAL 83 Ca 0.93 -1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 59.58 2dlv s VAL 83 Cb -0.85 -2.37 0.04 0.00 0.56 0.00 0.00 36.38 33.76 2dlv s VAL 83 CO 0.55 0.00 1.13 0.54 -0.31 0.00 0.00 175.10 177.01 2dlv s ASN 84 N -4.40 6.34 0.06 4.85 2.20 -1.26 -4.88 114.94 117.85 2dlv s ASN 84 Ca 0.48 -0.19 0.07 0.00 -0.94 0.00 0.00 52.86 52.28 2dlv s ASN 84 Cb -0.04 -2.52 -0.03 0.00 -2.00 0.00 0.00 41.25 36.66 2dlv s ASN 84 CO 0.30 -1.49 -0.19 -0.76 -2.94 0.00 0.00 177.10 172.02 2dlv s LEU 85 N 4.81 2.21 0.44 3.54 1.43 -1.26 -4.80 118.68 125.05 2dlv s LEU 85 Ca 0.37 -0.56 -0.25 0.00 -1.03 0.00 0.00 54.13 52.66 2dlv s LEU 85 Cb -0.09 -0.83 -0.09 0.00 0.03 0.00 0.00 46.19 45.21 2dlv s LEU 85 CO 0.21 0.08 1.35 -0.67 0.23 0.00 0.00 176.35 177.55 2dlv n ASP 86 N 1.60 2.92 -0.05 2.29 2.03 -1.26 -4.83 116.55 119.24 2dlv n ASP 86 Ca -0.18 1.11 -0.09 0.00 0.52 0.00 0.00 54.79 56.15 2dlv n ASP 86 Cb 0.54 -1.55 -0.03 0.00 -0.72 0.00 0.00 41.12 39.36 2dlv n ASP 86 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2dlv h PHE 87 N 2.17 -0.86 0.29 -0.67 3.04 -1.99 -1.35 116.94 117.57 2dlv h PHE 87 Ca -0.49 0.05 -0.00 0.00 3.98 0.00 0.00 57.97 61.50 2dlv h PHE 87 Cb 1.28 0.41 -0.03 0.00 2.56 0.00 0.00 35.95 40.18 2dlv h PHE 87 CO 0.49 -0.38 -0.43 1.25 -2.02 0.00 0.00 178.31 177.22 2dlv h HIS 88 N -0.32 -1.20 -0.97 0.41 2.76 -1.99 -0.10 115.15 113.74 2dlv h HIS 88 Ca 0.13 0.02 0.32 0.00 -2.20 0.00 0.00 60.37 58.64 2dlv h HIS 88 Cb 0.53 0.49 -0.16 0.00 1.55 0.00 0.00 27.41 29.82 2dlv h HIS 88 CO -0.46 -0.53 0.39 1.15 -1.30 0.00 0.00 177.93 177.19 2dlv h THR 89 N -0.75 0.17 0.13 6.26 2.02 -1.87 0.29 112.91 119.17 2dlv h THR 89 Ca -0.03 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 2dlv h THR 89 Cb 0.68 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2dlv h THR 89 CO -0.13 0.03 -0.06 0.11 0.37 0.00 0.00 175.52 175.84 2dlv h LYS 90 N 0.16 -0.17 -0.15 6.66 1.57 -0.52 -2.59 116.57 121.54 2dlv h LYS 90 Ca 0.70 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.53 2dlv h LYS 90 Cb 1.63 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.95 2dlv h LYS 90 CO -0.72 0.15 -0.05 1.49 -0.57 0.00 0.00 179.45 179.75 2dlv h GLU 91 N -0.50 -0.03 -0.77 3.15 4.81 0.12 0.10 114.58 121.45 2dlv h GLU 91 Ca -0.02 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.36 2dlv h GLU 91 Cb 0.40 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 29.69 2dlv h GLU 91 CO 0.03 -0.02 0.33 0.28 -0.73 0.00 0.00 179.01 178.90 2dlv h VAL 92 N -0.03 0.67 -0.33 0.32 2.07 -0.61 -1.06 116.25 117.28 2dlv h VAL 92 Ca 0.08 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.34 2dlv h VAL 92 Cb 0.14 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 2dlv h VAL 92 CO -0.17 0.09 -0.16 0.40 0.02 0.00 0.00 177.57 177.74 2dlv h ILE 93 N 0.48 1.29 -0.86 4.57 2.04 -0.99 0.67 117.51 124.70 2dlv h ILE 93 Ca 0.43 -1.28 0.11 0.00 1.00 0.00 0.00 64.86 65.12 2dlv h ILE 93 Cb 0.64 1.41 -0.08 0.00 -0.74 0.00 0.00 36.82 38.04 2dlv h ILE 93 CO -0.40 0.41 0.49 0.74 0.00 0.00 0.00 178.15 179.40 2dlv h THR 94 N 0.47 0.86 0.05 -0.27 2.02 0.22 0.80 112.91 117.05 2dlv h THR 94 Ca 0.07 -0.27 -0.30 0.00 0.77 0.00 0.00 66.41 66.69 2dlv h THR 94 Cb 0.70 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2dlv h THR 94 CO 0.05 0.14 -1.62 0.78 0.37 0.00 0.00 175.52 175.24 2dlv h ASN 95 N 0.77 0.16 -0.34 4.18 2.35 -1.21 -3.31 115.58 118.17 2dlv h ASN 95 Ca 0.43 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2dlv h ASN 95 Cb 0.46 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2dlv h ASN 95 CO -0.28 1.24 0.00 -0.24 -1.65 0.00 0.00 177.43 176.50 2dlv n SER 96 N -3.25 3.40 0.00 5.81 2.88 0.23 -4.11 113.62 118.59 2dlv n SER 96 Ca -0.17 -2.43 0.09 0.00 -1.33 0.00 0.00 58.87 55.04 2dlv n SER 96 Cb 1.03 -0.54 0.42 0.00 -0.75 0.00 0.00 64.21 64.37 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 0.42 0.66 0.01 2.46 0.13 0.27 -1.65 119.36 121.66 2dlv n ILE 97 Ca 0.15 0.16 0.08 0.00 -1.10 0.00 0.00 62.75 62.05 2dlv n ILE 97 Cb 0.70 -0.83 -0.13 0.00 -0.84 0.00 0.00 39.64 38.55 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 -1.49 0.00 -1.43 9.51 5.66 -1.26 -4.45 114.28 120.82 2dlv n THR 98 Ca 0.05 -0.37 0.05 0.00 -3.05 0.00 0.00 64.05 60.73 2dlv n THR 98 Cb 0.22 0.15 0.20 0.00 -1.55 0.00 0.00 70.33 69.35 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 -2.05 1.65 -2.23 1.09 6.02 -1.08 -5.05 117.38 115.74 2dlv n GLN 99 Ca -0.03 -3.11 -0.41 0.00 -0.01 0.00 0.00 57.00 53.43 2dlv n GLN 99 Cb 0.42 -1.65 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 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 -3.15 4.41 0.50 -1.09 0.04 -0.66 -5.04 135.00 130.01 2dlv s PRO 100 Ca 0.38 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.54 2dlv s PRO 100 Cb 0.36 -3.18 0.02 0.00 0.04 0.00 0.00 34.50 31.74 2dlv s PRO 100 CO -0.03 -0.21 0.45 0.95 0.04 0.00 0.00 177.00 178.21 2dlv s THR 101 N -0.11 2.09 0.61 1.26 -4.23 -1.26 -4.85 115.64 109.15 2dlv s THR 101 Ca 0.55 -1.37 0.31 0.00 -1.18 0.00 0.00 61.69 60.00 2dlv s THR 101 Cb -0.36 -2.46 0.36 0.00 1.34 0.00 0.00 72.50 71.38 2dlv s THR 101 CO 0.40 0.00 2.12 -0.07 -0.54 0.00 0.00 174.62 176.53 2dlv h LEU 102 N 0.77 0.00 -3.31 4.79 3.38 -1.95 0.31 115.31 119.31 2dlv h LEU 102 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2dlv h LEU 102 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2dlv h LEU 102 CO 0.55 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.08 2dlv n HIS 103 N -3.61 1.40 0.46 1.13 1.44 -1.26 -4.52 115.22 110.27 2dlv n HIS 103 Ca 0.00 -0.74 -0.18 0.00 -2.01 0.00 0.00 57.72 54.79 2dlv n HIS 103 Cb 0.29 -0.34 -0.09 0.00 0.12 0.00 0.00 29.99 29.97 2dlv n HIS 103 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2dlv h SER 104 N 3.04 -0.99 0.53 4.39 4.64 -0.73 -3.04 113.55 121.39 2dlv h SER 104 Ca 0.00 0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.29 2dlv h SER 104 Cb 1.57 0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 63.91 2dlv h SER 104 CO 0.30 -0.67 -0.29 -0.26 -0.87 0.00 0.00 176.83 175.03 2dlv h PHE 105 N -1.24 0.00 -0.65 4.77 0.04 -1.82 -3.22 116.94 114.82 2dlv h PHE 105 Ca -0.12 0.00 0.21 0.00 2.80 0.00 0.00 57.97 60.86 2dlv h PHE 105 Cb 0.90 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.93 2dlv h PHE 105 CO 0.02 0.29 0.13 -3.47 -0.60 0.00 0.00 178.31 174.68 2dlv n ASP 106 N -3.78 0.03 0.10 2.17 -0.08 -1.15 0.11 116.55 113.96 2dlv n ASP 106 Ca -0.01 1.09 -0.12 0.00 -1.51 0.00 0.00 54.79 54.24 2dlv n ASP 106 Cb 0.39 -0.44 -0.08 0.00 2.34 0.00 0.00 41.12 43.32 2dlv n ASP 106 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2dlv h ALA 107 N 1.30 -0.30 -0.82 -1.67 0.00 -1.69 -3.16 119.26 112.91 2dlv h ALA 107 Ca 0.45 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.27 2dlv h ALA 107 Cb 1.03 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 2dlv h ALA 107 CO -0.57 -0.45 0.45 0.00 0.00 0.00 0.00 179.25 178.68 2dlv h ALA 108 N -0.14 1.20 -0.80 0.00 0.00 0.59 -1.28 119.26 118.83 2dlv h ALA 108 Ca -0.03 0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.09 2dlv h ALA 108 Cb 0.50 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 2dlv h ALA 108 CO 0.05 0.01 0.36 0.37 0.00 0.00 0.00 179.25 180.03 2dlv h GLN 109 N 0.70 0.48 -0.73 0.00 4.15 -0.52 -0.89 115.11 118.32 2dlv h GLN 109 Ca 0.42 -0.03 0.16 0.00 0.77 0.00 0.00 58.65 59.97 2dlv h GLN 109 Cb 0.48 -0.11 -0.12 0.00 0.21 0.00 0.00 27.48 27.95 2dlv h GLN 109 CO -0.30 0.32 0.09 1.03 -1.93 0.00 0.00 178.83 178.05 2dlv h SER 110 N 0.50 -0.16 0.64 -0.69 0.87 -1.19 0.20 113.55 113.72 2dlv h SER 110 Ca 0.45 0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 61.14 2dlv h SER 110 Cb 0.68 0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.90 2dlv h SER 110 CO -0.40 -0.11 -0.39 0.03 -0.53 0.00 0.00 176.83 175.43 2dlv h ARG 111 N 0.18 -0.93 -0.38 2.24 2.47 -1.22 -2.44 114.38 114.30 2dlv h ARG 111 Ca 0.40 0.06 0.08 0.00 -1.26 0.00 0.00 59.98 59.27 2dlv h ARG 111 Cb 0.70 0.21 -0.08 0.00 -1.65 0.00 0.00 29.97 29.15 2dlv h ARG 111 CO -0.57 -0.62 -0.16 0.28 0.56 0.00 0.00 179.97 179.46 2dlv h VAL 112 N -0.96 0.49 -0.85 2.04 2.07 -1.29 0.25 116.25 117.99 2dlv h VAL 112 Ca -0.09 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.65 2dlv h VAL 112 Cb 0.77 0.49 -0.14 0.00 -1.52 0.00 0.00 31.29 30.89 2dlv h VAL 112 CO 0.09 0.00 0.16 0.22 0.02 0.00 0.00 177.57 178.05 2dlv h TYR 113 N -0.09 0.21 0.04 1.57 3.20 -0.54 0.04 116.97 121.40 2dlv h TYR 113 Ca 0.19 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 2dlv h TYR 113 Cb 0.38 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.69 2dlv h TYR 113 CO -0.40 -0.24 -0.02 1.96 -1.64 0.00 0.00 178.16 177.83 2dlv h GLN 114 N 0.16 -0.05 -1.12 1.82 4.20 -0.71 -2.74 115.11 116.67 2dlv h GLN 114 Ca 0.52 0.00 0.36 0.00 0.06 0.00 0.00 58.65 59.60 2dlv h GLN 114 Cb 1.02 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 28.67 2dlv h GLN 114 CO -0.68 0.61 0.68 -0.07 -0.67 0.00 0.00 178.83 178.70 2dlv h LEU 115 N -0.83 0.39 0.01 1.46 3.38 0.42 -0.13 115.31 120.01 2dlv h LEU 115 Ca -0.01 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2dlv h LEU 115 Cb 0.68 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2dlv h LEU 115 CO 0.01 -0.15 -0.01 0.24 0.09 0.00 0.00 178.44 178.62 2dlv h MET 116 N 0.22 -0.02 -1.57 1.13 2.86 -1.08 -3.29 114.93 113.18 2dlv h MET 116 Ca 0.76 0.00 0.45 0.00 -2.06 0.00 0.00 59.70 58.85 2dlv h MET 116 Cb 2.03 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 33.64 2dlv h MET 116 CO -0.51 -0.01 1.24 -1.91 1.06 0.00 0.00 176.91 176.78 2dlv n GLU 117 N -2.20 0.00 0.00 1.72 2.13 -0.94 -0.80 120.64 120.56 2dlv n GLU 117 Ca -0.00 0.96 0.00 0.00 0.66 0.00 0.00 57.16 58.78 2dlv n GLU 117 Cb 0.01 -2.27 0.00 0.00 0.27 0.00 0.00 31.44 29.45 2dlv n GLU 117 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2dlv n GLN 118 N -3.55 0.00 -0.01 5.31 1.13 -0.10 -3.60 117.38 116.56 2dlv n GLN 118 Ca 0.35 0.94 -0.01 0.00 -1.94 0.00 0.00 57.00 56.34 2dlv n GLN 118 Cb 1.71 -1.49 -0.01 0.00 0.11 0.00 0.00 30.24 30.56 2dlv n GLN 118 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2dlv n ASP 119 N -2.87 4.18 -0.16 1.08 2.03 -0.61 -4.45 116.55 115.76 2dlv n ASP 119 Ca 0.00 -0.01 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 2dlv n ASP 119 Cb 0.00 0.29 0.05 0.00 -0.72 0.00 0.00 41.12 40.74 2dlv n ASP 119 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2dlv h SER 120 N 0.00 -0.34 0.19 1.67 4.64 -1.15 0.56 113.55 119.13 2dlv h SER 120 Ca -0.06 0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2dlv h SER 120 Cb 1.11 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2dlv h SER 120 CO -0.00 -0.12 -0.09 0.22 -0.87 0.00 0.00 176.83 175.96 2dlv h TYR 121 N 0.05 -0.24 -0.86 4.77 3.20 -1.62 0.25 116.97 122.52 2dlv h TYR 121 Ca 0.24 -0.01 0.22 0.00 3.14 0.00 0.00 58.73 62.33 2dlv h TYR 121 Cb 0.37 0.08 -0.15 0.00 1.54 0.00 0.00 36.73 38.57 2dlv h TYR 121 CO -0.37 -0.15 0.07 1.79 -1.64 0.00 0.00 178.16 177.87 2dlv h THR 122 N -0.43 0.23 0.00 1.81 1.35 -1.60 -0.29 112.91 113.99 2dlv h THR 122 Ca -0.03 -0.04 -0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2dlv h THR 122 Cb 0.20 0.12 0.00 0.00 -1.73 0.00 0.00 68.15 66.74 2dlv h THR 122 CO 0.04 0.02 -0.00 -0.09 -0.25 0.00 0.00 175.52 175.24 2dlv h ARG 123 N 0.10 -0.01 -0.99 4.72 2.43 0.06 -3.17 114.38 117.53 2dlv h ARG 123 Ca 0.51 0.00 0.36 0.00 -0.81 0.00 0.00 59.98 60.04 2dlv h ARG 123 Cb 0.99 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 30.37 2dlv h ARG 123 CO -0.74 0.48 0.50 0.35 -1.51 0.00 0.00 179.97 179.05 2dlv h PHE 124 N -0.50 0.78 -0.75 2.20 3.57 0.12 1.28 116.94 123.65 2dlv h PHE 124 Ca -0.00 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.60 2dlv h PHE 124 Cb 0.49 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 2dlv h PHE 124 CO 0.10 -0.33 0.49 -0.07 -2.23 0.00 0.00 178.31 176.27 2dlv h LEU 125 N 0.15 0.71 -3.29 0.59 3.38 -1.31 -0.27 115.31 115.28 2dlv h LEU 125 Ca 0.76 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.74 2dlv h LEU 125 Cb 1.86 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.46 2dlv h LEU 125 CO -0.70 0.46 0.00 2.29 0.09 0.00 0.00 178.44 180.58 2dlv n LYS 126 N -4.48 4.08 -3.32 1.13 2.85 0.42 -4.79 118.16 114.06 2dlv n LYS 126 Ca 0.11 -2.97 -0.37 0.00 -1.05 0.00 0.00 58.31 54.02 2dlv n LYS 126 Cb 0.21 -2.01 -0.06 0.00 -0.65 0.00 0.00 35.03 32.52 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 -0.93 6.96 0.17 -5.58 1.04 -0.11 -4.99 113.70 110.26 2dlv s SER 127 Ca 0.51 1.18 -0.14 0.00 0.48 0.00 0.00 55.95 57.98 2dlv s SER 127 Cb 0.36 -2.33 0.11 0.00 0.10 0.00 0.00 66.02 64.26 2dlv s SER 127 CO 0.21 0.22 1.78 -0.78 0.98 0.00 0.00 173.24 175.65 2dlv h ASP 128 N 4.20 0.33 -0.53 7.02 1.82 -1.92 -2.31 116.42 125.03 2dlv h ASP 128 Ca -0.49 0.03 0.10 0.00 -0.39 0.00 0.00 57.03 56.27 2dlv h ASP 128 Cb 1.21 -0.03 -0.11 0.00 0.68 0.00 0.00 39.33 41.08 2dlv h ASP 128 CO 0.64 0.23 -0.25 0.40 -1.61 0.00 0.00 179.24 178.65 2dlv h ILE 129 N 0.45 0.28 -0.09 2.25 2.04 -1.94 0.80 117.51 121.30 2dlv h ILE 129 Ca 0.20 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.07 2dlv h ILE 129 Cb 0.11 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2dlv h ILE 129 CO -0.14 0.00 0.04 0.22 0.00 0.00 0.00 178.15 178.26 2dlv h TYR 130 N -0.13 0.07 0.00 1.37 3.20 -1.70 0.54 116.97 120.32 2dlv h TYR 130 Ca 0.24 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.09 2dlv h TYR 130 Cb 0.50 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 2dlv h TYR 130 CO -0.54 0.04 -0.12 -0.07 -1.64 0.00 0.00 178.16 175.82 2dlv h LEU 131 N 0.09 0.00 0.20 2.82 3.38 -0.70 -2.93 115.31 118.17 2dlv h LEU 131 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2dlv h LEU 131 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2dlv h LEU 131 CO -0.03 0.12 -0.10 -0.78 0.09 0.00 0.00 178.44 177.74 2dlv h ASP 132 N 0.00 -0.23 -1.25 -0.43 3.58 0.14 0.19 116.42 118.42 2dlv h ASP 132 Ca -0.00 -0.03 0.40 0.00 0.42 0.00 0.00 57.03 57.81 2dlv h ASP 132 Cb 0.28 0.06 -0.12 0.00 1.72 0.00 0.00 39.33 41.27 2dlv h ASP 132 CO 0.02 0.25 0.80 0.17 -2.88 0.00 0.00 179.24 177.59 2dlv h LEU 133 N -1.06 0.29 0.04 2.28 8.10 -0.87 0.59 115.31 124.68 2dlv h LEU 133 Ca -0.03 0.13 -0.31 0.00 0.11 0.00 0.00 57.88 57.79 2dlv h LEU 133 Cb 0.25 0.11 -0.04 0.00 -0.44 0.00 0.00 40.66 40.55 2dlv h LEU 133 CO 0.05 -0.14 -1.73 0.00 -4.11 0.00 0.00 178.44 172.50 2dlv h MET 134 N 0.14 0.09 -6.70 0.17 -0.00 -1.59 -3.35 114.93 103.69 2dlv h MET 134 Ca 0.78 -0.16 -0.54 0.00 -0.00 0.00 0.00 59.70 59.78 2dlv h MET 134 Cb 2.34 0.06 -0.19 0.00 -0.00 0.00 0.00 31.60 33.81 2dlv h MET 134 CO -0.42 0.76 -0.83 -1.13 -0.00 0.00 0.00 176.91 175.29 2dlv n SER 135 N -3.21 -3.39 -1.52 -0.10 3.41 0.21 -4.80 113.62 104.21 2dlv n SER 135 Ca -0.20 -0.99 -0.03 0.00 -0.26 0.00 0.00 58.87 57.39 2dlv n SER 135 Cb 1.04 -2.87 -0.01 0.00 -0.26 0.00 0.00 64.21 62.11 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 -1.44 3.89 3.76 5.00 0.00 -1.25 -5.02 105.19 110.14 2dlv n GLY 136 Ca 0.07 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.23 2.06 0.26 1.61 0.04 -1.26 -5.02 135.00 130.47 2dlv s PRO 137 Ca 0.05 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.20 2dlv s PRO 137 Cb 0.00 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 2dlv s PRO 137 CO 0.04 -1.76 0.13 -1.12 0.04 0.00 0.00 177.00 174.32 2dlv s SER 138 N -3.40 1.11 0.28 6.66 0.01 -1.26 -5.06 113.70 112.03 2dlv s SER 138 Ca 0.62 -1.44 -0.20 0.00 1.31 0.00 0.00 55.95 56.23 2dlv s SER 138 Cb -0.17 0.28 -0.09 0.00 0.21 0.00 0.00 66.02 66.25 2dlv s SER 138 CO 0.56 -0.81 0.79 -0.94 0.41 0.00 0.00 173.24 173.26 2dlv s SER 139 N -3.30 7.04 0.00 2.44 1.04 -1.26 -5.28 113.70 114.38 2dlv s SER 139 Ca 0.37 1.50 0.00 0.00 0.48 0.00 0.00 55.95 58.30 2dlv s SER 139 Cb 0.07 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.74 2dlv s SER 139 CO 0.15 -0.08 0.16 0.61 0.98 0.00 0.00 173.24 175.06