#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlv n SER 2 N 0.00 -0.22 -4.75 1.61 2.88 -1.26 -4.26 113.62 107.62 2dlv n SER 2 Ca 0.00 1.39 -0.41 0.00 -1.33 0.00 0.00 58.87 58.52 2dlv n SER 2 Cb 0.00 -0.45 -0.03 0.00 -0.75 0.00 0.00 64.21 62.98 2dlv n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dlv s SER 3 N -5.14 6.86 0.00 -3.46 0.01 -1.26 -4.80 113.70 105.91 2dlv s SER 3 Ca -0.12 2.50 0.00 0.00 1.31 0.00 0.00 55.95 59.65 2dlv s SER 3 Cb 0.23 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2dlv s SER 3 CO 0.63 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 174.37 2dlv n GLY 4 N 1.88 -1.77 3.89 3.44 0.00 -1.26 -5.15 105.19 106.21 2dlv n GLY 4 Ca 0.04 0.68 -0.30 0.00 0.00 0.00 0.00 46.02 46.44 2dlv n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlv s SER 5 N 2.00 6.53 -0.15 1.61 0.15 -1.26 -5.02 113.70 117.55 2dlv s SER 5 Ca 0.00 0.92 -0.16 0.00 0.70 0.00 0.00 55.95 57.42 2dlv s SER 5 Cb 0.00 -2.23 -0.23 0.00 -1.71 0.00 0.00 66.02 61.84 2dlv s SER 5 CO 0.00 -0.23 0.36 0.28 1.20 0.00 0.00 173.24 174.85 2dlv h SER 6 N 1.78 0.22 -2.80 5.45 0.02 -2.01 -3.49 113.55 112.72 2dlv h SER 6 Ca -0.47 -0.74 0.10 0.00 -0.84 0.00 0.00 61.79 59.83 2dlv h SER 6 Cb 1.18 -0.07 -0.27 0.00 0.14 0.00 0.00 62.40 63.38 2dlv h SER 6 CO 0.66 1.63 0.46 -0.83 -1.14 0.00 0.00 176.83 177.61 2dlv s GLY 7 N -5.09 -0.03 0.02 -3.77 0.00 -1.26 -4.93 107.32 92.26 2dlv s GLY 7 Ca -0.24 2.97 0.07 0.00 0.00 0.00 0.00 44.72 47.51 2dlv s GLY 7 CO 0.69 2.19 -0.20 -0.56 0.00 0.00 0.00 173.10 175.22 2dlv s SER 8 N 0.71 2.42 0.00 1.64 0.01 -1.26 -4.89 113.70 112.33 2dlv s SER 8 Ca -0.02 -0.47 0.14 0.00 1.31 0.00 0.00 55.95 56.91 2dlv s SER 8 Cb -0.04 -0.22 0.65 0.00 0.21 0.00 0.00 66.02 66.62 2dlv s SER 8 CO -0.11 0.18 1.43 -0.81 0.41 0.00 0.00 173.24 174.35 2dlv n PRO 9 N 2.08 0.08 0.08 12.44 -0.04 -1.26 -2.42 135.00 145.96 2dlv n PRO 9 Ca -0.17 0.22 -0.12 0.00 -0.04 0.00 0.00 63.50 63.40 2dlv n PRO 9 Cb 0.53 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 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 0.26 0.00 0.54 4.57 -1.97 -3.07 114.58 114.91 2dlv h GLU 10 Ca 0.00 -0.32 -0.26 0.00 -1.18 0.00 0.00 59.36 57.60 2dlv h GLU 10 Cb 0.20 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.86 2dlv h GLU 10 CO 0.00 1.06 -1.42 -0.85 -1.18 0.00 0.00 179.01 176.62 2dlv n GLU 11 N -3.64 0.56 -0.30 1.92 0.28 -1.07 -4.24 120.64 114.16 2dlv n GLU 11 Ca -0.05 0.53 0.23 0.00 -0.16 0.00 0.00 57.16 57.70 2dlv n GLU 11 Cb 0.87 -1.70 0.53 0.00 1.43 0.00 0.00 31.44 32.57 2dlv n GLU 11 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2dlv h ALA 12 N -0.60 2.32 -0.69 -1.84 0.00 -1.64 0.31 119.26 117.12 2dlv h ALA 12 Ca -0.39 0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.62 2dlv h ALA 12 Cb 1.31 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 2dlv h ALA 12 CO -0.23 -0.68 0.45 -0.24 0.00 0.00 0.00 179.25 178.55 2dlv h VAL 13 N 0.36 1.04 0.17 0.00 3.04 -1.71 -2.56 116.25 116.59 2dlv h VAL 13 Ca 0.56 -0.25 -0.24 0.00 -1.01 0.00 0.00 66.70 65.75 2dlv h VAL 13 Cb 1.49 0.23 0.03 0.00 -2.01 0.00 0.00 31.29 31.03 2dlv h VAL 13 CO -0.23 0.14 -1.06 0.11 -1.01 0.00 0.00 177.57 175.51 2dlv h LYS 14 N 0.74 0.41 -0.80 4.17 1.57 -0.60 -3.33 116.57 118.73 2dlv h LYS 14 Ca 0.29 -0.68 0.21 0.00 -1.87 0.00 0.00 60.65 58.61 2dlv h LYS 14 Cb 0.21 0.25 -0.15 0.00 0.08 0.00 0.00 32.23 32.61 2dlv h LYS 14 CO -0.09 1.32 -0.01 0.91 -0.57 0.00 0.00 179.45 181.01 2dlv n TRP 15 N -3.97 0.49 -0.30 -1.35 8.01 -0.76 0.18 117.44 119.75 2dlv n TRP 15 Ca -0.15 0.97 0.04 0.00 -1.31 0.00 0.00 57.50 57.05 2dlv n TRP 15 Cb 0.92 -1.09 0.18 0.00 -2.01 0.00 0.00 31.31 29.31 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 1.31 -0.42 6.99 0.00 -1.66 -3.00 103.07 106.28 2dlv h GLY 16 Ca 0.48 -0.31 0.04 0.00 0.00 0.00 0.00 47.33 47.53 2dlv h GLY 16 CO -0.76 0.11 -0.25 1.18 0.00 0.00 0.00 176.54 176.82 2dlv n GLU 17 N -4.76 -0.19 -4.09 4.80 1.02 0.49 -4.54 120.64 113.38 2dlv n GLU 17 Ca 0.14 0.89 -0.13 0.00 -0.02 0.00 0.00 57.16 58.04 2dlv n GLU 17 Cb 0.30 -1.32 -0.11 0.00 -0.02 0.00 0.00 31.44 30.29 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 -4.46 0.98 0.34 1.62 1.04 -1.13 -5.04 113.70 107.05 2dlv s SER 18 Ca -0.05 -0.62 0.04 0.00 0.48 0.00 0.00 55.95 55.80 2dlv s SER 18 Cb 0.05 0.04 0.63 0.00 0.10 0.00 0.00 66.02 66.83 2dlv s SER 18 CO 0.26 -0.23 1.91 0.15 0.98 0.00 0.00 173.24 176.32 2dlv h PHE 19 N 4.25 0.60 0.25 5.02 3.57 -1.80 -2.96 116.94 125.87 2dlv h PHE 19 Ca -0.36 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.10 2dlv h PHE 19 Cb 1.20 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 2dlv h PHE 19 CO 0.64 0.52 -0.18 0.22 -2.23 0.00 0.00 178.31 177.28 2dlv h ASP 20 N 0.58 -0.46 -0.98 0.41 1.82 -1.96 -3.07 116.42 112.76 2dlv h ASP 20 Ca 0.14 0.03 0.09 0.00 -0.39 0.00 0.00 57.03 56.90 2dlv h ASP 20 Cb 0.21 0.14 -0.12 0.00 0.68 0.00 0.00 39.33 40.25 2dlv h ASP 20 CO -0.00 -0.28 -0.59 0.11 -1.61 0.00 0.00 179.24 176.87 2dlv h LYS 21 N -0.43 -0.01 -0.75 0.28 1.57 -1.80 0.54 116.57 115.97 2dlv h LYS 21 Ca -0.02 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.83 2dlv h LYS 21 Cb 0.37 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.58 2dlv h LYS 21 CO 0.00 -0.01 -0.53 1.25 -0.57 0.00 0.00 179.45 179.59 2dlv h LEU 22 N -0.01 -1.90 -0.73 2.94 5.85 -1.60 0.21 115.31 120.07 2dlv h LEU 22 Ca 0.16 0.28 0.12 0.00 0.84 0.00 0.00 57.88 59.28 2dlv h LEU 22 Cb 0.42 0.82 -0.08 0.00 0.37 0.00 0.00 40.66 42.19 2dlv h LEU 22 CO -0.93 -0.26 0.33 -0.07 -0.34 0.00 0.00 178.44 177.17 2dlv h LEU 23 N -0.11 0.37 -0.94 2.25 3.38 -1.09 -0.84 115.31 118.32 2dlv h LEU 23 Ca 0.12 0.09 0.25 0.00 0.09 0.00 0.00 57.88 58.43 2dlv h LEU 23 Cb 0.43 0.04 -0.13 0.00 0.09 0.00 0.00 40.66 41.08 2dlv h LEU 23 CO -0.76 0.18 0.45 -1.28 0.09 0.00 0.00 178.44 177.12 2dlv h SER 24 N 0.52 0.40 -3.26 -0.43 0.87 0.15 -3.38 113.55 108.42 2dlv h SER 24 Ca 0.38 0.16 -0.58 0.00 -1.23 0.00 0.00 61.79 60.52 2dlv h SER 24 Cb 0.50 0.13 -0.08 0.00 -0.44 0.00 0.00 62.40 62.52 2dlv h SER 24 CO -0.34 -0.03 -0.18 -2.28 -0.53 0.00 0.00 176.83 173.47 2dlv s HIS 25 N -5.82 3.55 0.07 2.24 5.65 -0.32 -5.00 115.29 115.66 2dlv s HIS 25 Ca -0.11 0.87 -0.34 0.00 0.25 0.00 0.00 55.06 55.73 2dlv s HIS 25 Cb 0.27 -2.46 -0.19 0.00 -1.18 0.00 0.00 32.58 29.02 2dlv s HIS 25 CO 0.78 0.29 1.61 -0.09 -0.65 0.00 0.00 174.74 176.68 2dlv h ARG 26 N 6.26 -0.95 -0.94 2.88 9.65 -1.80 -1.60 114.38 127.88 2dlv h ARG 26 Ca -0.43 0.06 0.18 0.00 -1.10 0.00 0.00 59.98 58.69 2dlv h ARG 26 Cb 1.18 0.22 -0.17 0.00 -1.39 0.00 0.00 29.97 29.81 2dlv h ARG 26 CO 0.72 -0.64 -0.27 0.22 2.80 0.00 0.00 179.97 182.81 2dlv h ASP 27 N -0.99 -1.01 -0.10 -3.80 3.58 -1.91 0.21 116.42 112.39 2dlv h ASP 27 Ca -0.09 0.29 -0.00 0.00 0.42 0.00 0.00 57.03 57.64 2dlv h ASP 27 Cb 0.77 0.62 -0.00 0.00 1.72 0.00 0.00 39.33 42.44 2dlv h ASP 27 CO 0.14 -0.31 0.05 1.23 -2.88 0.00 0.00 179.24 177.47 2dlv h GLY 28 N -0.01 0.16 0.52 -0.78 0.00 -1.72 -2.76 103.07 98.47 2dlv h GLY 28 Ca 0.42 -0.08 0.05 0.00 0.00 0.00 0.00 47.33 47.72 2dlv h GLY 28 CO -0.96 0.07 -0.06 -2.00 0.00 0.00 0.00 176.54 173.60 2dlv h LEU 29 N 0.03 -0.22 -0.21 3.11 5.85 0.21 -0.80 115.31 123.29 2dlv h LEU 29 Ca 0.03 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2dlv h LEU 29 Cb 0.13 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.23 2dlv h LEU 29 CO -0.00 -0.08 -0.37 -0.33 -0.34 0.00 0.00 178.44 177.32 2dlv h GLU 30 N 0.01 -0.39 -0.75 1.25 5.08 -0.65 -0.86 114.58 118.28 2dlv h GLU 30 Ca 0.12 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.57 2dlv h GLU 30 Cb 0.18 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 2dlv h GLU 30 CO -0.25 -0.26 0.43 0.00 -1.00 0.00 0.00 179.01 177.94 2dlv h ALA 31 N 0.37 1.02 -0.30 3.43 0.00 -1.19 -2.36 119.26 120.23 2dlv h ALA 31 Ca 0.11 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.09 2dlv h ALA 31 Cb 0.58 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2dlv h ALA 31 CO -0.43 0.13 -0.06 0.35 0.00 0.00 0.00 179.25 179.24 2dlv h PHE 32 N 0.79 -0.13 -0.00 0.00 3.57 0.04 -2.52 116.94 118.69 2dlv h PHE 32 Ca 0.33 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.88 2dlv h PHE 32 Cb 0.20 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 2dlv h PHE 32 CO -0.06 -0.11 -0.16 1.15 -2.23 0.00 0.00 178.31 176.89 2dlv h THR 33 N 0.02 0.60 -0.67 4.41 2.02 -0.70 -2.66 112.91 115.93 2dlv h THR 33 Ca 0.14 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.45 2dlv h THR 33 Cb 0.21 0.60 -0.13 0.00 -1.74 0.00 0.00 68.15 67.10 2dlv h THR 33 CO -0.29 0.00 -0.27 0.03 0.37 0.00 0.00 175.52 175.36 2dlv h ARG 34 N -0.27 -0.08 -0.87 6.66 3.08 -1.05 0.34 114.38 122.18 2dlv h ARG 34 Ca 0.05 0.01 0.19 0.00 0.07 0.00 0.00 59.98 60.30 2dlv h ARG 34 Cb 0.34 0.02 -0.11 0.00 0.08 0.00 0.00 29.97 30.29 2dlv h ARG 34 CO -0.16 -0.05 0.40 0.35 -1.07 0.00 0.00 179.97 179.44 2dlv h PHE 35 N -0.08 0.67 -0.14 3.04 3.57 -1.11 -0.59 116.94 122.30 2dlv h PHE 35 Ca 0.29 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.68 2dlv h PHE 35 Cb 0.55 -0.16 0.01 0.00 2.79 0.00 0.00 35.95 39.13 2dlv h PHE 35 CO -0.63 0.03 -0.51 -0.07 -2.23 0.00 0.00 178.31 174.90 2dlv h LEU 36 N 0.47 0.69 -0.81 0.59 3.38 -0.37 -3.26 115.31 116.00 2dlv h LEU 36 Ca 0.52 -0.61 0.18 0.00 0.09 0.00 0.00 57.88 58.06 2dlv h LEU 36 Cb 0.91 -0.20 -0.15 0.00 0.09 0.00 0.00 40.66 41.31 2dlv h LEU 36 CO -0.47 1.19 -0.08 0.11 0.09 0.00 0.00 178.44 179.28 2dlv h LYS 37 N 0.24 0.05 -0.65 1.13 1.57 0.11 0.66 116.57 119.67 2dlv h LYS 37 Ca -0.02 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2dlv h LYS 37 Cb 1.14 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.41 2dlv h LYS 37 CO 0.11 0.03 0.43 1.79 -0.57 0.00 0.00 179.45 181.24 2dlv h THR 38 N 0.05 1.16 -0.33 -0.16 1.35 -1.49 -0.07 112.91 113.42 2dlv h THR 38 Ca 0.43 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 2dlv h THR 38 Cb 0.74 0.21 0.00 0.00 -1.73 0.00 0.00 68.15 67.37 2dlv h THR 38 CO -0.76 0.16 0.00 -0.62 -0.25 0.00 0.00 175.52 174.04 2dlv n GLU 39 N -4.44 1.83 -2.99 4.72 -0.58 0.20 -4.90 120.64 114.48 2dlv n GLU 39 Ca 0.07 -1.29 -0.20 0.00 -0.42 0.00 0.00 57.16 55.32 2dlv n GLU 39 Cb 0.05 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 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 0.54 -1.70 0.35 -0.32 3.01 0.55 -4.81 117.46 115.08 2dlv n PHE 40 Ca 0.13 0.33 0.04 0.00 1.01 0.00 0.00 57.45 58.96 2dlv n PHE 40 Cb 0.32 -3.28 -0.02 0.00 -0.01 0.00 0.00 39.48 36.48 2dlv n PHE 40 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dlv n SER 41 N -2.20 0.73 -0.33 4.37 7.64 -0.61 -4.64 113.62 118.59 2dlv n SER 41 Ca -0.08 -0.86 0.23 0.00 1.01 0.00 0.00 58.87 59.16 2dlv n SER 41 Cb 0.58 0.72 0.45 0.00 -1.01 0.00 0.00 64.21 64.95 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 0.46 0.23 -1.35 1.43 9.09 -1.84 0.16 114.58 122.77 2dlv h GLU 42 Ca 0.00 -0.01 0.42 0.00 0.05 0.00 0.00 59.36 59.82 2dlv h GLU 42 Cb 0.22 -0.05 -0.08 0.00 -1.65 0.00 0.00 28.75 27.19 2dlv h GLU 42 CO 0.00 0.15 0.93 -0.85 0.05 0.00 0.00 179.01 179.29 2dlv n GLU 43 N -5.14 -0.01 0.30 1.06 0.28 -1.26 0.78 120.64 116.64 2dlv n GLU 43 Ca 0.30 0.92 -0.14 0.00 -0.16 0.00 0.00 57.16 58.08 2dlv n GLU 43 Cb 0.96 -1.96 -0.07 0.00 1.43 0.00 0.00 31.44 31.79 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 -0.66 -0.64 -1.84 4.21 -0.96 -3.12 115.58 112.57 2dlv h ASN 44 Ca 0.72 -0.03 -0.08 0.00 1.21 0.00 0.00 56.30 58.12 2dlv h ASN 44 Cb 2.65 0.17 -0.02 0.00 -1.12 0.00 0.00 38.32 39.99 2dlv h ASN 44 CO -0.17 -0.29 0.08 -0.29 -1.29 0.00 0.00 177.43 175.47 2dlv h ILE 45 N -1.09 1.26 -0.86 2.81 6.09 0.20 -3.04 117.51 122.88 2dlv h ILE 45 Ca -0.08 -1.05 0.20 0.00 -1.37 0.00 0.00 64.86 62.56 2dlv h ILE 45 Cb 0.65 0.70 -0.16 0.00 0.47 0.00 0.00 36.82 38.49 2dlv h ILE 45 CO 0.13 0.39 -0.06 -0.33 -3.07 0.00 0.00 178.15 175.21 2dlv h GLU 46 N 0.98 0.04 -0.47 2.19 5.08 -0.74 0.32 114.58 121.99 2dlv h GLU 46 Ca 0.19 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 2dlv h GLU 46 Cb 0.46 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2dlv h GLU 46 CO 0.02 0.03 0.18 0.35 -1.00 0.00 0.00 179.01 178.58 2dlv h PHE 47 N 0.05 0.72 -1.00 4.33 3.57 -1.47 -2.31 116.94 120.83 2dlv h PHE 47 Ca 0.47 -0.06 0.21 0.00 3.53 0.00 0.00 57.97 62.12 2dlv h PHE 47 Cb 0.84 -0.21 -0.11 0.00 2.79 0.00 0.00 35.95 39.25 2dlv h PHE 47 CO -0.53 0.62 0.59 2.35 -2.23 0.00 0.00 178.31 179.12 2dlv h TRP 48 N 0.61 1.03 0.23 0.41 7.01 -0.37 -2.12 115.95 122.76 2dlv h TRP 48 Ca 0.15 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 2dlv h TRP 48 Cb 0.21 -0.30 0.00 0.00 -2.10 0.00 0.00 29.16 26.97 2dlv h TRP 48 CO 0.01 0.16 -0.11 0.82 -2.79 0.00 0.00 178.44 176.52 2dlv h ILE 49 N 0.68 0.67 -0.94 2.65 2.04 -1.07 -3.24 117.51 118.29 2dlv h ILE 49 Ca 0.60 -0.96 0.32 0.00 1.00 0.00 0.00 64.86 65.83 2dlv h ILE 49 Cb 1.03 1.10 -0.17 0.00 -0.74 0.00 0.00 36.82 38.04 2dlv h ILE 49 CO -0.42 0.16 0.23 0.00 0.00 0.00 0.00 178.15 178.12 2dlv n ALA 50 N -2.58 0.70 -0.01 1.87 0.00 -0.84 0.84 120.51 120.48 2dlv n ALA 50 Ca -0.08 0.99 -0.10 0.00 0.00 0.00 0.00 53.44 54.25 2dlv n ALA 50 Cb 0.25 -0.84 -0.05 0.00 0.00 0.00 0.00 19.45 18.82 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 0.08 -0.02 0.00 0.00 4.39 0.42 0.17 114.58 119.62 2dlv h GLU 52 Ca 0.05 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.64 2dlv h GLU 52 Cb 0.04 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2dlv h GLU 52 CO -0.06 -0.02 -0.53 0.22 -1.16 0.00 0.00 179.01 177.46 2dlv h ASP 53 N -0.03 0.00 -0.56 1.42 1.82 -1.19 -3.03 116.42 114.85 2dlv h ASP 53 Ca 0.22 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.85 2dlv h ASP 53 Cb 0.35 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.33 2dlv h ASP 53 CO -0.47 0.53 0.34 0.15 -1.61 0.00 0.00 179.24 178.17 2dlv h PHE 54 N 0.00 0.76 -0.16 0.28 3.04 0.17 -2.53 116.94 118.49 2dlv h PHE 54 Ca -0.01 0.00 -0.21 0.00 3.98 0.00 0.00 57.97 61.74 2dlv h PHE 54 Cb 1.01 -0.25 0.01 0.00 2.56 0.00 0.00 35.95 39.28 2dlv h PHE 54 CO 0.00 0.51 -0.71 0.87 -2.02 0.00 0.00 178.31 176.96 2dlv h LYS 55 N 0.80 0.77 -1.42 1.11 1.57 -1.19 -3.20 116.57 115.00 2dlv h LYS 55 Ca 0.21 -0.61 0.46 0.00 -1.87 0.00 0.00 60.65 58.83 2dlv h LYS 55 Cb -0.02 0.12 -0.10 0.00 0.08 0.00 0.00 32.23 32.31 2dlv h LYS 55 CO -0.04 1.22 0.96 1.63 -0.57 0.00 0.00 179.45 182.66 2dlv n LYS 56 N -3.99 -0.02 -1.49 3.15 5.02 -0.95 -4.48 118.16 115.39 2dlv n LYS 56 Ca -0.07 1.06 -0.37 0.00 -2.02 0.00 0.00 58.31 56.90 2dlv n LYS 56 Cb 0.71 -2.20 0.05 0.00 -0.02 0.00 0.00 35.03 33.57 2dlv n LYS 56 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2dlv n SER 57 N -4.19 -0.24 -0.02 4.39 2.88 -1.21 -4.95 113.62 110.28 2dlv n SER 57 Ca 0.37 0.73 -0.03 0.00 -1.33 0.00 0.00 58.87 58.62 2dlv n SER 57 Cb 1.54 -1.28 -0.02 0.00 -0.75 0.00 0.00 64.21 63.70 2dlv n SER 57 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dlv n LYS 58 N -0.68 0.85 -2.70 -1.46 4.81 -1.26 -5.03 118.16 112.68 2dlv n LYS 58 Ca 0.12 0.02 -0.24 0.00 -0.87 0.00 0.00 58.31 57.34 2dlv n LYS 58 Cb 0.48 -1.08 0.03 0.00 0.02 0.00 0.00 35.03 34.48 2dlv n LYS 58 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2dlv s GLY 59 N -4.17 1.63 -0.02 3.14 0.00 -1.26 -5.03 107.32 101.61 2dlv s GLY 59 Ca -0.05 -0.99 -0.25 0.00 0.00 0.00 0.00 44.72 43.43 2dlv s GLY 59 CO 0.10 -0.76 1.23 -0.56 0.00 0.00 0.00 173.10 173.11 2dlv h PRO 60 N 0.10 -0.06 -0.14 2.90 0.13 -2.00 -3.30 132.00 129.64 2dlv h PRO 60 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.70 2dlv h PRO 60 Cb 1.27 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 2dlv h PRO 60 CO 0.57 0.40 -0.08 0.94 -0.23 0.00 0.00 178.00 179.61 2dlv n GLN 61 N -4.89 -0.06 -0.18 0.86 -0.06 -1.26 -1.64 117.38 110.15 2dlv n GLN 61 Ca -0.08 0.99 -0.05 0.00 -2.00 0.00 0.00 57.00 55.86 2dlv n GLN 61 Cb 0.25 -1.47 -0.04 0.00 -4.06 0.00 0.00 30.24 24.92 2dlv n GLN 61 CO 0.00 0.00 0.00 0.94 -0.20 0.00 0.00 177.06 177.80 2dlv n GLN 62 N -3.25 -0.18 -0.31 3.69 -0.06 -1.26 -0.74 117.38 115.27 2dlv n GLN 62 Ca 0.00 1.18 -0.03 0.00 -2.00 0.00 0.00 57.00 56.16 2dlv n GLN 62 Cb 0.04 -1.75 0.01 0.00 -4.06 0.00 0.00 30.24 24.47 2dlv n GLN 62 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 2dlv n ILE 63 N -3.94 -0.45 0.21 1.69 5.41 -0.65 -0.32 119.36 121.30 2dlv n ILE 63 Ca 0.01 1.88 -0.17 0.00 1.00 0.00 0.00 62.75 65.47 2dlv n ILE 63 Cb 0.11 -2.44 -0.09 0.00 -0.71 0.00 0.00 39.64 36.50 2dlv n ILE 63 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 2dlv h HIS 64 N 0.00 -1.40 -0.06 1.39 3.86 -0.24 0.26 115.15 118.97 2dlv h HIS 64 Ca 0.24 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.50 2dlv h HIS 64 Cb 0.44 0.57 -0.06 0.00 1.06 0.00 0.00 27.41 29.42 2dlv h HIS 64 CO -0.72 -0.61 -0.51 -0.07 0.86 0.00 0.00 177.93 176.87 2dlv h LEU 65 N -0.86 -1.60 -0.85 2.43 4.07 0.16 -0.94 115.31 117.72 2dlv h LEU 65 Ca -0.04 0.19 0.16 0.00 0.08 0.00 0.00 57.88 58.27 2dlv h LEU 65 Cb 0.79 0.62 -0.10 0.00 1.08 0.00 0.00 40.66 43.05 2dlv h LEU 65 CO -0.15 -0.50 0.42 0.11 -1.08 0.00 0.00 178.44 177.24 2dlv h LYS 66 N -0.61 0.56 -0.63 1.13 1.57 -0.54 -0.29 116.57 117.75 2dlv h LYS 66 Ca 0.03 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 2dlv h LYS 66 Cb 0.70 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 2dlv h LYS 66 CO -0.39 0.37 0.30 0.00 -0.57 0.00 0.00 179.45 179.16 2dlv h ALA 67 N 1.58 0.84 0.67 3.86 0.00 0.80 0.71 119.26 127.73 2dlv h ALA 67 Ca 0.48 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.40 2dlv h ALA 67 Cb 0.72 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.48 2dlv h ALA 67 CO -0.39 -0.08 -0.32 -0.22 0.00 0.00 0.00 179.25 178.24 2dlv h LYS 68 N 0.54 -0.87 -0.23 0.00 3.64 -0.04 0.12 116.57 119.75 2dlv h LYS 68 Ca 0.30 0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.80 2dlv h LYS 68 Cb 0.29 0.20 -0.07 0.00 -0.41 0.00 0.00 32.23 32.23 2dlv h LYS 68 CO -0.24 -0.54 -0.33 0.00 -2.27 0.00 0.00 179.45 176.07 2dlv h ALA 69 N -0.97 -0.32 -0.79 5.00 0.00 -1.15 -0.50 119.26 120.53 2dlv h ALA 69 Ca -0.09 0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.90 2dlv h ALA 69 Cb 0.73 0.65 -0.05 0.00 0.00 0.00 0.00 17.79 19.12 2dlv h ALA 69 CO 0.15 -0.78 0.52 0.82 0.00 0.00 0.00 179.25 179.96 2dlv h ILE 70 N -0.35 1.11 0.79 0.00 2.04 -0.90 -2.14 117.51 118.06 2dlv h ILE 70 Ca 0.12 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 2dlv h ILE 70 Cb 0.55 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 2dlv h ILE 70 CO -0.42 0.17 -0.48 0.22 0.00 0.00 0.00 178.15 177.65 2dlv h TYR 71 N 0.96 -1.28 0.00 1.37 5.03 0.58 0.16 116.97 123.78 2dlv h TYR 71 Ca 0.32 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.61 2dlv h TYR 71 Cb 0.06 0.45 0.00 0.00 1.55 0.00 0.00 36.73 38.80 2dlv h TYR 71 CO -0.00 -0.72 0.00 0.39 -1.32 0.00 0.00 178.16 176.51 2dlv n GLU 72 N -5.49 0.15 -0.08 1.82 1.02 -0.52 -0.30 120.64 117.23 2dlv n GLU 72 Ca -0.15 0.14 -0.09 0.00 -0.02 0.00 0.00 57.16 57.04 2dlv n GLU 72 Cb 0.49 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.38 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 -1.18 0.50 -0.02 3.49 4.81 -0.51 -4.33 118.16 120.91 2dlv n LYS 73 Ca 0.04 0.41 -0.04 0.00 -0.87 0.00 0.00 58.31 57.85 2dlv n LYS 73 Cb 0.05 -1.60 -0.01 0.00 0.02 0.00 0.00 35.03 33.49 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 -4.53 0.00 0.00 5.64 3.01 0.43 -2.16 117.46 119.85 2dlv n PHE 74 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.32 2dlv n PHE 74 Cb 0.42 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 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 -0.71 4.37 2.08 -0.69 -2.97 119.36 117.76 2dlv n ILE 75 Ca -0.06 0.84 -0.32 0.00 0.56 0.00 0.00 62.75 63.77 2dlv n ILE 75 Cb 0.22 -1.15 0.16 0.00 -0.75 0.00 0.00 39.64 38.12 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 -2.07 -1.08 -0.07 0.38 10.64 0.59 -4.71 117.38 121.06 2dlv n GLN 76 Ca 0.00 -0.29 -0.05 0.00 -1.83 0.00 0.00 57.00 54.83 2dlv n GLN 76 Cb 0.00 -1.80 -0.16 0.00 -0.86 0.00 0.00 30.24 27.42 2dlv n GLN 76 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 2dlv n THR 77 N -4.11 1.12 0.96 -0.39 5.66 -1.26 -4.20 114.28 112.05 2dlv n THR 77 Ca 0.04 -0.77 0.00 0.00 -3.05 0.00 0.00 64.05 60.26 2dlv n THR 77 Cb 0.58 -0.42 0.00 0.00 -1.55 0.00 0.00 70.33 68.94 2dlv n THR 77 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2dlv n ASP 78 N -2.68 0.63 -4.87 1.09 2.03 -1.26 -4.78 116.55 106.71 2dlv n ASP 78 Ca -0.25 -1.60 -0.26 0.00 0.52 0.00 0.00 54.79 53.20 2dlv n ASP 78 Cb 1.02 -0.32 -0.04 0.00 -0.72 0.00 0.00 41.12 41.06 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 -1.21 3.77 0.27 -1.67 0.00 -1.26 -5.02 121.76 116.64 2dlv s ALA 79 Ca 0.00 -1.12 0.05 0.00 0.00 0.00 0.00 51.96 50.90 2dlv s ALA 79 Cb 0.00 -1.57 0.37 0.00 0.00 0.00 0.00 23.12 21.92 2dlv s ALA 79 CO 0.00 0.53 1.65 -1.00 0.00 0.00 0.00 175.76 176.94 2dlv h PRO 80 N 2.32 0.26 -0.51 0.00 0.13 -1.84 -2.94 132.00 129.42 2dlv h PRO 80 Ca -0.48 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2dlv h PRO 80 Cb 1.20 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dlv h PRO 80 CO 0.66 0.68 0.00 1.63 -0.23 0.00 0.00 178.00 180.74 2dlv n LYS 81 N -3.98 4.02 -1.64 0.86 4.76 -1.16 -4.96 118.16 116.06 2dlv n LYS 81 Ca -0.02 -2.96 -0.49 0.00 -2.87 0.00 0.00 58.31 51.97 2dlv n LYS 81 Cb 0.52 -2.02 -0.05 0.00 -1.84 0.00 0.00 35.03 31.65 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 0.48 1.69 -4.31 1.97 -0.00 -0.92 -4.33 120.64 115.22 2dlv n GLU 82 Ca 0.25 0.61 -0.25 0.00 -0.00 0.00 0.00 57.16 57.77 2dlv n GLU 82 Cb 1.01 -2.33 -0.08 0.00 -0.00 0.00 0.00 31.44 30.03 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 1.21 3.23 -0.66 3.84 -7.23 -1.16 -4.94 120.40 114.69 2dlv s VAL 83 Ca 0.84 -1.85 -0.27 0.00 -1.81 0.00 0.00 61.98 58.88 2dlv s VAL 83 Cb -0.81 -2.67 0.02 0.00 0.56 0.00 0.00 36.38 33.48 2dlv s VAL 83 CO 0.44 -0.26 1.37 0.20 -0.31 0.00 0.00 175.10 176.54 2dlv s ASN 84 N -3.27 6.10 -0.09 4.85 0.01 -1.26 -4.84 114.94 116.43 2dlv s ASN 84 Ca 0.28 -0.10 -0.04 0.00 -0.71 0.00 0.00 52.86 52.29 2dlv s ASN 84 Cb -0.07 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 39.00 2dlv s ASN 84 CO 0.17 -1.81 0.08 -0.76 -1.51 0.00 0.00 177.10 173.27 2dlv s LEU 85 N 6.08 4.04 0.22 0.60 1.43 -1.26 -4.98 118.68 124.81 2dlv s LEU 85 Ca 0.44 0.32 -0.31 0.00 -1.03 0.00 0.00 54.13 53.54 2dlv s LEU 85 Cb -0.09 -2.01 -0.14 0.00 0.03 0.00 0.00 46.19 43.98 2dlv s LEU 85 CO 0.20 0.38 1.28 0.47 0.23 0.00 0.00 176.35 178.91 2dlv n ASP 86 N 1.94 2.12 -0.23 2.29 8.00 -1.26 -4.52 116.55 124.89 2dlv n ASP 86 Ca -0.19 1.15 0.02 0.00 0.71 0.00 0.00 54.79 56.48 2dlv n ASP 86 Cb 0.54 -1.34 0.06 0.00 -0.02 0.00 0.00 41.12 40.36 2dlv n ASP 86 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2dlv n PHE 87 N 1.57 0.13 0.22 1.24 7.35 -1.26 0.15 117.46 126.86 2dlv n PHE 87 Ca 0.12 0.76 -0.12 0.00 -0.76 0.00 0.00 57.45 57.45 2dlv n PHE 87 Cb 0.29 -0.80 -0.07 0.00 0.35 0.00 0.00 39.48 39.25 2dlv n PHE 87 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 2dlv h HIS 88 N 0.00 -0.56 -1.20 -5.13 2.76 -1.99 -1.75 115.15 107.28 2dlv h HIS 88 Ca 0.26 -0.01 0.36 0.00 -2.20 0.00 0.00 60.37 58.78 2dlv h HIS 88 Cb 0.42 0.18 -0.11 0.00 1.55 0.00 0.00 27.41 29.46 2dlv h HIS 88 CO -0.51 -0.24 0.78 1.15 -1.30 0.00 0.00 177.93 177.81 2dlv h THR 89 N -1.01 0.32 -0.00 6.26 2.02 -0.74 0.52 112.91 120.27 2dlv h THR 89 Ca -0.06 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 2dlv h THR 89 Cb 0.57 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 2dlv h THR 89 CO 0.10 0.04 -0.04 0.50 0.37 0.00 0.00 175.52 176.49 2dlv h LYS 90 N 0.21 0.03 0.80 6.66 3.64 -0.23 -3.14 116.57 124.54 2dlv h LYS 90 Ca 0.70 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 60.01 2dlv h LYS 90 Cb 2.10 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 33.94 2dlv h LYS 90 CO -0.33 0.76 -0.39 1.49 -2.27 0.00 0.00 179.45 178.71 2dlv h GLU 91 N -0.68 -1.04 -1.00 1.90 4.81 0.13 -1.89 114.58 116.82 2dlv h GLU 91 Ca -0.00 0.07 0.25 0.00 -0.13 0.00 0.00 59.36 59.55 2dlv h GLU 91 Cb 0.77 0.24 -0.19 0.00 0.63 0.00 0.00 28.75 30.20 2dlv h GLU 91 CO 0.01 -0.68 -0.06 -0.24 -0.73 0.00 0.00 179.01 177.31 2dlv h VAL 92 N -1.24 0.00 -0.39 0.32 3.04 -0.26 1.25 116.25 118.97 2dlv h VAL 92 Ca -0.11 -0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.49 2dlv h VAL 92 Cb 0.84 0.00 -0.02 0.00 -2.01 0.00 0.00 31.29 30.10 2dlv h VAL 92 CO 0.18 0.00 -0.14 0.40 -1.01 0.00 0.00 177.57 177.00 2dlv h ILE 93 N 0.00 1.26 -0.68 3.17 2.04 -1.49 0.25 117.51 122.06 2dlv h ILE 93 Ca 0.57 -1.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 2dlv h ILE 93 Cb 1.10 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 2dlv h ILE 93 CO -0.97 0.40 0.31 0.74 0.00 0.00 0.00 178.15 178.63 2dlv h THR 94 N 0.64 1.23 0.00 -0.27 2.02 0.23 0.48 112.91 117.25 2dlv h THR 94 Ca 0.11 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.61 2dlv h THR 94 Cb 0.60 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 2dlv h THR 94 CO 0.04 0.28 -0.50 0.78 0.37 0.00 0.00 175.52 176.48 2dlv h ASN 95 N 0.94 0.00 -0.32 4.18 2.35 -0.88 -3.28 115.58 118.58 2dlv h ASN 95 Ca 0.23 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2dlv h ASN 95 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2dlv h ASN 95 CO -0.03 0.06 0.00 -0.24 -1.65 0.00 0.00 177.43 175.57 2dlv n SER 96 N -2.33 3.89 0.00 5.81 2.88 0.86 -4.49 113.62 120.24 2dlv n SER 96 Ca 0.03 -2.80 0.12 0.00 -1.33 0.00 0.00 58.87 54.89 2dlv n SER 96 Cb 0.46 -0.50 0.59 0.00 -0.75 0.00 0.00 64.21 64.01 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 -0.17 0.23 -0.03 2.46 0.13 0.17 -1.62 119.36 120.52 2dlv n ILE 97 Ca 0.20 0.06 0.02 0.00 -1.10 0.00 0.00 62.75 61.93 2dlv n ILE 97 Cb 0.83 -0.63 -0.11 0.00 -0.84 0.00 0.00 39.64 38.88 2dlv n ILE 97 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 2dlv n THR 98 N -1.39 0.34 -1.47 9.51 -2.24 -1.26 -4.51 114.28 113.27 2dlv n THR 98 Ca 0.09 -0.43 0.04 0.00 -2.27 0.00 0.00 64.05 61.48 2dlv n THR 98 Cb 0.24 -0.13 0.20 0.00 -2.10 0.00 0.00 70.33 68.55 2dlv n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dlv n GLN 99 N -2.20 1.65 -2.18 -0.78 1.13 -1.17 -5.03 117.38 108.79 2dlv n GLN 99 Ca -0.10 -3.16 -0.42 0.00 -1.94 0.00 0.00 57.00 51.38 2dlv n GLN 99 Cb 0.59 -1.66 -0.03 0.00 0.11 0.00 0.00 30.24 29.26 2dlv n GLN 99 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2dlv s PRO 100 N -3.18 4.28 0.62 -1.09 0.04 -0.64 -5.03 135.00 130.00 2dlv s PRO 100 Ca 0.39 2.03 0.07 0.00 0.04 0.00 0.00 61.00 63.52 2dlv s PRO 100 Cb 0.36 -3.51 0.10 0.00 0.04 0.00 0.00 34.50 31.49 2dlv s PRO 100 CO -0.04 -0.56 0.85 0.95 0.04 0.00 0.00 177.00 178.24 2dlv s THR 101 N 2.16 2.15 0.59 1.26 -4.23 -1.26 -4.80 115.64 111.51 2dlv s THR 101 Ca 0.65 -0.88 0.34 0.00 -1.18 0.00 0.00 61.69 60.62 2dlv s THR 101 Cb -0.33 -2.27 0.38 0.00 1.34 0.00 0.00 72.50 71.61 2dlv s THR 101 CO 0.28 0.00 2.27 -0.07 -0.54 0.00 0.00 174.62 176.56 2dlv h LEU 102 N -0.03 0.00 -3.23 4.79 3.38 -1.95 0.47 115.31 118.74 2dlv h LEU 102 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2dlv h LEU 102 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2dlv h LEU 102 CO 0.40 0.01 0.00 1.41 0.09 0.00 0.00 178.44 180.35 2dlv n HIS 103 N -3.58 1.33 0.03 1.13 8.25 -1.26 -4.65 115.22 116.47 2dlv n HIS 103 Ca -0.03 -0.70 -0.01 0.00 -0.26 0.00 0.00 57.72 56.72 2dlv n HIS 103 Cb 0.10 -0.29 -0.01 0.00 1.12 0.00 0.00 29.99 30.90 2dlv n HIS 103 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dlv h SER 104 N 3.16 -0.08 -0.89 0.41 0.87 -1.25 -3.24 113.55 112.54 2dlv h SER 104 Ca 0.00 0.00 0.26 0.00 -1.23 0.00 0.00 61.79 60.82 2dlv h SER 104 Cb 1.47 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 63.42 2dlv h SER 104 CO 0.26 -0.03 0.64 -0.26 -0.53 0.00 0.00 176.83 176.91 2dlv h PHE 105 N -0.14 0.02 -0.78 2.24 0.04 -1.83 -2.16 116.94 114.32 2dlv h PHE 105 Ca -0.01 0.00 0.21 0.00 2.80 0.00 0.00 57.97 60.98 2dlv h PHE 105 Cb 0.07 -0.01 -0.15 0.00 2.20 0.00 0.00 35.95 38.07 2dlv h PHE 105 CO 0.11 0.00 0.01 -3.47 -0.60 0.00 0.00 178.31 174.36 2dlv n ASP 106 N -4.28 -0.10 0.30 2.17 2.03 -1.22 0.55 116.55 116.00 2dlv n ASP 106 Ca 0.18 1.33 -0.17 0.00 0.52 0.00 0.00 54.79 56.66 2dlv n ASP 106 Cb 0.95 -0.48 -0.08 0.00 -0.72 0.00 0.00 41.12 40.78 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 1.57 -0.78 -0.35 -1.67 0.00 -1.56 -2.41 119.26 114.06 2dlv h ALA 107 Ca 0.47 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.27 2dlv h ALA 107 Cb 0.97 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 2dlv h ALA 107 CO -0.74 -0.95 0.10 0.00 0.00 0.00 0.00 179.25 177.66 2dlv h ALA 108 N -0.34 0.39 -0.77 0.00 0.00 -0.08 -2.25 119.26 116.21 2dlv h ALA 108 Ca -0.06 0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.08 2dlv h ALA 108 Cb 0.63 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.35 2dlv h ALA 108 CO 0.07 -0.30 0.19 0.37 0.00 0.00 0.00 179.25 179.57 2dlv h GLN 109 N 0.23 0.25 -0.04 0.00 4.15 -0.65 0.75 115.11 119.81 2dlv h GLN 109 Ca 0.16 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.58 2dlv h GLN 109 Cb 0.16 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.79 2dlv h GLN 109 CO -0.19 0.16 0.05 1.03 -1.93 0.00 0.00 178.83 177.96 2dlv h SER 110 N 0.25 0.00 0.27 -0.69 0.87 -0.89 -0.73 113.55 112.64 2dlv h SER 110 Ca 0.45 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.99 2dlv h SER 110 Cb 0.79 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2dlv h SER 110 CO -0.55 0.00 -0.13 -0.09 -0.53 0.00 0.00 176.83 175.53 2dlv h ARG 111 N 0.00 -0.35 -0.75 2.24 1.12 0.60 -3.28 114.38 113.96 2dlv h ARG 111 Ca 0.02 0.02 0.07 0.00 -1.11 0.00 0.00 59.98 58.98 2dlv h ARG 111 Cb 0.13 0.08 -0.06 0.00 -0.01 0.00 0.00 29.97 30.11 2dlv h ARG 111 CO -0.00 -0.24 0.43 0.28 -3.11 0.00 0.00 179.97 177.34 2dlv h VAL 112 N -0.94 0.97 -1.04 0.20 2.07 -1.27 -1.69 116.25 114.56 2dlv h VAL 112 Ca -0.04 -0.27 0.33 0.00 0.82 0.00 0.00 66.70 67.54 2dlv h VAL 112 Cb 0.28 0.12 -0.14 0.00 -1.52 0.00 0.00 31.29 30.03 2dlv h VAL 112 CO 0.06 0.14 0.61 0.22 0.02 0.00 0.00 177.57 178.62 2dlv h TYR 113 N 0.78 0.88 0.16 1.57 5.03 -1.25 -1.77 116.97 122.36 2dlv h TYR 113 Ca 0.34 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.68 2dlv h TYR 113 Cb 0.23 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.28 2dlv h TYR 113 CO -0.06 -0.16 -0.08 1.96 -1.32 0.00 0.00 178.16 178.50 2dlv h GLN 114 N 0.31 -0.21 -0.82 1.82 4.20 -1.37 -2.73 115.11 116.32 2dlv h GLN 114 Ca 0.73 0.01 0.31 0.00 0.06 0.00 0.00 58.65 59.77 2dlv h GLN 114 Cb 1.74 0.05 -0.12 0.00 0.30 0.00 0.00 27.48 29.45 2dlv h GLN 114 CO -0.56 -0.14 0.48 1.28 -0.67 0.00 0.00 178.83 179.22 2dlv n LEU 115 N -4.02 0.21 0.06 1.46 4.77 -0.84 -0.31 117.00 118.33 2dlv n LEU 115 Ca -0.03 1.10 -0.03 0.00 -0.03 0.00 0.00 56.01 57.02 2dlv n LEU 115 Cb 0.08 -0.54 -0.01 0.00 -2.33 0.00 0.00 43.42 40.62 2dlv n LEU 115 CO 0.06 -1.21 0.14 0.24 -1.33 0.00 0.00 177.39 175.29 2dlv h MET 116 N 0.00 -0.19 -0.36 3.23 2.86 -1.42 -3.24 114.93 115.81 2dlv h MET 116 Ca 0.61 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 58.37 2dlv h MET 116 Cb 1.76 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.45 2dlv h MET 116 CO -0.46 -0.13 0.96 1.49 1.06 0.00 0.00 176.91 179.83 2dlv h GLU 117 N -0.60 0.00 0.00 1.72 4.22 -0.33 0.22 114.58 119.80 2dlv h GLU 117 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.42 2dlv h GLU 117 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2dlv h GLU 117 CO 0.03 0.00 0.00 1.04 -2.18 0.00 0.00 179.01 177.90 2dlv n GLN 118 N -2.86 0.00 -0.01 1.92 6.02 -0.24 -4.33 117.38 117.87 2dlv n GLN 118 Ca 0.08 0.49 -0.02 0.00 -0.01 0.00 0.00 57.00 57.54 2dlv n GLN 118 Cb 1.08 -1.47 -0.01 0.00 1.02 0.00 0.00 30.24 30.86 2dlv n GLN 118 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2dlv n ASP 119 N -1.94 3.95 -0.26 1.08 5.68 -0.55 -4.47 116.55 120.03 2dlv n ASP 119 Ca 0.00 -0.01 0.07 0.00 -0.50 0.00 0.00 54.79 54.34 2dlv n ASP 119 Cb 0.00 0.09 0.18 0.00 -1.14 0.00 0.00 41.12 40.26 2dlv n ASP 119 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2dlv h SER 120 N 0.00 -0.21 0.35 -1.12 0.02 -0.84 0.31 113.55 112.06 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 0.30 0.00 0.00 0.14 0.00 0.00 62.40 63.94 2dlv h SER 120 CO -0.01 -0.14 -0.17 0.22 -1.14 0.00 0.00 176.83 175.59 2dlv h TYR 121 N 0.16 -0.44 -1.10 3.45 3.20 -1.63 -0.89 116.97 119.72 2dlv h TYR 121 Ca 0.44 -0.01 0.36 0.00 3.14 0.00 0.00 58.73 62.65 2dlv h TYR 121 Cb 0.79 0.14 -0.14 0.00 1.54 0.00 0.00 36.73 39.06 2dlv h TYR 121 CO -0.36 -0.27 0.66 1.79 -1.64 0.00 0.00 178.16 178.34 2dlv h THR 122 N -0.76 0.24 -0.06 1.81 1.35 -1.67 0.80 112.91 114.62 2dlv h THR 122 Ca -0.05 -0.08 -0.22 0.00 -0.55 0.00 0.00 66.41 65.51 2dlv h THR 122 Cb 0.36 -0.01 0.01 0.00 -1.73 0.00 0.00 68.15 66.78 2dlv h THR 122 CO 0.08 0.04 -0.86 -0.09 -0.25 0.00 0.00 175.52 174.44 2dlv h ARG 123 N 0.23 0.55 -0.83 4.72 2.43 -0.40 -3.23 114.38 117.84 2dlv h ARG 123 Ca 0.75 -0.51 -0.04 0.00 -0.81 0.00 0.00 59.98 59.38 2dlv h ARG 123 Cb 1.97 0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 31.61 2dlv h ARG 123 CO -0.53 1.14 0.37 0.35 -1.51 0.00 0.00 179.97 179.79 2dlv h PHE 124 N 0.34 1.23 -0.02 2.20 3.57 0.20 -0.24 116.94 124.23 2dlv h PHE 124 Ca -0.07 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.36 2dlv h PHE 124 Cb 1.48 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.85 2dlv h PHE 124 CO 0.07 0.90 0.02 -0.07 -2.23 0.00 0.00 178.31 177.00 2dlv h LEU 125 N 1.20 0.00 -3.07 0.59 3.38 -1.09 -0.41 115.31 115.91 2dlv h LEU 125 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2dlv h LEU 125 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2dlv h LEU 125 CO -0.03 0.00 0.00 2.29 0.09 0.00 0.00 178.44 180.79 2dlv n LYS 126 N -3.83 2.74 -3.08 1.13 2.85 -0.72 -4.79 118.16 112.47 2dlv n LYS 126 Ca -0.03 -2.39 -0.40 0.00 -1.05 0.00 0.00 58.31 54.45 2dlv n LYS 126 Cb 0.10 -1.51 -0.05 0.00 -0.65 0.00 0.00 35.03 32.92 2dlv n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2dlv s SER 127 N -1.60 6.76 0.36 -5.58 1.04 -0.16 -4.94 113.70 109.57 2dlv s SER 127 Ca 0.30 0.92 0.17 0.00 0.48 0.00 0.00 55.95 57.82 2dlv s SER 127 Cb 0.22 -2.37 1.23 0.00 0.10 0.00 0.00 66.02 65.20 2dlv s SER 127 CO 0.10 -0.28 1.58 0.44 0.98 0.00 0.00 173.24 176.06 2dlv h ASP 128 N 7.38 0.17 0.02 7.02 3.32 -1.90 0.39 116.42 132.83 2dlv h ASP 128 Ca -0.32 0.26 0.03 0.00 0.02 0.00 0.00 57.03 57.02 2dlv h ASP 128 Cb 1.15 0.31 -0.04 0.00 0.22 0.00 0.00 39.33 40.96 2dlv h ASP 128 CO 0.78 -0.42 -0.25 0.40 -1.72 0.00 0.00 179.24 178.04 2dlv h ILE 129 N 0.01 0.43 -0.70 0.35 2.04 -1.92 0.84 117.51 118.56 2dlv h ILE 129 Ca 0.80 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.66 2dlv h ILE 129 Cb 2.05 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 2dlv h ILE 129 CO -0.80 0.00 0.44 0.22 0.00 0.00 0.00 178.15 178.01 2dlv h TYR 130 N -0.40 0.91 0.00 1.37 3.20 -0.47 0.12 116.97 121.70 2dlv h TYR 130 Ca 0.06 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.85 2dlv h TYR 130 Cb 0.47 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 2dlv h TYR 130 CO -0.28 0.60 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.40 2dlv h LEU 131 N 0.95 0.00 0.12 2.82 3.38 -0.77 -3.14 115.31 118.67 2dlv h LEU 131 Ca 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 2dlv h LEU 131 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2dlv h LEU 131 CO -0.05 0.37 -0.06 -0.78 0.09 0.00 0.00 178.44 178.01 2dlv h ASP 132 N 0.00 -0.14 -1.25 -0.43 3.58 0.15 -0.06 116.42 118.27 2dlv h ASP 132 Ca -0.00 -0.19 0.44 0.00 0.42 0.00 0.00 57.03 57.69 2dlv h ASP 132 Cb 0.74 0.04 -0.14 0.00 1.72 0.00 0.00 39.33 41.68 2dlv h ASP 132 CO 0.05 0.42 0.78 0.17 -2.88 0.00 0.00 179.24 177.78 2dlv h LEU 133 N -1.01 0.27 0.04 2.28 8.10 -0.84 0.88 115.31 125.02 2dlv h LEU 133 Ca -0.02 0.17 -0.31 0.00 0.11 0.00 0.00 57.88 57.84 2dlv h LEU 133 Cb 0.32 0.17 -0.04 0.00 -0.44 0.00 0.00 40.66 40.67 2dlv h LEU 133 CO 0.03 -0.26 -1.72 0.00 -4.11 0.00 0.00 178.44 172.38 2dlv h MET 134 N 0.06 0.08 -6.22 0.17 -0.00 -1.62 -3.41 114.93 103.99 2dlv h MET 134 Ca 0.84 -0.14 -0.46 0.00 -0.00 0.00 0.00 59.70 59.94 2dlv h MET 134 Cb 2.52 0.05 -0.00 0.00 -0.00 0.00 0.00 31.60 34.17 2dlv h MET 134 CO -0.52 0.73 -0.75 -1.13 -0.00 0.00 0.00 176.91 175.24 2dlv n SER 135 N -3.19 -4.93 -4.74 -0.10 3.41 0.30 -4.54 113.62 99.84 2dlv n SER 135 Ca -0.19 -0.74 -0.30 0.00 -0.26 0.00 0.00 58.87 57.37 2dlv n SER 135 Cb 1.05 -4.09 0.12 0.00 -0.26 0.00 0.00 64.21 61.02 2dlv n SER 135 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dlv s GLY 136 N -3.36 1.65 0.93 5.00 0.00 -1.24 -5.02 107.32 105.28 2dlv s GLY 136 Ca 0.62 0.15 -0.12 0.00 0.00 0.00 0.00 44.72 45.38 2dlv s GLY 136 CO 0.81 0.57 1.09 2.56 0.00 0.00 0.00 173.10 178.13 2dlv s PRO 137 N -4.89 0.96 -0.13 2.90 0.04 -1.26 -4.97 135.00 127.65 2dlv s PRO 137 Ca 0.63 0.72 -0.29 0.00 0.04 0.00 0.00 61.00 62.09 2dlv s PRO 137 Cb -0.18 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 2dlv s PRO 137 CO 0.57 -2.42 1.20 0.45 0.04 0.00 0.00 177.00 176.84 2dlv s SER 138 N -3.43 7.02 -0.17 6.66 0.15 -1.26 -4.93 113.70 117.74 2dlv s SER 138 Ca 0.64 1.69 -0.13 0.00 0.70 0.00 0.00 55.95 58.85 2dlv s SER 138 Cb -0.18 -2.55 -0.08 0.00 -1.71 0.00 0.00 66.02 61.51 2dlv s SER 138 CO 0.57 -0.67 -0.11 -1.20 1.20 0.00 0.00 173.24 173.04 2dlv n SER 139 N 5.98 1.84 0.00 5.45 7.64 -1.26 -5.35 113.62 127.92 2dlv n SER 139 Ca 0.12 0.54 0.00 0.00 1.01 0.00 0.00 58.87 60.55 2dlv n SER 139 Cb 0.46 -0.88 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 2dlv n SER 139 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64