#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dll n GLY 4 N 0.00 -1.44 1.82 1.57 0.00 -1.26 -5.05 105.19 100.83 3dll n GLY 4 Ca 0.00 0.54 -0.13 0.00 0.00 0.00 0.00 46.02 46.43 3dll n GLY 4 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dll n LYS 5 N 0.00 1.64 0.00 1.61 4.01 -1.26 -4.85 118.16 119.30 3dll n LYS 5 Ca 0.00 -1.23 0.00 0.00 -0.51 0.00 0.00 58.31 56.57 3dll n LYS 5 Cb 0.00 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.03 3dll n LYS 5 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3dll n ALA 6 N 0.62 0.00 0.00 7.82 0.00 -1.26 -5.09 120.51 122.59 3dll n ALA 6 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3dll n ALA 6 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 3dll n ALA 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dll n GLY 7 N 0.08 -1.31 0.00 0.00 0.00 -1.26 -5.18 105.19 97.51 3dll n GLY 7 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3dll n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dll n ARG 8 N 0.00 0.00 0.00 1.61 5.12 -1.26 -5.19 116.66 116.94 3dll n ARG 8 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 3dll n ARG 8 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 3dll n ARG 8 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 3dll n LYS 9 N 0.00 0.00 -4.13 5.56 4.81 -1.26 -5.16 118.16 117.98 3dll n LYS 9 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 3dll n LYS 9 Cb 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 34.95 3dll n LYS 9 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 3dll s LEU 10 N 0.00 2.49 0.00 3.14 2.96 -1.26 -5.06 118.68 120.95 3dll s LEU 10 Ca 0.00 -0.98 0.00 0.00 -0.22 0.00 0.00 54.13 52.93 3dll s LEU 10 Cb 0.00 0.05 0.00 0.00 0.50 0.00 0.00 46.19 46.74 3dll s LEU 10 CO 0.00 -0.52 0.00 -0.46 -1.32 0.00 0.00 176.35 174.05 3dll n ASN 11 N 0.10 0.00 0.00 3.68 6.94 -1.26 -5.09 115.26 119.63 3dll n ASN 11 Ca -0.13 -0.98 0.00 0.00 -0.02 0.00 0.00 54.58 53.45 3dll n ASN 11 Cb 0.61 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.03 3dll n ASN 11 CO 0.00 0.00 0.00 -2.11 -1.03 0.00 0.00 177.26 174.12 3dll n ARG 12 N 0.00 0.00 -3.74 -3.83 1.85 -1.26 -5.15 116.66 104.53 3dll n ARG 12 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.48 3dll n ARG 12 Cb 0.24 0.00 -0.11 0.00 -1.05 0.00 0.00 32.46 31.55 3dll n ARG 12 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3dll s ASN 13 N 1.07 5.30 0.00 2.89 2.20 -1.26 -4.86 114.94 120.27 3dll s ASN 13 Ca 0.00 -2.23 0.00 0.00 -0.94 0.00 0.00 52.86 49.69 3dll s ASN 13 Cb 0.00 -1.85 0.00 0.00 -2.00 0.00 0.00 41.25 37.40 3dll s ASN 13 CO 0.00 -0.51 0.00 -1.54 -2.94 0.00 0.00 177.10 172.11 3dll n SER 14 N 4.34 0.00 0.00 3.54 3.41 -1.26 -1.57 113.62 122.09 3dll n SER 14 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3dll n SER 14 Cb 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 3dll n SER 14 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dll n SER 15 N 1.10 0.00 0.07 4.04 3.41 -1.26 0.22 113.62 121.20 3dll n SER 15 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 3dll n SER 15 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 3dll n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dll h ALA 16 N 0.00 -0.20 -0.84 7.33 0.00 -1.68 -2.47 119.26 121.40 3dll h ALA 16 Ca 0.00 -0.21 0.24 0.00 0.00 0.00 0.00 54.91 54.95 3dll h ALA 16 Cb 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3dll h ALA 16 CO 0.00 -0.39 1.04 -0.09 0.00 0.00 0.00 179.25 179.81 3dll h ARG 17 N -0.65 0.00 0.13 0.00 9.65 0.25 0.92 114.38 124.69 3dll h ARG 17 Ca -0.02 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 3dll h ARG 17 Cb 0.48 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.06 3dll h ARG 17 CO 0.03 0.00 -0.06 0.28 2.80 0.00 0.00 179.97 183.02 3dll h VAL 18 N 0.00 0.41 -1.05 0.20 2.07 -1.09 -2.75 116.25 114.04 3dll h VAL 18 Ca 0.40 -1.10 0.32 0.00 0.82 0.00 0.00 66.70 67.13 3dll h VAL 18 Cb 2.48 0.74 -0.13 0.00 -1.52 0.00 0.00 31.29 32.86 3dll h VAL 18 CO -0.00 0.13 0.62 0.00 0.02 0.00 0.00 177.57 178.33 3dll h ALA 19 N -0.76 2.06 -3.00 1.67 0.00 0.10 0.50 119.26 119.84 3dll h ALA 19 Ca -0.02 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3dll h ALA 19 Cb 0.34 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3dll h ALA 19 CO 0.03 -0.63 0.00 -0.11 0.00 0.00 0.00 179.25 178.54 3dll n LEU 20 N -4.92 0.00 -0.59 0.00 7.94 0.20 0.37 117.00 120.00 3dll n LEU 20 Ca 0.31 0.00 0.46 0.00 -1.11 0.00 0.00 56.01 55.67 3dll n LEU 20 Cb 0.99 0.00 0.72 0.00 0.53 0.00 0.00 43.42 45.66 3dll n LEU 20 CO 0.14 0.00 1.30 0.00 -1.11 0.00 0.00 177.39 177.72 3dll n ALA 21 N -3.00 1.61 0.07 1.96 0.00 -1.04 0.19 120.51 120.29 3dll n ALA 21 Ca 0.00 0.67 -0.03 0.00 0.00 0.00 0.00 53.44 54.08 3dll n ALA 21 Cb 0.00 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 3dll n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dll h ARG 22 N 0.00 -0.18 -0.94 0.00 3.08 0.37 -1.13 114.38 115.58 3dll h ARG 22 Ca 0.86 0.01 0.22 0.00 0.07 0.00 0.00 59.98 61.14 3dll h ARG 22 Cb 3.23 0.04 -0.18 0.00 0.08 0.00 0.00 29.97 33.15 3dll h ARG 22 CO -0.14 -0.12 -0.11 0.00 -1.07 0.00 0.00 179.97 178.53 3dll h ALA 23 N -1.74 0.86 0.00 0.04 0.00 1.79 0.92 119.26 121.13 3dll h ALA 23 Ca -0.02 0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3dll h ALA 23 Cb 0.15 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3dll h ALA 23 CO 0.03 -0.46 0.00 1.96 0.00 0.00 0.00 179.25 180.78 3dll h GLN 24 N 0.02 0.00 -0.25 0.00 4.20 0.37 -2.46 115.11 116.98 3dll h GLN 24 Ca 0.51 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.09 3dll h GLN 24 Cb 0.91 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.69 3dll h GLN 24 CO -0.92 0.00 -0.36 0.00 -0.67 0.00 0.00 178.83 176.88 3dll h ALA 25 N 2.14 0.38 -0.19 3.87 0.00 0.22 -3.08 119.26 122.61 3dll h ALA 25 Ca 0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 3dll h ALA 25 Cb 0.59 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3dll h ALA 25 CO 0.00 0.45 -0.03 1.15 0.00 0.00 0.00 179.25 180.82 3dll h THR 26 N 0.41 1.27 0.22 0.00 2.02 -1.08 -1.89 112.91 113.86 3dll h THR 26 Ca 0.03 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.25 3dll h THR 26 Cb 0.94 1.53 -0.03 0.00 -1.74 0.00 0.00 68.15 68.86 3dll h THR 26 CO 0.08 0.29 -0.41 0.00 0.37 0.00 0.00 175.52 175.86 3dll h ALA 27 N 0.75 -0.97 -0.20 6.16 0.00 -1.49 -1.10 119.26 122.41 3dll h ALA 27 Ca 0.05 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3dll h ALA 27 Cb 0.45 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.90 3dll h ALA 27 CO 0.01 -1.04 -0.39 1.25 0.00 0.00 0.00 179.25 179.08 3dll h LEU 28 N -0.67 -1.24 -2.72 0.00 6.46 -1.57 0.26 115.31 115.83 3dll h LEU 28 Ca -0.02 0.18 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 3dll h LEU 28 Cb 0.63 0.52 0.00 0.00 -0.73 0.00 0.00 40.66 41.08 3dll h LEU 28 CO -0.15 -0.39 0.08 -0.07 -0.62 0.00 0.00 178.44 177.29 3dll h LEU 29 N -0.42 0.00 0.00 2.25 3.38 -1.22 -1.69 115.31 117.61 3dll h LEU 29 Ca 0.10 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 3dll h LEU 29 Cb 0.59 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3dll h LEU 29 CO -0.43 0.00 -1.75 -1.14 0.09 0.00 0.00 178.44 175.21 3dll n ARG 30 N -3.01 0.65 -2.93 1.13 0.63 0.55 -4.63 116.66 109.04 3dll n ARG 30 Ca -0.03 0.03 -0.17 0.00 -0.92 0.00 0.00 57.85 56.76 3dll n ARG 30 Cb 0.14 -1.66 -0.01 0.00 0.45 0.00 0.00 32.46 31.38 3dll n ARG 30 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 3dll n GLU 31 N -2.63 1.46 0.00 -0.14 1.02 0.61 -5.03 120.64 115.93 3dll n GLU 31 Ca -0.12 -3.58 0.00 0.00 -0.02 0.00 0.00 57.16 53.44 3dll n GLU 31 Cb 0.78 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 3dll n GLU 31 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dll n GLY 32 N 0.05 0.00 3.53 0.62 0.00 -0.94 -4.11 105.19 104.35 3dll n GLY 32 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3dll n GLY 32 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dll s ARG 33 N 0.00 0.51 0.36 1.61 3.52 -1.26 0.23 118.95 123.92 3dll s ARG 33 Ca 0.00 1.23 0.08 0.00 -0.13 0.00 0.00 55.73 56.91 3dll s ARG 33 Cb 0.00 0.74 -0.04 0.00 -1.56 0.00 0.00 34.95 34.09 3dll s ARG 33 CO 0.00 -0.23 0.19 0.96 -0.81 0.00 0.00 175.30 175.42 3dll s ILE 34 N 2.80 2.91 0.17 4.11 -4.36 -0.98 -4.90 121.20 120.96 3dll s ILE 34 Ca -0.02 -1.62 0.11 0.00 -0.26 0.00 0.00 60.65 58.86 3dll s ILE 34 Cb -0.11 -3.01 -0.04 0.00 1.25 0.00 0.00 42.46 40.55 3dll s ILE 34 CO -0.19 -0.13 -0.23 -1.58 0.24 0.00 0.00 174.94 173.05 3dll s GLN 35 N -3.91 1.55 0.00 0.37 0.74 -1.26 -1.14 119.66 116.01 3dll s GLN 35 Ca 0.40 -1.45 0.00 0.00 0.05 0.00 0.00 55.36 54.36 3dll s GLN 35 Cb -0.02 -1.90 0.00 0.00 1.10 0.00 0.00 33.01 32.19 3dll s GLN 35 CO 0.24 0.42 0.00 -2.37 -0.55 0.00 0.00 175.29 173.02 3dll n THR 36 N 0.41 0.00 -0.87 -0.34 5.66 0.74 -4.95 114.28 114.94 3dll n THR 36 Ca -0.14 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.52 3dll n THR 36 Cb 0.55 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.28 3dll n THR 36 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3dll n THR 37 N -0.58 0.00 -0.41 1.09 -2.24 -1.26 -2.64 114.28 108.24 3dll n THR 37 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3dll n THR 37 Cb 0.00 -0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 68.02 3dll n THR 37 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3dll n LEU 38 N 1.42 -1.00 0.00 3.22 7.94 -1.14 -1.32 117.00 126.12 3dll n LEU 38 Ca 0.13 1.75 0.00 0.00 -1.11 0.00 0.00 56.01 56.79 3dll n LEU 38 Cb 0.01 -0.25 0.00 0.00 0.53 0.00 0.00 43.42 43.71 3dll n LEU 38 CO 0.40 -1.44 0.33 0.41 -1.11 0.00 0.00 177.39 175.98 3dll n THR 39 N -5.26 0.00 -0.60 1.96 -1.04 -1.26 -0.30 114.28 107.78 3dll n THR 39 Ca 0.03 1.16 0.47 0.00 -2.04 0.00 0.00 64.05 63.68 3dll n THR 39 Cb 0.27 -1.79 0.76 0.00 -1.82 0.00 0.00 70.33 67.75 3dll n THR 39 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 3dll h LYS 40 N 0.00 0.00 0.00 -2.82 1.57 -1.76 0.66 116.57 114.22 3dll h LYS 40 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dll h LYS 40 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3dll h LYS 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 3dll n ALA 41 N -2.74 0.00 0.00 3.86 0.00 -0.43 -2.53 120.51 118.68 3dll n ALA 41 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3dll n ALA 41 Cb 1.81 0.00 0.00 0.00 0.00 0.00 0.00 19.45 21.26 3dll n ALA 41 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dll n LYS 42 N -0.35 0.00 -0.00 0.00 5.02 0.59 0.49 118.16 123.90 3dll n LYS 42 Ca 0.00 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.36 3dll n LYS 42 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 34.92 3dll n LYS 42 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3dll n GLU 43 N -1.52 1.75 0.18 1.97 0.00 -0.86 -4.16 120.64 118.00 3dll n GLU 43 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 57.16 57.21 3dll n GLU 43 Cb 0.00 -1.24 0.21 0.00 0.00 0.00 0.00 31.44 30.41 3dll n GLU 43 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 3dll h LEU 44 N 0.00 0.00 0.00 -1.84 5.85 1.15 -3.37 115.31 117.10 3dll h LEU 44 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dll h LEU 44 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3dll h LEU 44 CO 0.00 0.31 0.00 -1.14 -0.34 0.00 0.00 178.44 177.27 3dll n ARG 45 N -3.26 0.00 -0.32 1.25 0.63 -1.11 -1.49 116.66 112.37 3dll n ARG 45 Ca 0.02 0.20 0.17 0.00 -0.92 0.00 0.00 57.85 57.32 3dll n ARG 45 Cb 0.59 -0.84 0.37 0.00 0.45 0.00 0.00 32.46 33.03 3dll n ARG 45 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 3dll h PRO 46 N 0.00 0.31 -0.65 -0.14 0.13 -1.83 0.33 132.00 130.15 3dll h PRO 46 Ca 0.00 -0.02 0.12 0.00 -0.87 0.00 0.00 66.00 65.23 3dll h PRO 46 Cb 0.00 -0.07 -0.09 0.00 0.13 0.00 0.00 31.00 30.97 3dll h PRO 46 CO 0.00 0.20 0.19 0.35 -0.23 0.00 0.00 178.00 178.51 3dll h PHE 47 N 0.32 0.32 0.12 1.56 3.57 -1.66 1.75 116.94 122.91 3dll h PHE 47 Ca 0.63 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 62.16 3dll h PHE 47 Cb 1.32 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 40.02 3dll h PHE 47 CO -0.13 0.01 -0.06 -0.24 -2.23 0.00 0.00 178.31 175.67 3dll h VAL 48 N 0.33 0.81 -1.38 1.41 3.04 0.10 -2.99 116.25 117.58 3dll h VAL 48 Ca 0.34 -1.29 0.43 0.00 -1.01 0.00 0.00 66.70 65.17 3dll h VAL 48 Cb 0.50 1.43 -0.11 0.00 -2.01 0.00 0.00 31.29 31.11 3dll h VAL 48 CO -0.39 0.24 0.92 -0.33 -1.01 0.00 0.00 177.57 177.00 3dll h GLU 49 N -0.93 0.10 0.00 4.17 5.08 -0.58 2.53 114.58 124.95 3dll h GLU 49 Ca -0.02 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3dll h GLU 49 Cb 0.51 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.74 3dll h GLU 49 CO 0.03 0.06 0.00 1.04 -1.00 0.00 0.00 179.01 179.14 3dll n GLN 50 N -4.50 0.17 -0.13 2.33 6.02 0.59 -3.31 117.38 118.55 3dll n GLN 50 Ca 0.36 0.12 -0.27 0.00 -0.01 0.00 0.00 57.00 57.19 3dll n GLN 50 Cb 1.44 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 31.09 3dll n GLN 50 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3dll n LEU 51 N -1.38 2.03 -0.33 1.08 4.77 0.85 -3.91 117.00 120.11 3dll n LEU 51 Ca 0.08 0.32 0.27 0.00 -0.03 0.00 0.00 56.01 56.64 3dll n LEU 51 Cb 0.20 -0.86 0.50 0.00 -2.33 0.00 0.00 43.42 40.93 3dll n LEU 51 CO 0.17 0.56 1.00 0.16 -1.33 0.00 0.00 177.39 177.95 3dll h ILE 52 N -0.90 0.04 -0.70 -0.08 3.07 -1.49 2.88 117.51 120.33 3dll h ILE 52 Ca -0.63 -0.01 -0.06 0.00 1.55 0.00 0.00 64.86 65.70 3dll h ILE 52 Cb 1.59 -0.00 -0.03 0.00 -0.27 0.00 0.00 36.82 38.11 3dll h ILE 52 CO -0.35 0.01 0.18 0.74 -1.05 0.00 0.00 178.15 177.67 3dll h THR 53 N 0.03 1.26 0.17 0.16 2.02 -1.73 -0.69 112.91 114.13 3dll h THR 53 Ca 0.77 -0.94 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 3dll h THR 53 Cb 1.93 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 3dll h THR 53 CO -0.79 0.36 -0.08 0.74 0.37 0.00 0.00 175.52 176.12 3dll h THR 54 N 1.05 0.91 -0.71 3.16 2.02 0.49 -2.58 112.91 117.24 3dll h THR 54 Ca 0.22 -0.33 0.20 0.00 0.77 0.00 0.00 66.41 67.28 3dll h THR 54 Cb 0.35 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 3dll h THR 54 CO -0.00 0.08 0.51 0.00 0.37 0.00 0.00 175.52 176.48 3dll h ALA 55 N 0.43 2.65 0.00 6.16 0.00 -0.74 -2.28 119.26 125.48 3dll h ALA 55 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dll h ALA 55 Cb 0.30 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3dll h ALA 55 CO 0.04 -0.86 0.00 1.63 0.00 0.00 0.00 179.25 180.06 3dll n LYS 56 N -4.33 0.21 -0.00 0.00 5.02 -0.30 -1.98 118.16 116.78 3dll n LYS 56 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 3dll n LYS 56 Cb 0.77 -1.39 -0.00 0.00 -0.02 0.00 0.00 35.03 34.39 3dll n LYS 56 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dll n GLY 57 N 1.43 0.52 4.45 0.72 0.00 -0.86 -4.99 105.19 106.45 3dll n GLY 57 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3dll n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dll n GLY 58 N 1.67 0.00 3.78 -0.02 0.00 -0.84 -4.84 105.19 104.95 3dll n GLY 58 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3dll n GLY 58 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dll s ASP 59 N 0.00 6.79 0.18 1.61 3.84 -1.26 -4.87 116.67 122.96 3dll s ASP 59 Ca 0.00 2.02 -0.19 0.00 -0.00 0.00 0.00 52.55 54.38 3dll s ASP 59 Cb 0.00 -2.58 0.12 0.00 -1.38 0.00 0.00 42.92 39.07 3dll s ASP 59 CO 0.00 -0.46 1.32 -0.11 -0.00 0.00 0.00 175.17 175.92 3dll n LEU 60 N -0.05 -0.67 -0.21 2.11 7.94 -1.26 -1.24 117.00 123.62 3dll n LEU 60 Ca 0.05 1.50 -0.05 0.00 -1.11 0.00 0.00 56.01 56.40 3dll n LEU 60 Cb 0.50 -0.29 -0.05 0.00 0.53 0.00 0.00 43.42 44.10 3dll n LEU 60 CO 0.45 -1.31 0.48 1.57 -1.11 0.00 0.00 177.39 177.47 3dll n HIS 61 N -5.20 -0.22 -0.40 1.96 -0.00 -1.26 0.77 115.22 110.88 3dll n HIS 61 Ca 0.06 0.62 -0.07 0.00 0.46 0.00 0.00 57.72 58.79 3dll n HIS 61 Cb 0.30 -0.54 -0.05 0.00 -0.12 0.00 0.00 29.99 29.59 3dll n HIS 61 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 3dll n SER 62 N -4.12 -0.90 -0.07 0.26 7.64 -0.38 -0.72 113.62 115.33 3dll n SER 62 Ca 0.01 1.74 -0.09 0.00 1.01 0.00 0.00 58.87 61.54 3dll n SER 62 Cb 0.13 -0.28 -0.03 0.00 -1.01 0.00 0.00 64.21 63.01 3dll n SER 62 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 3dll h ARG 63 N 0.00 -0.32 0.00 1.43 2.43 0.53 0.41 114.38 118.86 3dll h ARG 63 Ca 0.22 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 3dll h ARG 63 Cb 0.47 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3dll h ARG 63 CO -0.94 -0.21 0.00 0.00 -1.51 0.00 0.00 179.97 177.30 3dll h ARG 64 N -0.33 0.00 0.00 0.20 3.08 0.35 0.21 114.38 117.89 3dll h ARG 64 Ca 0.13 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.99 3dll h ARG 64 Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 3dll h ARG 64 CO -0.48 0.00 -0.91 -0.07 -1.07 0.00 0.00 179.97 177.44 3dll h LEU 65 N 0.00 0.00 -0.02 3.04 3.38 0.20 -2.80 115.31 119.10 3dll h LEU 65 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3dll h LEU 65 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3dll h LEU 65 CO 0.00 0.91 -0.28 0.58 0.09 0.00 0.00 178.44 179.74 3dll h VAL 66 N 0.00 1.49 -1.40 1.22 2.07 0.23 -3.00 116.25 116.87 3dll h VAL 66 Ca -0.01 -1.84 0.45 0.00 0.82 0.00 0.00 66.70 66.12 3dll h VAL 66 Cb 1.63 2.59 -0.11 0.00 -1.52 0.00 0.00 31.29 33.88 3dll h VAL 66 CO 0.12 0.51 0.94 0.00 0.02 0.00 0.00 177.57 179.16 3dll n ALA 67 N -2.52 1.37 0.28 1.67 0.00 0.61 0.37 120.51 122.28 3dll n ALA 67 Ca -0.09 0.71 0.17 0.00 0.00 0.00 0.00 53.44 54.23 3dll n ALA 67 Cb 0.50 -0.96 0.70 0.00 0.00 0.00 0.00 19.45 19.68 3dll n ALA 67 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3dll h GLN 68 N 0.00 0.00 0.00 0.00 4.20 -1.34 -3.41 115.11 114.55 3dll h GLN 68 Ca 0.80 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.51 3dll h GLN 68 Cb 2.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.57 3dll h GLN 68 CO -0.28 0.01 0.00 -0.25 -0.67 0.00 0.00 178.83 177.64 3dll n ASP 69 N -3.11 0.00 -4.68 1.46 8.00 1.16 -4.88 116.55 114.51 3dll n ASP 69 Ca 0.00 0.00 -0.46 0.00 0.71 0.00 0.00 54.79 55.04 3dll n ASP 69 Cb 0.30 -0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.35 3dll n ASP 69 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3dll n ILE 70 N -1.28 0.63 0.00 0.53 5.41 -1.05 -4.81 119.36 118.80 3dll n ILE 70 Ca 0.00 -0.11 -0.18 0.00 1.00 0.00 0.00 62.75 63.45 3dll n ILE 70 Cb 0.00 -2.01 -0.14 0.00 -0.71 0.00 0.00 39.64 36.78 3dll n ILE 70 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 3dll h HIS 71 N 9.60 0.38 -2.39 1.39 3.86 -1.86 -3.38 115.15 122.75 3dll h HIS 71 Ca -0.49 -0.28 -0.55 0.00 -1.16 0.00 0.00 60.37 57.90 3dll h HIS 71 Cb 1.26 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 29.69 3dll h HIS 71 CO 0.90 1.59 1.32 0.34 0.86 0.00 0.00 177.93 182.95 3dll s ASP 72 N -6.82 5.61 0.19 2.45 3.68 -1.26 -4.92 116.67 115.59 3dll s ASP 72 Ca -0.18 1.01 -0.24 0.00 2.13 0.00 0.00 52.55 55.28 3dll s ASP 72 Cb 0.07 -2.53 0.09 0.00 -1.45 0.00 0.00 42.92 39.10 3dll s ASP 72 CO 0.79 -1.98 1.53 0.29 0.13 0.00 0.00 175.17 175.93 3dll n LYS 73 N 8.69 -0.33 -0.30 4.34 5.02 -1.26 0.29 118.16 134.60 3dll n LYS 73 Ca 0.23 1.51 0.13 0.00 -2.02 0.00 0.00 58.31 58.17 3dll n LYS 73 Cb 0.49 -2.23 0.29 0.00 -0.02 0.00 0.00 35.03 33.56 3dll n LYS 73 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3dll h ASP 74 N 0.00 -0.05 0.33 4.39 3.32 -1.99 0.70 116.42 123.12 3dll h ASP 74 Ca 0.25 0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.50 3dll h ASP 74 Cb 0.50 0.29 0.00 0.00 0.22 0.00 0.00 39.33 40.35 3dll h ASP 74 CO -0.96 -0.18 -0.16 0.58 -1.72 0.00 0.00 179.24 176.80 3dll h VAL 75 N 0.18 0.00 -1.24 -1.35 2.07 -0.56 -2.75 116.25 112.60 3dll h VAL 75 Ca 0.56 -0.28 0.36 0.00 0.82 0.00 0.00 66.70 68.16 3dll h VAL 75 Cb 1.15 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.83 3dll h VAL 75 CO -0.68 0.00 0.85 1.62 0.02 0.00 0.00 177.57 179.37 3dll h VAL 76 N -0.72 0.35 -0.73 2.57 3.04 -1.12 3.24 116.25 122.88 3dll h VAL 76 Ca -0.05 -0.05 -0.02 0.00 -1.01 0.00 0.00 66.70 65.58 3dll h VAL 76 Cb 0.34 0.18 -0.04 0.00 -2.01 0.00 0.00 31.29 29.77 3dll h VAL 76 CO 0.07 0.03 0.40 0.03 -1.01 0.00 0.00 177.57 177.09 3dll h ARG 77 N 0.15 1.02 0.61 4.17 3.08 -0.82 -1.04 114.38 121.54 3dll h ARG 77 Ca 0.67 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 60.57 3dll h ARG 77 Cb 2.22 -0.20 0.01 0.00 0.08 0.00 0.00 29.97 32.08 3dll h ARG 77 CO -0.19 0.75 -0.29 -0.22 -1.07 0.00 0.00 179.97 178.94 3dll h LYS 78 N 1.02 -0.79 -0.82 0.04 3.64 0.62 -1.57 116.57 118.71 3dll h LYS 78 Ca 0.26 0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.81 3dll h LYS 78 Cb 0.03 0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 31.98 3dll h LYS 78 CO -0.04 -0.48 0.53 -0.24 -2.27 0.00 0.00 179.45 176.95 3dll h VAL 79 N -0.98 0.88 0.00 2.00 3.04 -0.98 0.31 116.25 120.53 3dll h VAL 79 Ca -0.08 -0.23 -0.23 0.00 -1.01 0.00 0.00 66.70 65.15 3dll h VAL 79 Cb 0.68 0.16 0.02 0.00 -2.01 0.00 0.00 31.29 30.14 3dll h VAL 79 CO 0.14 0.12 -0.91 -0.03 -1.01 0.00 0.00 177.57 175.88 3dll h MET 80 N 0.66 0.61 0.00 4.17 4.05 -1.10 -1.87 114.93 121.44 3dll h MET 80 Ca 0.39 -0.66 0.00 0.00 -0.28 0.00 0.00 59.70 59.16 3dll h MET 80 Cb 0.61 0.19 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 3dll h MET 80 CO -0.16 1.26 -1.56 -0.25 0.23 0.00 0.00 176.91 176.43 3dll n ASP 81 N -3.97 0.81 0.00 1.39 8.00 -0.60 -4.74 116.55 117.44 3dll n ASP 81 Ca -0.11 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.13 3dll n ASP 81 Cb 0.82 1.60 0.00 0.00 -0.02 0.00 0.00 41.12 43.52 3dll n ASP 81 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3dll n GLU 82 N -1.93 0.00 0.10 -1.24 1.02 0.11 -4.83 120.64 113.86 3dll n GLU 82 Ca -0.01 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.93 3dll n GLU 82 Cb 0.42 -0.49 -0.15 0.00 -0.02 0.00 0.00 31.44 31.20 3dll n GLU 82 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 3dll h VAL 83 N 0.00 1.27 0.19 2.62 -1.51 -1.52 -3.30 116.25 114.01 3dll h VAL 83 Ca 0.00 -2.82 -0.01 0.00 -1.23 0.00 0.00 66.70 62.64 3dll h VAL 83 Cb 0.91 2.90 0.00 0.00 -2.13 0.00 0.00 31.29 32.97 3dll h VAL 83 CO 0.00 0.84 -0.09 0.00 -1.23 0.00 0.00 177.57 177.09 3dll h ALA 84 N 0.38 -1.04 -0.89 5.19 0.00 -1.60 -2.76 119.26 118.55 3dll h ALA 84 Ca -0.22 -0.06 0.24 0.00 0.00 0.00 0.00 54.91 54.87 3dll h ALA 84 Cb 2.06 0.10 -0.17 0.00 0.00 0.00 0.00 17.79 19.78 3dll h ALA 84 CO 0.21 -1.02 -0.01 -2.30 0.00 0.00 0.00 179.25 176.13 3dll n PRO 85 N -2.71 -0.07 0.01 0.00 -0.02 -1.26 0.25 135.00 131.20 3dll n PRO 85 Ca -0.03 1.33 -0.13 0.00 -2.02 0.00 0.00 63.50 62.65 3dll n PRO 85 Cb 0.10 -2.11 -0.07 0.00 -0.02 0.00 0.00 33.50 31.41 3dll n PRO 85 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3dll h LYS 86 N 0.00 -0.51 -0.50 -0.52 1.57 -1.62 0.35 116.57 115.34 3dll h LYS 86 Ca 0.53 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 3dll h LYS 86 Cb 1.06 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3dll h LYS 86 CO -0.84 -0.34 0.00 0.66 -0.57 0.00 0.00 179.45 178.36 3dll n TYR 87 N -5.44 0.00 0.02 -1.35 4.01 0.69 -4.20 117.16 110.90 3dll n TYR 87 Ca -0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.67 3dll n TYR 87 Cb 0.37 -0.05 -0.01 0.00 -0.31 0.00 0.00 39.34 39.34 3dll n TYR 87 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dll h ALA 88 N 1.62 -0.67 0.00 -0.72 0.00 0.02 -1.98 119.26 117.53 3dll h ALA 88 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dll h ALA 88 Cb 0.25 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3dll h ALA 88 CO 0.00 -0.68 0.01 0.39 0.00 0.00 0.00 179.25 178.98 3dll n GLU 89 N -2.70 0.00 -3.41 0.00 1.02 -1.26 -4.63 120.64 109.65 3dll n GLU 89 Ca -0.01 0.40 -0.37 0.00 -0.02 0.00 0.00 57.16 57.16 3dll n GLU 89 Cb 0.04 -1.51 -0.06 0.00 -0.02 0.00 0.00 31.44 29.89 3dll n GLU 89 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3dll s ARG 90 N -2.80 4.30 -0.96 3.49 3.52 -0.75 -4.96 118.95 120.79 3dll s ARG 90 Ca 0.00 0.29 -0.26 0.00 -0.13 0.00 0.00 55.73 55.63 3dll s ARG 90 Cb 0.00 -3.43 -0.21 0.00 -1.56 0.00 0.00 34.95 29.75 3dll s ARG 90 CO 0.00 0.19 1.99 -2.30 -0.81 0.00 0.00 175.30 174.36 3dll n PRO 91 N 3.65 0.63 0.00 5.12 -0.02 -1.26 -4.63 135.00 138.49 3dll n PRO 91 Ca -0.09 -1.86 0.00 0.00 -2.02 0.00 0.00 63.50 59.53 3dll n PRO 91 Cb 0.52 -3.64 0.00 0.00 -0.02 0.00 0.00 33.50 30.35 3dll n PRO 91 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dll n GLY 92 N 5.78 0.00 0.00 -1.23 0.00 -1.26 -4.87 105.19 103.61 3dll n GLY 92 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3dll n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dll n GLY 93 N 1.19 -0.24 3.01 -0.02 0.00 -1.26 -5.13 105.19 102.74 3dll n GLY 93 Ca 0.00 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 3dll n GLY 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dll s TYR 94 N 0.00 2.27 0.00 1.61 5.04 -1.26 -5.02 117.35 119.99 3dll s TYR 94 Ca 0.00 -1.36 0.00 0.00 -2.44 0.00 0.00 57.07 53.27 3dll s TYR 94 Cb 0.00 -1.62 0.00 0.00 0.35 0.00 0.00 41.96 40.69 3dll s TYR 94 CO 0.00 -0.70 0.00 2.41 -1.34 0.00 0.00 175.55 175.92 3dll n THR 95 N 4.74 0.00 -3.83 4.34 -1.04 -1.05 -4.83 114.28 112.60 3dll n THR 95 Ca -0.16 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.73 3dll n THR 95 Cb 0.49 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.90 3dll n THR 95 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dll s ARG 96 N -1.60 0.46 -0.26 -2.82 1.70 -1.15 -5.06 118.95 110.23 3dll s ARG 96 Ca 0.00 -0.19 0.03 0.00 -0.47 0.00 0.00 55.73 55.10 3dll s ARG 96 Cb 0.00 0.20 0.06 0.00 -0.57 0.00 0.00 34.95 34.64 3dll s ARG 96 CO 0.00 -0.11 -0.09 0.42 -1.08 0.00 0.00 175.30 174.44 3dll s ILE 97 N -1.00 2.04 0.12 4.99 1.09 -1.26 -2.88 121.20 124.29 3dll s ILE 97 Ca -0.11 -1.57 0.05 0.00 -1.10 0.00 0.00 60.65 57.92 3dll s ILE 97 Cb -0.06 -2.19 -0.04 0.00 -1.06 0.00 0.00 42.46 39.11 3dll s ILE 97 CO 0.02 -0.06 0.03 -0.76 -0.10 0.00 0.00 174.94 174.07 3dll s LEU 98 N 1.16 3.54 -0.30 2.97 1.02 -0.15 -4.94 118.68 121.98 3dll s LEU 98 Ca -0.08 -0.18 -0.07 0.00 0.02 0.00 0.00 54.13 53.82 3dll s LEU 98 Cb -0.20 -2.24 0.01 0.00 0.02 0.00 0.00 46.19 43.79 3dll s LEU 98 CO -0.05 0.14 0.10 0.00 0.02 0.00 0.00 176.35 176.56 3dll s ARG 99 N -2.56 3.09 0.00 1.70 1.70 -1.26 0.90 118.95 122.51 3dll s ARG 99 Ca 0.27 -0.86 0.00 0.00 -0.47 0.00 0.00 55.73 54.67 3dll s ARG 99 Cb -0.11 -3.43 0.00 0.00 -0.57 0.00 0.00 34.95 30.84 3dll s ARG 99 CO 0.20 -0.46 0.00 0.28 -1.08 0.00 0.00 175.30 174.23 3dll n VAL 100 N 4.89 0.00 -2.98 4.99 0.31 -1.26 -4.92 118.33 119.36 3dll n VAL 100 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 3dll n VAL 100 Cb 0.48 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 3dll n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dll n GLY 101 N 0.81 4.10 3.77 2.92 0.00 -1.26 -4.91 105.19 110.63 3dll n GLY 101 Ca 0.00 -1.27 -0.38 0.00 0.00 0.00 0.00 46.02 44.36 3dll n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dll s THR 102 N -1.88 3.97 0.32 2.61 -4.23 -1.26 -0.09 115.64 115.07 3dll s THR 102 Ca 0.00 1.76 -0.17 0.00 -1.18 0.00 0.00 61.69 62.10 3dll s THR 102 Cb 0.00 -4.04 -0.09 0.00 1.34 0.00 0.00 72.50 69.71 3dll s THR 102 CO 0.00 0.26 0.76 -0.60 -0.54 0.00 0.00 174.62 174.50 3dll s ARG 103 N -1.78 4.08 0.12 3.99 3.52 0.15 -4.83 118.95 124.20 3dll s ARG 103 Ca 0.48 0.77 -0.01 0.00 -0.13 0.00 0.00 55.73 56.84 3dll s ARG 103 Cb -0.24 -2.48 -0.17 0.00 -1.56 0.00 0.00 34.95 30.50 3dll s ARG 103 CO 0.30 0.18 1.25 -0.09 -0.81 0.00 0.00 175.30 176.13 3dll h ARG 104 N 2.43 0.22 0.26 5.12 2.43 -1.97 -3.17 114.38 119.71 3dll h ARG 104 Ca -0.48 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 58.36 3dll h ARG 104 Cb 1.18 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 3dll h ARG 104 CO 0.65 1.09 -0.13 0.78 -1.51 0.00 0.00 179.97 180.85 3dll h GLY 105 N 1.84 -0.37 -1.77 2.80 0.00 -1.95 -3.39 103.07 100.22 3dll h GLY 105 Ca -0.08 0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.29 3dll h GLY 105 CO 0.17 -0.13 -0.65 2.09 0.00 0.00 0.00 176.54 178.01 3dll n ASP 106 N -5.09 1.92 -0.62 0.19 5.68 -1.26 -4.96 116.55 112.41 3dll n ASP 106 Ca -0.09 -3.50 -0.05 0.00 -0.50 0.00 0.00 54.79 50.65 3dll n ASP 106 Cb 0.26 -0.47 -0.02 0.00 -1.14 0.00 0.00 41.12 39.75 3dll n ASP 106 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dll n GLY 107 N -0.77 0.51 3.73 6.12 0.00 -1.20 -4.89 105.19 108.69 3dll n GLY 107 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3dll n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dll s VAL 108 N -1.21 4.34 -0.64 1.61 1.01 -1.26 -4.64 120.40 119.62 3dll s VAL 108 Ca 0.00 1.94 -0.26 0.00 0.00 0.00 0.00 61.98 63.66 3dll s VAL 108 Cb 0.00 -4.24 0.04 0.00 0.00 0.00 0.00 36.38 32.18 3dll s VAL 108 CO 0.00 0.30 1.12 0.28 0.00 0.00 0.00 175.10 176.80 3dll s THR 109 N 0.01 4.07 0.76 3.92 -1.32 -1.26 0.34 115.64 122.16 3dll s THR 109 Ca 0.48 0.38 -0.13 0.00 -1.21 0.00 0.00 61.69 61.22 3dll s THR 109 Cb -0.25 -4.73 0.19 0.00 -1.51 0.00 0.00 72.50 66.19 3dll s THR 109 CO 0.31 -1.47 0.75 0.23 -2.21 0.00 0.00 174.62 172.24 3dll n MET 110 N 8.37 -2.01 -3.61 7.08 2.81 0.87 -2.89 117.12 127.75 3dll n MET 110 Ca 0.03 -1.19 0.01 0.00 -1.81 0.00 0.00 57.70 54.73 3dll n MET 110 Cb 0.48 -1.03 -0.01 0.00 -0.71 0.00 0.00 33.22 31.96 3dll n MET 110 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3dll s ALA 111 N -3.26 -2.23 0.14 3.04 0.00 -1.08 -3.99 121.76 114.37 3dll s ALA 111 Ca 0.47 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.45 3dll s ALA 111 Cb -0.04 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 3dll s ALA 111 CO 0.35 -0.95 -0.17 -0.48 0.00 0.00 0.00 175.76 174.51 3dll s LEU 112 N -2.79 2.40 -0.29 0.00 2.34 0.26 -0.19 118.68 120.41 3dll s LEU 112 Ca 0.13 -0.81 -0.02 0.00 0.06 0.00 0.00 54.13 53.49 3dll s LEU 112 Cb 0.04 -0.74 0.10 0.00 -0.56 0.00 0.00 46.19 45.02 3dll s LEU 112 CO -0.04 -0.05 0.10 -0.51 -1.06 0.00 0.00 176.35 174.78 3dll s ILE 113 N -1.90 0.53 0.10 1.48 2.07 -0.29 -0.98 121.20 122.22 3dll s ILE 113 Ca 0.11 -1.10 0.01 0.00 -1.41 0.00 0.00 60.65 58.27 3dll s ILE 113 Cb -0.06 -1.38 -0.04 0.00 0.13 0.00 0.00 42.46 41.11 3dll s ILE 113 CO 0.05 -0.64 0.23 -1.83 -1.91 0.00 0.00 174.94 170.84 3dll s GLU 114 N 1.80 3.39 0.00 3.50 -1.05 -1.14 -2.32 118.70 122.87 3dll s GLU 114 Ca 0.08 -0.54 0.00 0.00 -0.15 0.00 0.00 54.97 54.36 3dll s GLU 114 Cb -0.17 -2.97 0.00 0.00 -0.44 0.00 0.00 34.13 30.55 3dll s GLU 114 CO -0.27 0.56 0.26 1.28 0.95 0.00 0.00 175.26 178.05