#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl1 n SER 2 N 0.00 3.68 -3.75 1.61 3.41 -1.26 -5.00 113.62 112.31 2dl1 n SER 2 Ca 0.00 -0.03 -0.25 0.00 -0.26 0.00 0.00 58.87 58.33 2dl1 n SER 2 Cb 0.00 0.80 -0.17 0.00 -0.26 0.00 0.00 64.21 64.58 2dl1 n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dl1 s SER 3 N -1.53 2.12 0.00 4.04 1.04 -1.26 -4.95 113.70 113.15 2dl1 s SER 3 Ca 0.00 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.05 2dl1 s SER 3 Cb 0.00 -0.50 0.00 0.00 0.10 0.00 0.00 66.02 65.62 2dl1 s SER 3 CO 0.00 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.59 2dl1 n GLY 4 N 5.11 0.05 1.00 7.32 0.00 -1.26 -5.05 105.19 112.37 2dl1 n GLY 4 Ca -0.08 -0.08 -0.00 0.00 0.00 0.00 0.00 46.02 45.86 2dl1 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dl1 n SER 5 N -1.74 0.41 0.00 1.61 2.88 -1.26 -5.09 113.62 110.43 2dl1 n SER 5 Ca 0.00 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2dl1 n SER 5 Cb 0.00 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2dl1 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dl1 n SER 6 N -2.87 0.00 0.00 -3.46 2.88 -1.26 -5.16 113.62 103.75 2dl1 n SER 6 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2dl1 n SER 6 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dl1 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl1 n GLY 7 N 0.00 4.15 3.22 0.46 0.00 -1.26 -5.09 105.19 106.67 2dl1 n GLY 7 Ca 0.00 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 2dl1 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dl1 s GLU 8 N -2.80 0.56 0.27 1.61 8.01 -1.26 -5.13 118.70 119.96 2dl1 s GLU 8 Ca 0.00 -0.00 -0.29 0.00 0.01 0.00 0.00 54.97 54.69 2dl1 s GLU 8 Cb 0.00 0.25 -0.09 0.00 -4.31 0.00 0.00 34.13 29.98 2dl1 s GLU 8 CO 0.00 -0.13 1.26 -1.25 0.01 0.00 0.00 175.26 175.14 2dl1 s PRO 9 N -0.85 4.44 0.33 0.39 0.04 -1.26 -4.89 135.00 133.20 2dl1 s PRO 9 Ca -0.09 2.05 0.21 0.00 0.04 0.00 0.00 61.00 63.21 2dl1 s PRO 9 Cb -0.04 -3.15 1.16 0.00 0.04 0.00 0.00 34.50 32.51 2dl1 s PRO 9 CO 0.03 -0.11 1.65 0.00 0.04 0.00 0.00 177.00 178.60 2dl1 n ALA 10 N 1.60 1.00 0.11 8.56 0.00 -1.26 -2.59 120.51 127.93 2dl1 n ALA 10 Ca 0.02 0.20 -0.05 0.00 0.00 0.00 0.00 53.44 53.61 2dl1 n ALA 10 Cb 0.43 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 2dl1 n ALA 10 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2dl1 h GLU 11 N 0.00 -0.33 -0.43 0.00 5.08 -2.01 -3.28 114.58 113.61 2dl1 h GLU 11 Ca 0.00 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.44 2dl1 h GLU 11 Cb 0.06 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.30 2dl1 h GLU 11 CO 0.00 -0.22 -0.53 0.82 -1.00 0.00 0.00 179.01 178.08 2dl1 h ILE 12 N -0.87 0.03 -0.81 3.13 2.04 -1.90 -0.01 117.51 119.12 2dl1 h ILE 12 Ca -0.04 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.04 2dl1 h ILE 12 Cb 0.26 0.03 -0.15 0.00 -0.74 0.00 0.00 36.82 36.22 2dl1 h ILE 12 CO 0.06 0.00 -0.03 1.17 0.00 0.00 0.00 178.15 179.35 2dl1 n LYS 13 N -5.38 -0.07 -0.16 2.37 4.81 -1.20 0.21 118.16 118.75 2dl1 n LYS 13 Ca -0.02 1.23 -0.12 0.00 -0.87 0.00 0.00 58.31 58.53 2dl1 n LYS 13 Cb 0.34 -1.92 -0.00 0.00 0.02 0.00 0.00 35.03 33.47 2dl1 n LYS 13 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 2dl1 h ILE 14 N 0.00 1.27 -0.82 3.15 2.04 -1.09 -3.06 117.51 119.00 2dl1 h ILE 14 Ca 0.47 -1.39 -0.04 0.00 1.00 0.00 0.00 64.86 64.90 2dl1 h ILE 14 Cb 0.93 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 38.12 2dl1 h ILE 14 CO -0.78 0.48 0.37 0.40 0.00 0.00 0.00 178.15 178.62 2dl1 h ILE 15 N 0.84 1.26 0.49 -0.67 2.04 0.34 -1.18 117.51 120.63 2dl1 h ILE 15 Ca 0.11 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 2dl1 h ILE 15 Cb 0.81 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2dl1 h ILE 15 CO 0.07 0.32 -0.49 0.03 0.00 0.00 0.00 178.15 178.07 2dl1 h ARG 16 N 1.17 -0.95 -0.69 2.37 2.47 -0.50 0.25 114.38 118.50 2dl1 h ARG 16 Ca 0.28 0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 59.06 2dl1 h ARG 16 Cb 0.16 0.22 -0.03 0.00 -1.65 0.00 0.00 29.97 28.66 2dl1 h ARG 16 CO -0.03 -0.64 0.43 1.49 0.56 0.00 0.00 179.97 181.78 2dl1 h GLU 17 N -0.99 0.92 0.00 0.04 4.81 -1.49 0.93 114.58 118.80 2dl1 h GLU 17 Ca -0.06 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 2dl1 h GLU 17 Cb 0.86 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 2dl1 h GLU 17 CO -0.06 0.63 -0.09 0.00 -0.73 0.00 0.00 179.01 178.76 2dl1 h ALA 18 N 1.53 1.07 0.10 2.92 0.00 -0.74 -0.30 119.26 123.83 2dl1 h ALA 18 Ca 0.25 -0.09 -0.35 0.00 0.00 0.00 0.00 54.91 54.72 2dl1 h ALA 18 Cb -0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2dl1 h ALA 18 CO -0.05 0.12 -1.94 0.98 0.00 0.00 0.00 179.25 178.36 2dl1 n TYR 19 N -3.30 1.18 0.10 0.00 9.36 0.85 -3.23 117.16 122.12 2dl1 n TYR 19 Ca -0.00 0.28 -0.09 0.00 3.32 0.00 0.00 57.90 61.41 2dl1 n TYR 19 Cb 0.31 -1.17 -0.06 0.00 -0.63 0.00 0.00 39.34 37.79 2dl1 n TYR 19 CO 0.00 0.00 0.00 -0.22 0.22 0.00 0.00 176.86 176.86 2dl1 h LYS 20 N 0.05 -0.31 -0.88 2.98 3.64 -0.75 -2.60 116.57 118.70 2dl1 h LYS 20 Ca -0.39 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.07 2dl1 h LYS 20 Cb 2.03 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 33.86 2dl1 h LYS 20 CO 0.08 -0.00 0.55 0.87 -2.27 0.00 0.00 179.45 178.68 2dl1 h LYS 21 N -0.98 0.98 -0.82 1.90 1.57 -1.27 0.73 116.57 118.68 2dl1 h LYS 21 Ca -0.03 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2dl1 h LYS 21 Cb 0.46 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.51 2dl1 h LYS 21 CO 0.05 0.65 0.48 0.00 -0.57 0.00 0.00 179.45 180.07 2dl1 h ALA 22 N 1.41 1.31 0.00 3.86 0.00 -1.63 -0.33 119.26 123.88 2dl1 h ALA 22 Ca 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2dl1 h ALA 22 Cb 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2dl1 h ALA 22 CO -0.17 0.58 -0.57 1.19 0.00 0.00 0.00 179.25 180.28 2dl1 n PHE 23 N -4.37 0.43 -0.07 0.00 3.72 -0.64 -3.51 117.46 113.03 2dl1 n PHE 23 Ca 0.09 0.13 -0.15 0.00 -0.05 0.00 0.00 57.45 57.46 2dl1 n PHE 23 Cb 0.07 -0.58 -0.13 0.00 -0.94 0.00 0.00 39.48 37.90 2dl1 n PHE 23 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2dl1 h LEU 24 N 0.00 0.01 -0.90 4.37 5.85 0.12 -3.04 115.31 121.73 2dl1 h LEU 24 Ca 0.00 -0.94 0.00 0.00 0.84 0.00 0.00 57.88 57.78 2dl1 h LEU 24 Cb 0.69 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.71 2dl1 h LEU 24 CO 0.00 1.07 0.00 -0.26 -0.34 0.00 0.00 178.44 178.91 2dl1 h PHE 25 N -0.98 0.00 0.00 1.25 0.04 -1.24 -3.10 116.94 112.91 2dl1 h PHE 25 Ca -0.04 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 2dl1 h PHE 25 Cb 1.06 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.20 2dl1 h PHE 25 CO 0.26 0.00 -0.04 0.28 -0.60 0.00 0.00 178.31 178.21 2dl1 h VAL 26 N 0.00 1.46 0.00 -0.55 2.07 -1.63 -3.17 116.25 114.43 2dl1 h VAL 26 Ca 0.00 -2.11 0.00 0.00 0.82 0.00 0.00 66.70 65.41 2dl1 h VAL 26 Cb 0.34 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2dl1 h VAL 26 CO 0.00 0.50 0.32 -1.13 0.02 0.00 0.00 177.57 177.28 2dl1 h ASN 27 N -1.00 0.00 0.00 0.57 -0.73 -1.45 -2.07 115.58 110.90 2dl1 h ASN 27 Ca -0.01 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.16 2dl1 h ASN 27 Cb 0.84 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.43 2dl1 h ASN 27 CO -0.01 0.00 -0.15 0.11 -0.37 0.00 0.00 177.43 177.01 2dl1 h LYS 28 N 0.00 0.00 -0.83 6.67 1.57 -1.61 -3.32 116.57 119.05 2dl1 h LYS 28 Ca 0.00 0.00 0.20 0.00 -1.87 0.00 0.00 60.65 58.98 2dl1 h LYS 28 Cb 0.65 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.81 2dl1 h LYS 28 CO 0.00 0.00 -0.00 0.78 -0.57 0.00 0.00 179.45 179.66 2dl1 h GLY 29 N -0.79 0.94 0.14 3.86 0.00 -1.35 0.25 103.07 106.11 2dl1 h GLY 29 Ca 0.00 0.13 0.15 0.00 0.00 0.00 0.00 47.33 47.61 2dl1 h GLY 29 CO 0.00 -0.35 0.33 1.41 0.00 0.00 0.00 176.54 177.93 2dl1 h LEU 30 N 0.08 0.33 0.75 3.11 3.38 -1.65 -0.62 115.31 120.69 2dl1 h LEU 30 Ca 0.46 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.51 2dl1 h LEU 30 Cb 0.85 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 2dl1 h LEU 30 CO -0.75 0.12 -0.46 -1.13 0.09 0.00 0.00 178.44 176.32 2dl1 h ASN 31 N 0.47 -1.14 -0.95 -0.43 -1.24 -0.61 -2.48 115.58 109.20 2dl1 h ASN 31 Ca 0.43 0.06 0.22 0.00 0.71 0.00 0.00 56.30 57.72 2dl1 h ASN 31 Cb 0.66 0.33 -0.07 0.00 0.73 0.00 0.00 38.32 39.97 2dl1 h ASN 31 CO -0.40 -0.70 0.62 0.71 -1.29 0.00 0.00 177.43 176.36 2dl1 h THR 32 N -1.13 0.64 -0.40 -3.57 1.35 -1.14 0.31 112.91 108.97 2dl1 h THR 32 Ca -0.10 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 2dl1 h THR 32 Cb 0.90 0.19 -0.02 0.00 -1.73 0.00 0.00 68.15 67.49 2dl1 h THR 32 CO 0.11 0.08 0.19 -0.78 -0.25 0.00 0.00 175.52 174.86 2dl1 h ASP 33 N 0.42 0.49 0.05 5.36 1.82 -0.70 0.11 116.42 123.97 2dl1 h ASP 33 Ca 0.51 -0.04 -0.25 0.00 -0.39 0.00 0.00 57.03 56.86 2dl1 h ASP 33 Cb 1.25 -0.12 0.02 0.00 0.68 0.00 0.00 39.33 41.15 2dl1 h ASP 33 CO -0.21 0.43 -0.98 -0.33 -1.61 0.00 0.00 179.24 176.54 2dl1 h GLU 34 N 0.55 0.66 0.00 0.28 4.39 0.02 -3.20 114.58 117.27 2dl1 h GLU 34 Ca 0.14 -0.67 -0.08 0.00 0.34 0.00 0.00 59.36 59.09 2dl1 h GLU 34 Cb 0.07 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2dl1 h GLU 34 CO -0.02 1.27 -0.37 -0.07 -1.16 0.00 0.00 179.01 178.66 2dl1 h LEU 35 N 0.38 0.00 0.00 1.33 4.07 -0.94 -3.46 115.31 116.69 2dl1 h LEU 35 Ca -0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.85 2dl1 h LEU 35 Cb 1.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.36 2dl1 h LEU 35 CO 0.19 0.37 0.00 0.61 -1.08 0.00 0.00 178.44 178.53 2dl1 n GLY 36 N -0.39 1.37 3.22 0.83 0.00 -0.35 -5.05 105.19 104.82 2dl1 n GLY 36 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 2dl1 n GLY 36 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dl1 n GLN 37 N -0.64 3.73 -0.13 1.61 6.02 0.25 -4.82 117.38 123.40 2dl1 n GLN 37 Ca 0.00 -4.19 0.03 0.00 -0.01 0.00 0.00 57.00 52.84 2dl1 n GLN 37 Cb 0.00 -2.72 0.34 0.00 1.02 0.00 0.00 30.24 28.88 2dl1 n GLN 37 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2dl1 h LYS 38 N 6.35 0.76 0.55 -1.09 1.79 -1.89 -1.67 116.57 121.37 2dl1 h LYS 38 Ca 0.25 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.66 2dl1 h LYS 38 Cb 0.77 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 2dl1 h LYS 38 CO 1.24 0.50 -0.44 0.93 -1.08 0.00 0.00 179.45 180.61 2dl1 h GLU 39 N 0.78 -0.92 -0.74 3.15 5.08 -1.95 0.02 114.58 120.00 2dl1 h GLU 39 Ca 0.24 0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.71 2dl1 h GLU 39 Cb -0.01 0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 2dl1 h GLU 39 CO -0.06 -0.62 0.44 0.93 -1.00 0.00 0.00 179.01 178.71 2dl1 h GLU 40 N -0.96 0.80 0.39 2.33 3.07 -1.93 -2.84 114.58 115.44 2dl1 h GLU 40 Ca -0.07 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.73 2dl1 h GLU 40 Cb 0.80 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.51 2dl1 h GLU 40 CO 0.01 0.53 -0.44 0.00 -1.40 0.00 0.00 179.01 177.71 2dl1 h ALA 41 N 1.35 -1.08 -0.91 3.43 0.00 -1.09 -1.59 119.26 119.38 2dl1 h ALA 41 Ca 0.32 -0.15 0.24 0.00 0.00 0.00 0.00 54.91 55.31 2dl1 h ALA 41 Cb 0.13 0.69 -0.16 0.00 0.00 0.00 0.00 17.79 18.45 2dl1 h ALA 41 CO -0.16 -1.12 0.06 0.87 0.00 0.00 0.00 179.25 178.91 2dl1 h LYS 42 N -0.84 0.07 -0.10 0.00 1.57 -0.84 0.27 116.57 116.70 2dl1 h LYS 42 Ca -0.05 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2dl1 h LYS 42 Cb 0.74 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2dl1 h LYS 42 CO -0.08 0.04 -0.00 -0.97 -0.57 0.00 0.00 179.45 177.87 2dl1 h ASN 43 N 0.07 -0.04 -0.53 0.86 -1.24 -1.21 -0.86 115.58 112.64 2dl1 h ASN 43 Ca 0.54 0.02 0.09 0.00 0.71 0.00 0.00 56.30 57.66 2dl1 h ASN 43 Cb 1.08 0.04 -0.07 0.00 0.73 0.00 0.00 38.32 40.09 2dl1 h ASN 43 CO -0.81 -0.00 0.11 1.88 -1.29 0.00 0.00 177.43 177.32 2dl1 h TYR 44 N 0.03 0.17 -0.62 0.67 0.05 0.47 -0.72 116.97 117.01 2dl1 h TYR 44 Ca 0.04 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.81 2dl1 h TYR 44 Cb 0.05 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 2dl1 h TYR 44 CO -0.13 -0.01 0.20 1.88 -1.05 0.00 0.00 178.16 179.05 2dl1 h TYR 45 N 0.24 0.97 0.00 4.88 0.05 -0.96 -1.15 116.97 121.00 2dl1 h TYR 45 Ca 0.27 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.97 2dl1 h TYR 45 Cb 0.37 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 37.83 2dl1 h TYR 45 CO -0.23 0.77 0.00 1.63 -1.05 0.00 0.00 178.16 179.28 2dl1 n LYS 46 N -4.28 0.16 -0.06 4.88 5.02 -0.36 -1.16 118.16 122.37 2dl1 n LYS 46 Ca 0.05 0.42 -0.21 0.00 -2.02 0.00 0.00 58.31 56.54 2dl1 n LYS 46 Cb 0.21 -1.82 -0.13 0.00 -0.02 0.00 0.00 35.03 33.27 2dl1 n LYS 46 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2dl1 n GLN 47 N -2.13 0.69 0.01 1.97 1.13 -0.54 -4.14 117.38 114.37 2dl1 n GLN 47 Ca 0.02 0.28 -0.15 0.00 -1.94 0.00 0.00 57.00 55.21 2dl1 n GLN 47 Cb 0.20 -1.64 -0.04 0.00 0.11 0.00 0.00 30.24 28.86 2dl1 n GLN 47 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2dl1 h GLY 48 N 0.84 0.73 0.38 1.08 0.00 -1.14 -3.27 103.07 101.70 2dl1 h GLY 48 Ca -0.48 -1.06 0.09 0.00 0.00 0.00 0.00 47.33 45.87 2dl1 h GLY 48 CO -0.05 0.94 0.16 -2.22 0.00 0.00 0.00 176.54 175.37 2dl1 h ILE 49 N 0.44 0.75 0.00 2.60 2.04 -1.35 0.14 117.51 122.14 2dl1 h ILE 49 Ca -0.05 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 2dl1 h ILE 49 Cb 1.41 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2dl1 h ILE 49 CO 0.16 0.06 -0.04 1.23 0.00 0.00 0.00 178.15 179.55 2dl1 h GLY 50 N 0.32 0.00 0.98 5.37 0.00 -1.71 -2.44 103.07 105.58 2dl1 h GLY 50 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.27 2dl1 h GLY 50 CO -0.31 0.00 -1.72 0.45 0.00 0.00 0.00 176.54 174.96 2dl1 h HIS 51 N 0.00 0.52 -0.83 5.60 3.86 -0.95 -3.19 115.15 120.16 2dl1 h HIS 51 Ca -0.00 -0.38 0.14 0.00 -1.16 0.00 0.00 60.37 58.97 2dl1 h HIS 51 Cb 0.13 -0.02 -0.09 0.00 1.06 0.00 0.00 27.41 28.49 2dl1 h HIS 51 CO 0.00 1.54 0.43 -0.07 0.86 0.00 0.00 177.93 180.69 2dl1 h LEU 52 N 0.08 0.53 -0.16 2.43 3.38 -0.34 -1.34 115.31 119.89 2dl1 h LEU 52 Ca -0.32 0.09 -0.23 0.00 0.09 0.00 0.00 57.88 57.51 2dl1 h LEU 52 Cb 2.05 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.81 2dl1 h LEU 52 CO 0.15 0.24 -0.79 -0.07 0.09 0.00 0.00 178.44 178.06 2dl1 h LEU 53 N 0.64 0.93 -1.94 1.67 3.38 -1.67 -2.98 115.31 115.33 2dl1 h LEU 53 Ca 0.45 -0.62 0.28 0.00 0.09 0.00 0.00 57.88 58.08 2dl1 h LEU 53 Cb 0.60 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2dl1 h LEU 53 CO -0.34 1.42 0.69 -0.09 0.09 0.00 0.00 178.44 180.21 2dl1 h ARG 54 N 0.53 0.04 0.00 1.13 2.43 -1.23 0.73 114.38 118.01 2dl1 h ARG 54 Ca -0.06 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2dl1 h ARG 54 Cb 1.42 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.96 2dl1 h ARG 54 CO 0.16 0.03 -1.07 0.41 -1.51 0.00 0.00 179.97 177.99 2dl1 n GLY 55 N -1.70 -1.43 0.29 2.80 0.00 -1.00 -3.91 105.19 100.24 2dl1 n GLY 55 Ca 0.21 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 46.09 2dl1 n GLY 55 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dl1 n ILE 56 N -2.64 0.00 -1.31 -0.61 5.41 0.15 -4.20 119.36 116.15 2dl1 n ILE 56 Ca -0.00 -0.15 -0.27 0.00 1.00 0.00 0.00 62.75 63.32 2dl1 n ILE 56 Cb 0.55 0.93 0.13 0.00 -0.71 0.00 0.00 39.64 40.54 2dl1 n ILE 56 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2dl1 n SER 57 N -0.62 5.38 0.00 4.38 7.64 0.21 -4.76 113.62 125.84 2dl1 n SER 57 Ca 0.08 -3.70 0.00 0.00 1.01 0.00 0.00 58.87 56.26 2dl1 n SER 57 Cb 0.40 -0.87 0.00 0.00 -1.01 0.00 0.00 64.21 62.73 2dl1 n SER 57 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2dl1 n ILE 58 N -1.04 0.00 0.00 0.44 2.08 -1.26 -5.02 119.36 114.57 2dl1 n ILE 58 Ca 0.59 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.90 2dl1 n ILE 58 Cb 1.19 -0.09 0.00 0.00 -0.75 0.00 0.00 39.64 39.99 2dl1 n ILE 58 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 2dl1 n SER 59 N 0.00 0.00 -2.11 4.38 7.64 -1.26 -5.00 113.62 117.27 2dl1 n SER 59 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2dl1 n SER 59 Cb 0.00 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 2dl1 n SER 59 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dl1 n SER 60 N -1.01 -0.79 0.00 6.43 3.41 -1.26 -4.81 113.62 115.60 2dl1 n SER 60 Ca 0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 2dl1 n SER 60 Cb 0.00 -0.83 0.00 0.00 -0.26 0.00 0.00 64.21 63.12 2dl1 n SER 60 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2dl1 n LYS 61 N -2.05 0.00 -4.96 4.33 4.01 -1.26 -4.95 118.16 113.27 2dl1 n LYS 61 Ca 0.00 0.00 -0.26 0.00 -0.51 0.00 0.00 58.31 57.54 2dl1 n LYS 61 Cb 0.39 -0.20 -0.16 0.00 -0.51 0.00 0.00 35.03 34.56 2dl1 n LYS 61 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2dl1 s GLU 62 N 0.00 1.62 0.00 1.97 -6.30 -1.26 -5.11 118.70 109.61 2dl1 s GLU 62 Ca 0.00 -0.71 0.00 0.00 -2.50 0.00 0.00 54.97 51.76 2dl1 s GLU 62 Cb 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 34.13 32.57 2dl1 s GLU 62 CO 0.00 0.42 0.00 0.43 0.02 0.00 0.00 175.26 176.13 2dl1 n SER 63 N 2.62 0.00 0.00 -1.70 7.64 -1.26 -5.06 113.62 115.86 2dl1 n SER 63 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.73 2dl1 n SER 63 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 2dl1 n SER 63 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dl1 n GLU 64 N -0.80 0.00 0.00 1.43 4.71 -1.26 -4.66 120.64 120.06 2dl1 n GLU 64 Ca 0.00 0.75 0.00 0.00 -0.01 0.00 0.00 57.16 57.90 2dl1 n GLU 64 Cb 0.00 -1.41 0.00 0.00 -1.01 0.00 0.00 31.44 29.02 2dl1 n GLU 64 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 2dl1 n HIS 65 N -2.35 0.00 -2.22 -0.32 8.25 -1.26 -4.88 115.22 112.43 2dl1 n HIS 65 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2dl1 n HIS 65 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2dl1 n HIS 65 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2dl1 n THR 66 N 0.00-12.65 0.00 1.59 -2.24 -1.26 -5.08 114.28 94.64 2dl1 n THR 66 Ca 0.00 3.09 0.00 0.00 -2.27 0.00 0.00 64.05 64.87 2dl1 n THR 66 Cb 0.00 -5.53 0.00 0.00 -2.10 0.00 0.00 70.33 62.70 2dl1 n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dl1 n GLY 67 N 1.91 2.27 0.02 3.38 0.00 -1.26 -4.98 105.19 106.52 2dl1 n GLY 67 Ca 0.00 -0.58 0.07 0.00 0.00 0.00 0.00 46.02 45.52 2dl1 n GLY 67 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl1 n PRO 68 N -0.56 0.03 0.13 1.61 -0.04 -1.26 -2.89 135.00 132.01 2dl1 n PRO 68 Ca 0.00 0.28 -0.23 0.00 -0.04 0.00 0.00 63.50 63.52 2dl1 n PRO 68 Cb 0.00 -1.55 -0.15 0.00 -0.04 0.00 0.00 33.50 31.76 2dl1 n PRO 68 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2dl1 h GLY 69 N 2.40 0.60 2.00 0.55 0.00 -2.00 -3.26 103.07 103.35 2dl1 h GLY 69 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 47.33 45.90 2dl1 h GLY 69 CO 0.00 1.25 0.00 1.49 0.00 0.00 0.00 176.54 179.28 2dl1 h TRP 70 N 0.18 0.00 0.24 5.60 4.06 -1.92 -3.24 115.95 120.86 2dl1 h TRP 70 Ca -0.22 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.73 2dl1 h TRP 70 Cb 2.06 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 30.20 2dl1 h TRP 70 CO 0.11 0.00 -0.31 1.49 -3.56 0.00 0.00 178.44 176.17 2dl1 h GLU 71 N 0.00 -0.55 -0.22 0.49 4.57 -1.60 0.35 114.58 117.63 2dl1 h GLU 71 Ca 0.00 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2dl1 h GLU 71 Cb 0.64 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 2dl1 h GLU 71 CO 0.00 -0.36 0.14 1.03 -1.18 0.00 0.00 179.01 178.63 2dl1 h SER 72 N -0.57 0.26 -1.01 1.04 0.87 -1.73 -2.31 113.55 110.11 2dl1 h SER 72 Ca -0.03 -0.03 0.23 0.00 -1.23 0.00 0.00 61.79 60.73 2dl1 h SER 72 Cb 0.51 -0.07 -0.10 0.00 -0.44 0.00 0.00 62.40 62.30 2dl1 h SER 72 CO -0.08 0.22 0.62 0.00 -0.53 0.00 0.00 176.83 177.07 2dl1 h ALA 73 N 1.06 1.94 -0.35 6.23 0.00 -1.56 0.18 119.26 126.76 2dl1 h ALA 73 Ca 0.08 0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2dl1 h ALA 73 Cb -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2dl1 h ALA 73 CO -0.02 -0.34 -0.44 0.00 0.00 0.00 0.00 179.25 178.46 2dl1 h ARG 74 N 0.56 0.89 -0.05 0.00 3.08 -0.40 -2.16 114.38 116.31 2dl1 h ARG 74 Ca 0.59 -0.50 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 2dl1 h ARG 74 Cb 1.20 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 2dl1 h ARG 74 CO -0.36 1.14 -0.36 1.96 -1.07 0.00 0.00 179.97 181.28 2dl1 h GLN 75 N 0.71 0.10 0.14 0.04 7.50 -0.29 -3.11 115.11 120.20 2dl1 h GLN 75 Ca 0.05 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.15 2dl1 h GLN 75 Cb 1.03 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.55 2dl1 h GLN 75 CO 0.10 0.45 -0.07 0.52 -1.50 0.00 0.00 178.83 178.34 2dl1 h MET 76 N 0.09 -0.18 -1.16 1.46 2.86 -0.81 -2.84 114.93 114.35 2dl1 h MET 76 Ca 0.01 0.01 0.35 0.00 -2.06 0.00 0.00 59.70 58.01 2dl1 h MET 76 Cb 0.68 0.04 -0.12 0.00 0.06 0.00 0.00 31.60 32.27 2dl1 h MET 76 CO 0.05 0.29 0.74 0.37 1.06 0.00 0.00 176.91 179.42 2dl1 h GLN 77 N -0.82 0.23 -0.18 1.72 4.15 -1.39 0.58 115.11 119.41 2dl1 h GLN 77 Ca -0.02 -0.01 -0.21 0.00 0.77 0.00 0.00 58.65 59.18 2dl1 h GLN 77 Cb 0.54 -0.05 0.01 0.00 0.21 0.00 0.00 27.48 28.19 2dl1 h GLN 77 CO 0.03 0.15 -0.72 0.37 -1.93 0.00 0.00 178.83 176.73 2dl1 h GLN 78 N 0.24 0.79 0.36 1.69 4.15 -1.55 -3.09 115.11 117.69 2dl1 h GLN 78 Ca 0.71 -0.61 -0.00 0.00 0.77 0.00 0.00 58.65 59.53 2dl1 h GLN 78 Cb 2.01 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 29.79 2dl1 h GLN 78 CO -0.39 1.22 -0.43 -0.22 -1.93 0.00 0.00 178.83 177.08 2dl1 h LYS 79 N 0.55 -0.79 -0.31 1.69 3.64 0.41 -2.59 116.57 119.17 2dl1 h LYS 79 Ca -0.04 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2dl1 h LYS 79 Cb 1.34 0.18 -0.08 0.00 -0.41 0.00 0.00 32.23 33.26 2dl1 h LYS 79 CO 0.15 -0.53 -0.25 0.52 -2.27 0.00 0.00 179.45 177.07 2dl1 h MET 80 N -0.82 -0.22 -0.90 1.90 2.86 -1.51 0.31 114.93 116.55 2dl1 h MET 80 Ca -0.03 0.01 0.26 0.00 -2.06 0.00 0.00 59.70 57.89 2dl1 h MET 80 Cb 0.75 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.42 2dl1 h MET 80 CO -0.10 -0.15 0.81 0.87 1.06 0.00 0.00 176.91 179.40 2dl1 h LYS 81 N -0.23 0.00 0.07 1.72 1.57 -1.41 0.58 116.57 118.87 2dl1 h LYS 81 Ca 0.16 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.64 2dl1 h LYS 81 Cb 0.47 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 2dl1 h LYS 81 CO -0.44 0.00 -1.64 0.39 -0.57 0.00 0.00 179.45 177.19 2dl1 n GLU 82 N -3.79 0.67 0.22 3.15 -0.58 0.77 -3.96 120.64 117.13 2dl1 n GLU 82 Ca 0.19 0.42 0.16 0.00 -0.42 0.00 0.00 57.16 57.50 2dl1 n GLU 82 Cb 1.11 -1.73 0.69 0.00 -0.57 0.00 0.00 31.44 30.94 2dl1 n GLU 82 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2dl1 h THR 83 N -0.46 0.00 0.11 2.62 2.02 0.16 -3.11 112.91 114.25 2dl1 h THR 83 Ca -0.39 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 2dl1 h THR 83 Cb 1.68 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 2dl1 h THR 83 CO -0.06 0.00 -0.05 0.25 0.37 0.00 0.00 175.52 176.03 2dl1 h LEU 84 N 0.00 -0.13 -1.89 2.58 6.46 -0.10 -2.18 115.31 120.05 2dl1 h LEU 84 Ca 0.00 0.00 0.33 0.00 -0.12 0.00 0.00 57.88 58.09 2dl1 h LEU 84 Cb 0.32 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.24 2dl1 h LEU 84 CO 0.00 -0.01 0.88 0.06 -0.62 0.00 0.00 178.44 178.76 2dl1 h GLN 85 N -0.31 0.00 0.02 1.25 3.07 -1.68 1.05 115.11 118.51 2dl1 h GLN 85 Ca -0.02 0.00 -0.21 0.00 0.09 0.00 0.00 58.65 58.51 2dl1 h GLN 85 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.67 2dl1 h GLN 85 CO 0.02 0.00 -0.94 -0.91 0.09 0.00 0.00 178.83 177.09 2dl1 h ASN 86 N 0.00 0.30 0.00 0.06 2.35 -1.57 -3.27 115.58 113.44 2dl1 h ASN 86 Ca 0.53 -0.26 -0.03 0.00 -0.55 0.00 0.00 56.30 55.99 2dl1 h ASN 86 Cb 2.30 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 40.57 2dl1 h ASN 86 CO -0.01 1.08 -0.26 0.58 -1.65 0.00 0.00 177.43 177.18 2dl1 h VAL 87 N 0.11 0.79 -0.92 2.81 2.07 0.16 -3.28 116.25 118.00 2dl1 h VAL 87 Ca -0.06 -1.67 0.37 0.00 0.82 0.00 0.00 66.70 66.16 2dl1 h VAL 87 Cb 1.59 1.57 -0.17 0.00 -1.52 0.00 0.00 31.29 32.76 2dl1 h VAL 87 CO 0.15 0.27 0.43 0.54 0.02 0.00 0.00 177.57 178.98 2dl1 n ARG 88 N -4.64 -0.06 -0.08 1.57 1.74 0.91 0.14 116.66 116.23 2dl1 n ARG 88 Ca -0.09 1.28 -0.11 0.00 -0.77 0.00 0.00 57.85 58.15 2dl1 n ARG 88 Cb 0.31 -2.26 -0.04 0.00 -1.02 0.00 0.00 32.46 29.45 2dl1 n ARG 88 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2dl1 h THR 89 N 0.00 1.27 0.46 0.55 2.02 -1.69 -2.80 112.91 112.71 2dl1 h THR 89 Ca 0.75 -0.96 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 2dl1 h THR 89 Cb 1.94 1.41 -0.01 0.00 -1.74 0.00 0.00 68.15 69.75 2dl1 h THR 89 CO -0.73 0.30 -0.33 0.03 0.37 0.00 0.00 175.52 175.17 2dl1 h ARG 90 N 0.20 -0.74 -0.93 6.66 2.47 0.11 -1.69 114.38 120.46 2dl1 h ARG 90 Ca 0.07 0.05 0.26 0.00 -1.26 0.00 0.00 59.98 59.10 2dl1 h ARG 90 Cb 0.45 0.17 -0.04 0.00 -1.65 0.00 0.00 29.97 28.90 2dl1 h ARG 90 CO 0.02 -0.49 0.66 1.25 0.56 0.00 0.00 179.97 181.96 2dl1 h LEU 91 N -0.77 0.07 0.02 3.04 5.85 -1.29 0.47 115.31 122.70 2dl1 h LEU 91 Ca -0.05 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2dl1 h LEU 91 Cb 0.65 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.68 2dl1 h LEU 91 CO 0.02 0.02 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.80 2dl1 h GLU 92 N 0.06 -0.03 -1.00 1.25 5.08 -1.07 -2.93 114.58 115.95 2dl1 h GLU 92 Ca 0.45 0.00 0.29 0.00 -1.00 0.00 0.00 59.36 59.10 2dl1 h GLU 92 Cb 1.70 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.91 2dl1 h GLU 92 CO -0.04 -0.02 0.75 0.82 -1.00 0.00 0.00 179.01 179.52 2dl1 h ILE 93 N -0.05 0.45 0.64 3.13 2.04 -1.02 -1.83 117.51 120.87 2dl1 h ILE 93 Ca -0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 2dl1 h ILE 93 Cb 0.02 0.47 0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2dl1 h ILE 93 CO 0.00 0.00 -0.31 -0.07 0.00 0.00 0.00 178.15 177.78 2dl1 h LEU 94 N 0.00 -0.73 -0.38 1.44 3.38 -0.95 1.68 115.31 119.74 2dl1 h LEU 94 Ca 0.47 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.55 2dl1 h LEU 94 Cb 1.96 0.19 -0.09 0.00 0.09 0.00 0.00 40.66 42.81 2dl1 h LEU 94 CO -0.00 -0.50 -0.30 -0.33 0.09 0.00 0.00 178.44 177.40 2dl1 h GLU 95 N -0.92 -0.23 -0.02 1.13 5.08 -1.14 1.69 114.58 120.17 2dl1 h GLU 95 Ca -0.09 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2dl1 h GLU 95 Cb 0.66 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2dl1 h GLU 95 CO 0.14 -0.15 0.00 0.36 -1.00 0.00 0.00 179.01 178.36 2dl1 n LYS 96 N -5.41 1.16 -2.69 2.33 2.85 -1.02 -3.90 118.16 111.48 2dl1 n LYS 96 Ca 0.01 -0.23 -0.07 0.00 -1.05 0.00 0.00 58.31 56.96 2dl1 n LYS 96 Cb 0.33 -1.39 0.07 0.00 -0.65 0.00 0.00 35.03 33.39 2dl1 n LYS 96 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2dl1 n GLY 97 N 0.94 1.49 0.13 2.58 0.00 0.57 -4.93 105.19 105.97 2dl1 n GLY 97 Ca 0.18 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 2dl1 n GLY 97 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2dl1 n LEU 98 N -0.40 2.21 0.18 0.99 -0.00 0.53 -4.49 117.00 116.02 2dl1 n LEU 98 Ca 0.02 0.25 -0.07 0.00 -0.00 0.00 0.00 56.01 56.21 2dl1 n LEU 98 Cb 0.83 -0.80 -0.03 0.00 -0.00 0.00 0.00 43.42 43.42 2dl1 n LEU 98 CO 0.09 0.74 0.35 0.00 -0.00 0.00 0.00 177.39 178.58 2dl1 h ALA 99 N 0.30 -0.81 -3.54 1.47 0.00 -1.89 -3.46 119.26 111.33 2dl1 h ALA 99 Ca -0.39 -0.10 -0.35 0.00 0.00 0.00 0.00 54.91 54.06 2dl1 h ALA 99 Cb 2.03 0.18 -0.33 0.00 0.00 0.00 0.00 17.79 19.67 2dl1 h ALA 99 CO 0.08 -0.77 -0.75 0.95 0.00 0.00 0.00 179.25 178.76 2dl1 s THR 100 N -3.48 0.27 0.34 0.00 -4.23 -1.26 -4.99 115.64 102.29 2dl1 s THR 100 Ca -0.07 0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 2dl1 s THR 100 Cb 0.01 -0.33 0.00 0.00 1.34 0.00 0.00 72.50 73.52 2dl1 s THR 100 CO 0.21 0.15 0.00 -0.24 -0.54 0.00 0.00 174.62 174.20 2dl1 n SER 101 N 3.94 -3.06 -3.27 3.99 2.88 -1.26 -4.83 113.62 112.01 2dl1 n SER 101 Ca -0.25 0.71 -0.38 0.00 -1.33 0.00 0.00 58.87 57.63 2dl1 n SER 101 Cb 0.52 2.97 -0.01 0.00 -0.75 0.00 0.00 64.21 66.94 2dl1 n SER 101 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2dl1 n LEU 102 N -3.23 7.55 -4.82 2.46 4.32 -1.26 -4.99 117.00 117.04 2dl1 n LEU 102 Ca 0.00 -4.83 -0.33 0.00 -0.02 0.00 0.00 56.01 50.83 2dl1 n LEU 102 Cb 0.00 -1.27 -0.03 0.00 -1.62 0.00 0.00 43.42 40.50 2dl1 n LEU 102 CO 0.00 1.97 0.69 -1.58 -1.22 0.00 0.00 177.39 177.26 2dl1 s GLN 103 N -2.21 3.78 0.69 3.23 0.74 -1.26 -4.53 119.66 120.10 2dl1 s GLN 103 Ca 0.52 1.14 0.00 0.00 0.05 0.00 0.00 55.36 57.07 2dl1 s GLN 103 Cb 0.25 -2.10 0.00 0.00 1.10 0.00 0.00 33.01 32.25 2dl1 s GLN 103 CO -0.15 -0.42 0.00 -1.71 -0.55 0.00 0.00 175.29 172.45 2dl1 n ASN 104 N -1.42 0.00 -2.92 6.67 4.05 -1.26 -4.80 115.26 115.57 2dl1 n ASN 104 Ca 0.08 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 55.00 2dl1 n ASN 104 Cb 0.53 0.00 0.01 0.00 1.23 0.00 0.00 39.78 41.56 2dl1 n ASN 104 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 2dl1 n ASP 105 N 1.67 -7.63 -4.54 1.20 2.03 -1.26 -4.73 116.55 103.29 2dl1 n ASP 105 Ca 0.00 0.57 -0.39 0.00 0.52 0.00 0.00 54.79 55.49 2dl1 n ASP 105 Cb 0.00 -4.83 -0.05 0.00 -0.72 0.00 0.00 41.12 35.51 2dl1 n ASP 105 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2dl1 n LEU 106 N -0.11 2.03 -2.71 -2.67 4.32 -1.26 -4.80 117.00 111.80 2dl1 n LEU 106 Ca 0.07 -0.25 -0.20 0.00 -0.02 0.00 0.00 56.01 55.61 2dl1 n LEU 106 Cb 0.43 -1.44 -0.00 0.00 -1.62 0.00 0.00 43.42 40.79 2dl1 n LEU 106 CO 0.47 -1.28 0.03 0.00 -1.22 0.00 0.00 177.39 175.39 2dl1 n GLN 107 N 8.83 2.32 -0.54 3.23 6.02 -1.26 -4.72 117.38 131.26 2dl1 n GLN 107 Ca 0.42 -4.01 -0.00 0.00 -0.01 0.00 0.00 57.00 53.40 2dl1 n GLN 107 Cb 0.42 -1.85 -0.00 0.00 1.02 0.00 0.00 30.24 29.83 2dl1 n GLN 107 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2dl1 n GLU 108 N -0.20 0.00 -3.88 -1.09 0.28 -1.26 -5.13 120.64 109.36 2dl1 n GLU 108 Ca 0.26 -0.21 -0.11 0.00 -0.16 0.00 0.00 57.16 56.94 2dl1 n GLU 108 Cb 0.67 -0.03 -0.11 0.00 1.43 0.00 0.00 31.44 33.40 2dl1 n GLU 108 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2dl1 s VAL 109 N 0.00 0.07 0.81 3.84 -7.23 -1.26 -5.16 120.40 111.47 2dl1 s VAL 109 Ca 0.00 -0.60 -0.11 0.00 -1.81 0.00 0.00 61.98 59.46 2dl1 s VAL 109 Cb 0.00 -0.37 0.08 0.00 0.56 0.00 0.00 36.38 36.65 2dl1 s VAL 109 CO -0.00 -0.33 1.09 -2.16 -0.31 0.00 0.00 175.10 173.39 2dl1 s PRO 110 N -1.14 1.99 0.14 4.82 0.04 -1.26 -5.07 135.00 134.51 2dl1 s PRO 110 Ca -0.12 1.08 -0.04 0.00 0.04 0.00 0.00 61.00 61.96 2dl1 s PRO 110 Cb -0.07 -1.87 0.02 0.00 0.04 0.00 0.00 34.50 32.61 2dl1 s PRO 110 CO 0.01 -1.81 0.25 0.45 0.04 0.00 0.00 177.00 175.94 2dl1 n SER 111 N -3.62 -0.71 0.00 6.66 2.88 -1.26 -5.14 113.62 112.43 2dl1 n SER 111 Ca 0.09 -1.60 0.00 0.00 -1.33 0.00 0.00 58.87 56.02 2dl1 n SER 111 Cb 0.54 1.22 0.00 0.00 -0.75 0.00 0.00 64.21 65.21 2dl1 n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl1 n GLY 112 N -0.20 -1.05 2.92 0.46 0.00 -1.26 -4.75 105.19 101.32 2dl1 n GLY 112 Ca -0.02 -2.13 -0.33 0.00 0.00 0.00 0.00 46.02 43.54 2dl1 n GLY 112 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl1 n PRO 113 N 0.00 1.57 -1.16 1.61 -0.04 -1.26 -4.26 135.00 131.46 2dl1 n PRO 113 Ca 0.00 -1.58 0.05 0.00 -0.04 0.00 0.00 63.50 61.93 2dl1 n PRO 113 Cb 0.00 -2.67 0.10 0.00 -0.04 0.00 0.00 33.50 30.89 2dl1 n PRO 113 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dl1 n SER 114 N 6.15 1.31 -3.88 3.54 7.64 -1.26 -5.08 113.62 122.04 2dl1 n SER 114 Ca 0.45 -2.77 -0.55 0.00 1.01 0.00 0.00 58.87 57.00 2dl1 n SER 114 Cb 0.28 -0.39 -0.10 0.00 -1.01 0.00 0.00 64.21 62.99 2dl1 n SER 114 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dl1 n SER 115 N -0.16 0.83 0.00 6.43 2.88 -1.26 -5.14 113.62 117.20 2dl1 n SER 115 Ca 0.11 0.79 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 2dl1 n SER 115 Cb 0.96 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 2dl1 n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42