#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 2.67 0.08 1.61 7.64 -1.26 -4.69 113.62 119.67 2dl1 n SER 2 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.96 2dl1 n SER 2 Cb 0.00 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 63.57 2dl1 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dl1 n SER 3 N -2.39 0.34 0.00 6.43 2.88 -1.26 -4.95 113.62 114.67 2dl1 n SER 3 Ca 0.00 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 2dl1 n SER 3 Cb 0.40 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 2dl1 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl1 n GLY 4 N -0.52 0.10 2.40 0.46 0.00 -1.26 -5.01 105.19 101.35 2dl1 n GLY 4 Ca 0.01 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 2dl1 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dl1 n SER 5 N 0.00 -5.04 -4.05 1.61 7.64 -1.26 -4.76 113.62 107.76 2dl1 n SER 5 Ca 0.00 0.18 -0.13 0.00 1.01 0.00 0.00 58.87 59.92 2dl1 n SER 5 Cb 0.00 -4.31 -0.12 0.00 -1.01 0.00 0.00 64.21 58.77 2dl1 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dl1 s SER 6 N -2.19 0.83 0.43 6.43 0.01 -1.26 -5.01 113.70 112.94 2dl1 s SER 6 Ca 0.00 -0.48 0.24 0.00 1.31 0.00 0.00 55.95 57.02 2dl1 s SER 6 Cb 0.00 0.02 0.85 0.00 0.21 0.00 0.00 66.02 67.10 2dl1 s SER 6 CO 0.00 -0.16 1.79 1.23 0.41 0.00 0.00 173.24 176.51 2dl1 h GLY 7 N 4.73 0.00 -1.40 3.44 0.00 -2.04 -3.50 103.07 104.30 2dl1 h GLY 7 Ca -0.35 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.04 2dl1 h GLY 7 CO 0.42 0.00 -0.42 1.18 0.00 0.00 0.00 176.54 177.72 2dl1 n GLU 8 N -3.35 -1.47 0.00 4.80 4.71 -1.26 -4.45 120.64 119.62 2dl1 n GLU 8 Ca 0.00 1.16 0.07 0.00 -0.01 0.00 0.00 57.16 58.39 2dl1 n GLU 8 Cb 0.45 -1.53 0.43 0.00 -1.01 0.00 0.00 31.44 29.79 2dl1 n GLU 8 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2dl1 n PRO 9 N -2.32 0.48 0.00 3.49 -0.04 -1.26 -4.85 135.00 130.50 2dl1 n PRO 9 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 2dl1 n PRO 9 Cb 0.22 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 2dl1 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dl1 n ALA 10 N -0.97 0.00 -0.05 0.55 0.00 -1.26 -4.59 120.51 114.19 2dl1 n ALA 10 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 2dl1 n ALA 10 Cb 0.05 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.55 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 0.70 -0.71 0.00 3.07 -1.98 -3.03 114.58 112.63 2dl1 h GLU 11 Ca 0.00 -0.37 0.00 0.00 -0.50 0.00 0.00 59.36 58.49 2dl1 h GLU 11 Cb 0.00 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.89 2dl1 h GLU 11 CO 0.00 0.99 0.46 0.82 -1.40 0.00 0.00 179.01 179.87 2dl1 h ILE 12 N 0.57 1.19 0.50 3.13 2.04 -1.95 -2.29 117.51 120.70 2dl1 h ILE 12 Ca 0.04 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 2dl1 h ILE 12 Cb 0.95 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2dl1 h ILE 12 CO 0.09 0.19 -0.28 0.11 0.00 0.00 0.00 178.15 178.25 2dl1 h LYS 13 N 0.97 -0.70 -0.65 2.37 1.57 -1.91 -1.85 116.57 116.37 2dl1 h LYS 13 Ca 0.26 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 59.17 2dl1 h LYS 13 Cb -0.09 0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.31 2dl1 h LYS 13 CO -0.05 -0.47 0.30 0.82 -0.57 0.00 0.00 179.45 179.48 2dl1 h ILE 14 N -0.73 0.84 0.39 1.86 2.04 -1.52 -2.84 117.51 117.55 2dl1 h ILE 14 Ca -0.06 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 2dl1 h ILE 14 Cb 0.58 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2dl1 h ILE 14 CO 0.08 0.10 -0.45 0.40 0.00 0.00 0.00 178.15 178.28 2dl1 h ILE 15 N 0.53 0.00 -0.19 -0.67 2.04 -1.20 -2.81 117.51 115.21 2dl1 h ILE 15 Ca 0.32 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.20 2dl1 h ILE 15 Cb 0.34 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 2dl1 h ILE 15 CO -0.27 0.00 -0.11 0.54 0.00 0.00 0.00 178.15 178.31 2dl1 n ARG 16 N -5.13 -0.08 -0.31 2.37 1.74 -0.71 0.46 116.66 114.99 2dl1 n ARG 16 Ca -0.10 1.03 0.22 0.00 -0.77 0.00 0.00 57.85 58.23 2dl1 n ARG 16 Cb 0.40 -1.54 0.42 0.00 -1.02 0.00 0.00 32.46 30.72 2dl1 n ARG 16 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2dl1 n GLU 17 N -3.38 -0.06 -0.09 5.56 4.71 -1.14 0.21 120.64 126.44 2dl1 n GLU 17 Ca 0.00 1.33 -0.10 0.00 -0.01 0.00 0.00 57.16 58.39 2dl1 n GLU 17 Cb 0.05 -2.25 0.05 0.00 -1.01 0.00 0.00 31.44 28.27 2dl1 n GLU 17 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2dl1 h ALA 18 N 1.85 0.75 0.00 0.62 0.00 0.27 0.35 119.26 123.11 2dl1 h ALA 18 Ca 0.68 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 2dl1 h ALA 18 Cb 1.65 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 2dl1 h ALA 18 CO -0.79 0.66 -0.16 -0.92 0.00 0.00 0.00 179.25 178.04 2dl1 h TYR 19 N 0.69 0.00 0.00 0.00 3.20 0.51 -1.09 116.97 120.28 2dl1 h TYR 19 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2dl1 h TYR 19 Cb 0.85 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.12 2dl1 h TYR 19 CO 0.05 0.16 -0.39 0.36 -1.64 0.00 0.00 178.16 176.69 2dl1 n LYS 20 N -3.81 0.26 -0.23 1.82 2.85 -0.31 -3.72 118.16 115.01 2dl1 n LYS 20 Ca -0.02 0.25 0.02 0.00 -1.05 0.00 0.00 58.31 57.52 2dl1 n LYS 20 Cb 0.26 -1.11 0.12 0.00 -0.65 0.00 0.00 35.03 33.64 2dl1 n LYS 20 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 2dl1 h LYS 21 N -0.52 0.08 -0.21 -1.58 1.57 -0.41 1.34 116.57 116.83 2dl1 h LYS 21 Ca 0.00 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2dl1 h LYS 21 Cb 0.39 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 2dl1 h LYS 21 CO 0.00 0.06 0.06 0.00 -0.57 0.00 0.00 179.45 179.00 2dl1 h ALA 22 N 1.64 0.23 0.00 3.86 0.00 -1.35 -1.19 119.26 122.45 2dl1 h ALA 22 Ca 0.36 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2dl1 h ALA 22 Cb 0.59 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2dl1 h ALA 22 CO -0.61 -0.36 0.00 1.19 0.00 0.00 0.00 179.25 179.46 2dl1 n PHE 23 N -5.06 0.32 -0.02 0.00 3.72 -0.22 -3.19 117.46 113.02 2dl1 n PHE 23 Ca -0.02 0.10 -0.12 0.00 -0.05 0.00 0.00 57.45 57.36 2dl1 n PHE 23 Cb 0.08 -0.67 -0.10 0.00 -0.94 0.00 0.00 39.48 37.85 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 -0.05 -1.57 4.37 5.85 0.29 -3.10 115.31 121.10 2dl1 h LEU 24 Ca 0.00 -0.61 -0.03 0.00 0.84 0.00 0.00 57.88 58.08 2dl1 h LEU 24 Cb 0.50 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 2dl1 h LEU 24 CO 0.00 0.63 -0.15 -0.26 -0.34 0.00 0.00 178.44 178.32 2dl1 h PHE 25 N -0.76 0.00 0.28 1.25 0.04 -1.47 -3.27 116.94 113.01 2dl1 h PHE 25 Ca -0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 2dl1 h PHE 25 Cb 0.66 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.81 2dl1 h PHE 25 CO 0.15 0.15 -0.14 0.28 -0.60 0.00 0.00 178.31 178.16 2dl1 h VAL 26 N 0.00 0.00 -1.64 -0.55 2.07 -1.57 -1.80 116.25 112.75 2dl1 h VAL 26 Ca -0.00 -0.08 0.48 0.00 0.82 0.00 0.00 66.70 67.92 2dl1 h VAL 26 Cb 0.52 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.22 2dl1 h VAL 26 CO 0.02 0.00 1.35 -3.20 0.02 0.00 0.00 177.57 175.76 2dl1 n ASN 27 N -3.24 0.00 0.01 0.57 4.05 -1.17 0.16 115.26 115.63 2dl1 n ASN 27 Ca -0.05 0.91 -0.18 0.00 0.45 0.00 0.00 54.58 55.71 2dl1 n ASN 27 Cb 0.15 -0.41 -0.14 0.00 1.23 0.00 0.00 39.78 40.61 2dl1 n ASN 27 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 2dl1 h LYS 28 N 0.00 0.23 -0.20 1.20 1.57 -1.60 -3.05 116.57 114.72 2dl1 h LYS 28 Ca 0.78 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 59.19 2dl1 h LYS 28 Cb 3.47 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 35.90 2dl1 h LYS 28 CO -0.01 1.15 0.09 0.78 -0.57 0.00 0.00 179.45 180.88 2dl1 h GLY 29 N -0.50 0.32 0.76 3.86 0.00 0.24 -2.30 103.07 105.45 2dl1 h GLY 29 Ca -0.09 -0.17 0.04 0.00 0.00 0.00 0.00 47.33 47.10 2dl1 h GLY 29 CO 0.11 0.16 0.18 1.41 0.00 0.00 0.00 176.54 178.39 2dl1 h LEU 30 N 0.18 0.24 0.44 3.11 -0.00 -1.29 -1.86 115.31 116.13 2dl1 h LEU 30 Ca 0.07 0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.96 2dl1 h LEU 30 Cb 0.16 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 40.79 2dl1 h LEU 30 CO -0.01 0.18 -0.38 -1.13 -0.00 0.00 0.00 178.44 177.11 2dl1 h ASN 31 N 0.36 -1.01 -0.81 -0.43 -1.24 -1.43 -2.38 115.58 108.64 2dl1 h ASN 31 Ca 0.17 0.07 0.20 0.00 0.71 0.00 0.00 56.30 57.45 2dl1 h ASN 31 Cb 0.10 0.32 -0.14 0.00 0.73 0.00 0.00 38.32 39.34 2dl1 h ASN 31 CO -0.14 -0.52 0.09 0.71 -1.29 0.00 0.00 177.43 176.28 2dl1 h THR 32 N -0.80 0.31 -0.71 -3.57 1.35 -1.33 0.70 112.91 108.87 2dl1 h THR 32 Ca -0.06 -0.05 0.14 0.00 -0.55 0.00 0.00 66.41 65.89 2dl1 h THR 32 Cb 0.67 0.16 -0.05 0.00 -1.73 0.00 0.00 68.15 67.21 2dl1 h THR 32 CO -0.01 0.03 0.48 -0.78 -0.25 0.00 0.00 175.52 174.98 2dl1 h ASP 33 N 0.14 0.37 1.37 5.36 3.58 -1.03 0.33 116.42 126.54 2dl1 h ASP 33 Ca 0.47 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.92 2dl1 h ASP 33 Cb 0.88 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.87 2dl1 h ASP 33 CO -0.68 0.20 -0.08 -0.33 -2.88 0.00 0.00 179.24 175.47 2dl1 h GLU 34 N 0.40 0.00 0.00 0.28 5.08 0.91 -2.91 114.58 118.34 2dl1 h GLU 34 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2dl1 h GLU 34 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2dl1 h GLU 34 CO -0.10 0.08 -0.79 -0.07 -1.00 0.00 0.00 179.01 177.12 2dl1 h LEU 35 N 0.00 0.00 0.00 1.33 4.07 0.11 -3.48 115.31 117.34 2dl1 h LEU 35 Ca -0.00 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.79 2dl1 h LEU 35 Cb 0.79 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.53 2dl1 h LEU 35 CO 0.01 0.08 0.00 0.61 -1.08 0.00 0.00 178.44 178.06 2dl1 n GLY 36 N 1.29 2.78 3.61 0.83 0.00 -0.48 -5.05 105.19 108.17 2dl1 n GLY 36 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2dl1 n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dl1 s GLN 37 N -0.46 3.37 -0.09 1.61 -0.21 -1.00 -4.87 119.66 118.00 2dl1 s GLN 37 Ca 0.00 1.96 -0.05 0.00 0.02 0.00 0.00 55.36 57.29 2dl1 s GLN 37 Cb 0.00 -4.28 -0.02 0.00 1.00 0.00 0.00 33.01 29.71 2dl1 s GLN 37 CO 0.00 -1.83 -0.10 0.87 -2.12 0.00 0.00 175.29 172.11 2dl1 h LYS 38 N 13.64 0.00 -0.93 2.91 1.79 -1.94 -3.20 116.57 128.85 2dl1 h LYS 38 Ca -0.40 0.00 0.11 0.00 -2.18 0.00 0.00 60.65 58.18 2dl1 h LYS 38 Cb 1.22 0.00 -0.13 0.00 -1.58 0.00 0.00 32.23 31.74 2dl1 h LYS 38 CO 0.97 0.00 -0.47 -0.85 -1.08 0.00 0.00 179.45 178.02 2dl1 n GLU 39 N -3.94 -0.33 0.39 3.15 0.28 -1.26 -0.52 120.64 118.41 2dl1 n GLU 39 Ca -0.04 1.42 -0.19 0.00 -0.16 0.00 0.00 57.16 58.18 2dl1 n GLU 39 Cb 0.15 -2.09 -0.10 0.00 1.43 0.00 0.00 31.44 30.83 2dl1 n GLU 39 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2dl1 h GLU 40 N 0.00 -1.10 -0.77 3.44 3.07 -1.98 -2.18 114.58 115.05 2dl1 h GLU 40 Ca 0.22 0.08 0.09 0.00 -0.50 0.00 0.00 59.36 59.25 2dl1 h GLU 40 Cb 0.45 0.25 -0.11 0.00 -0.84 0.00 0.00 28.75 28.50 2dl1 h GLU 40 CO -0.89 -0.73 -0.52 0.00 -1.40 0.00 0.00 179.01 175.46 2dl1 h ALA 41 N -1.05 -0.46 -0.61 3.43 0.00 -1.12 0.12 119.26 119.57 2dl1 h ALA 41 Ca -0.09 0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.05 2dl1 h ALA 41 Cb 0.94 1.18 -0.11 0.00 0.00 0.00 0.00 17.79 19.80 2dl1 h ALA 41 CO 0.05 -0.91 -0.10 0.87 0.00 0.00 0.00 179.25 179.16 2dl1 h LYS 42 N -0.14 0.03 0.03 0.00 1.57 -0.70 -1.31 116.57 116.05 2dl1 h LYS 42 Ca 0.17 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 2dl1 h LYS 42 Cb 0.51 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 2dl1 h LYS 42 CO -0.81 0.02 -0.27 -0.97 -0.57 0.00 0.00 179.45 176.85 2dl1 h ASN 43 N 0.04 -0.78 -1.00 0.86 -1.24 -0.17 0.15 115.58 113.43 2dl1 h ASN 43 Ca 0.30 0.10 0.19 0.00 0.71 0.00 0.00 56.30 57.60 2dl1 h ASN 43 Cb 0.48 0.31 -0.10 0.00 0.73 0.00 0.00 38.32 39.74 2dl1 h ASN 43 CO -0.59 -0.34 0.61 1.88 -1.29 0.00 0.00 177.43 177.70 2dl1 h TYR 44 N -0.43 1.04 0.22 0.67 0.05 -0.14 -1.83 116.97 116.56 2dl1 h TYR 44 Ca 0.05 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 2dl1 h TYR 44 Cb 0.50 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 37.93 2dl1 h TYR 44 CO -0.29 0.24 -0.11 1.88 -1.05 0.00 0.00 178.16 178.84 2dl1 h TYR 45 N 0.75 -0.28 0.00 4.88 0.05 -0.31 -1.48 116.97 120.59 2dl1 h TYR 45 Ca 0.57 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.34 2dl1 h TYR 45 Cb 0.90 0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.73 2dl1 h TYR 45 CO -0.00 0.06 0.32 0.87 -1.05 0.00 0.00 178.16 178.36 2dl1 h LYS 46 N -0.67 0.00 0.06 4.88 1.57 -0.22 0.16 116.57 122.36 2dl1 h LYS 46 Ca -0.03 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.43 2dl1 h LYS 46 Cb 0.47 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 2dl1 h LYS 46 CO 0.05 0.00 -1.76 1.04 -0.57 0.00 0.00 179.45 178.21 2dl1 n GLN 47 N -2.54 0.67 -0.20 3.15 6.02 -0.80 -4.02 117.38 119.64 2dl1 n GLN 47 Ca -0.02 0.38 -0.08 0.00 -0.01 0.00 0.00 57.00 57.28 2dl1 n GLN 47 Cb 0.35 -1.70 0.02 0.00 1.02 0.00 0.00 30.24 29.93 2dl1 n GLN 47 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2dl1 h GLY 48 N 0.16 0.95 0.30 1.08 0.00 0.04 -2.87 103.07 102.74 2dl1 h GLY 48 Ca -0.42 -0.56 0.01 0.00 0.00 0.00 0.00 47.33 46.36 2dl1 h GLY 48 CO -0.08 0.53 -0.44 -2.22 0.00 0.00 0.00 176.54 174.34 2dl1 h ILE 49 N 0.80 0.13 0.00 2.60 2.04 -1.34 0.44 117.51 122.19 2dl1 h ILE 49 Ca 0.18 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.04 2dl1 h ILE 49 Cb 0.28 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2dl1 h ILE 49 CO -0.01 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.75 2dl1 n GLY 50 N -1.48 -0.85 0.11 5.37 0.00 -1.21 -1.54 105.19 105.60 2dl1 n GLY 50 Ca -0.08 0.18 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 2dl1 n GLY 50 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dl1 n HIS 51 N -2.20 0.83 -0.04 1.61 8.25 0.12 -3.75 115.22 120.05 2dl1 n HIS 51 Ca -0.01 0.23 -0.12 0.00 -0.26 0.00 0.00 57.72 57.56 2dl1 n HIS 51 Cb 0.04 -1.13 -0.06 0.00 1.12 0.00 0.00 29.99 29.96 2dl1 n HIS 51 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2dl1 h LEU 52 N 0.03 0.22 -1.42 2.41 3.38 0.82 -2.97 115.31 117.78 2dl1 h LEU 52 Ca -0.42 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.26 2dl1 h LEU 52 Cb 2.04 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 42.70 2dl1 h LEU 52 CO 0.05 0.46 0.31 -0.07 0.09 0.00 0.00 178.44 179.28 2dl1 h LEU 53 N -0.02 0.61 -1.98 1.67 3.38 -1.64 -1.73 115.31 115.60 2dl1 h LEU 53 Ca 0.04 -0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.23 2dl1 h LEU 53 Cb 0.34 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2dl1 h LEU 53 CO 0.01 0.48 0.66 -0.09 0.09 0.00 0.00 178.44 179.58 2dl1 h ARG 54 N 0.71 0.00 0.16 1.13 9.65 -1.61 0.41 114.38 124.84 2dl1 h ARG 54 Ca 0.19 0.00 -0.35 0.00 -1.10 0.00 0.00 59.98 58.72 2dl1 h ARG 54 Cb -0.02 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.56 2dl1 h ARG 54 CO -0.03 0.00 -1.82 0.78 2.80 0.00 0.00 179.97 181.70 2dl1 h GLY 55 N 0.00 0.38 1.97 2.80 0.00 -1.39 -3.34 103.07 103.50 2dl1 h GLY 55 Ca 0.42 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2dl1 h GLY 55 CO -0.00 0.86 0.00 1.39 0.00 0.00 0.00 176.54 178.78 2dl1 n ILE 56 N -3.59 0.43 -2.25 2.60 5.41 -0.30 -3.44 119.36 118.22 2dl1 n ILE 56 Ca -0.28 0.11 -0.32 0.00 1.00 0.00 0.00 62.75 63.26 2dl1 n ILE 56 Cb 1.05 -0.72 0.02 0.00 -0.71 0.00 0.00 39.64 39.28 2dl1 n ILE 56 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2dl1 n SER 57 N -1.49 5.82 0.00 4.38 2.88 0.13 -4.86 113.62 120.48 2dl1 n SER 57 Ca 0.06 -3.77 0.00 0.00 -1.33 0.00 0.00 58.87 53.83 2dl1 n SER 57 Cb 0.26 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 2dl1 n SER 57 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2dl1 n ILE 58 N -0.51 0.00 0.06 2.46 2.08 -1.22 -4.93 119.36 117.30 2dl1 n ILE 58 Ca 0.45 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.76 2dl1 n ILE 58 Cb 0.50 -0.19 0.00 0.00 -0.75 0.00 0.00 39.64 39.20 2dl1 n ILE 58 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 2dl1 n SER 59 N 0.00 -1.15 -1.50 4.38 2.88 -1.26 -5.00 113.62 111.97 2dl1 n SER 59 Ca 0.00 0.44 -0.05 0.00 -1.33 0.00 0.00 58.87 57.93 2dl1 n SER 59 Cb 0.00 1.32 -0.02 0.00 -0.75 0.00 0.00 64.21 64.77 2dl1 n SER 59 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dl1 n SER 60 N -2.84 -1.47 -3.59 -3.46 3.41 -1.26 -4.84 113.62 99.57 2dl1 n SER 60 Ca 0.00 0.19 -0.13 0.00 -0.26 0.00 0.00 58.87 58.66 2dl1 n SER 60 Cb 0.00 -1.59 -0.12 0.00 -0.26 0.00 0.00 64.21 62.24 2dl1 n SER 60 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2dl1 s LYS 61 N -3.11 0.20 0.00 4.33 2.47 -1.26 -4.96 119.74 117.40 2dl1 s LYS 61 Ca 0.00 0.63 0.00 0.00 -1.56 0.00 0.00 55.97 55.04 2dl1 s LYS 61 Cb 0.00 -0.30 0.00 0.00 -1.46 0.00 0.00 37.83 36.07 2dl1 s LYS 61 CO 0.00 -0.41 0.00 0.39 0.16 0.00 0.00 175.35 175.49 2dl1 n GLU 62 N 5.35 0.00 -1.12 4.03 -0.58 -1.26 -5.16 120.64 121.90 2dl1 n GLU 62 Ca -0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 2dl1 n GLU 62 Cb 0.50 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.37 2dl1 n GLU 62 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2dl1 n SER 63 N 0.00 1.21 -4.04 1.62 7.64 -1.26 -5.12 113.62 113.67 2dl1 n SER 63 Ca 0.00 -0.56 -0.33 0.00 1.01 0.00 0.00 58.87 58.99 2dl1 n SER 63 Cb 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.07 2dl1 n SER 63 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2dl1 s GLU 64 N -0.69 2.00 -0.03 1.43 2.02 -1.26 -4.87 118.70 117.30 2dl1 s GLU 64 Ca 0.00 -2.24 0.06 0.00 0.02 0.00 0.00 54.97 52.81 2dl1 s GLU 64 Cb 0.00 -3.45 0.12 0.00 0.10 0.00 0.00 34.13 30.90 2dl1 s GLU 64 CO 0.00 -1.08 1.08 0.72 0.02 0.00 0.00 175.26 176.00 2dl1 n HIS 65 N 3.81 0.09 -1.36 1.61 8.25 -1.26 -5.03 115.22 121.33 2dl1 n HIS 65 Ca 0.04 -0.62 -0.53 0.00 -0.26 0.00 0.00 57.72 56.35 2dl1 n HIS 65 Cb 0.38 -0.08 -0.10 0.00 1.12 0.00 0.00 29.99 31.31 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 -0.58 0.06 -2.93 1.59 -2.24 -1.26 -4.51 114.28 104.42 2dl1 n THR 66 Ca 0.06 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2dl1 n THR 66 Cb 0.38 -0.99 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 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 6.98 1.18 0.08 3.38 0.00 -1.26 -4.99 105.19 110.57 2dl1 n GLY 67 Ca 0.51 -0.67 0.10 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 0.12 0.01 1.61 -0.04 -1.26 -2.90 135.00 132.54 2dl1 n PRO 68 Ca 0.00 0.36 -0.01 0.00 -0.04 0.00 0.00 63.50 63.81 2dl1 n PRO 68 Cb 0.00 -1.73 -0.00 0.00 -0.04 0.00 0.00 33.50 31.73 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 2.32 -0.07 2.00 0.55 0.00 -1.94 -3.31 103.07 102.62 2dl1 h GLY 69 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2dl1 h GLY 69 CO 0.00 -0.02 0.00 0.79 0.00 0.00 0.00 176.54 177.31 2dl1 n TRP 70 N -2.95 0.14 0.48 5.60 7.02 -1.25 -2.87 117.44 123.62 2dl1 n TRP 70 Ca -0.01 0.07 -0.19 0.00 -1.02 0.00 0.00 57.50 56.35 2dl1 n TRP 70 Cb 0.03 -0.61 -0.09 0.00 -2.42 0.00 0.00 31.31 28.22 2dl1 n TRP 70 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 2dl1 h GLU 71 N 0.00 -1.17 0.00 -0.99 4.81 -1.61 0.38 114.58 115.99 2dl1 h GLU 71 Ca 0.00 0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2dl1 h GLU 71 Cb 0.05 0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 2dl1 h GLU 71 CO 0.00 -0.78 -0.12 1.03 -0.73 0.00 0.00 179.01 178.41 2dl1 h SER 72 N -1.25 0.00 0.62 1.04 0.87 -1.66 -1.33 113.55 111.84 2dl1 h SER 72 Ca -0.12 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.32 2dl1 h SER 72 Cb 0.93 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 2dl1 h SER 72 CO 0.20 0.12 -0.57 0.00 -0.53 0.00 0.00 176.83 176.06 2dl1 h ALA 73 N 1.88 1.02 0.00 6.23 0.00 -1.54 -2.38 119.26 124.48 2dl1 h ALA 73 Ca -0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 2dl1 h ALA 73 Cb 0.24 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2dl1 h ALA 73 CO 0.02 0.71 -0.72 0.00 0.00 0.00 0.00 179.25 179.26 2dl1 h ARG 74 N 0.00 0.00 0.10 0.00 3.08 0.07 -3.08 114.38 114.54 2dl1 h ARG 74 Ca -0.01 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.78 2dl1 h ARG 74 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 2dl1 h ARG 74 CO 0.07 0.08 -1.21 1.96 -1.07 0.00 0.00 179.97 179.80 2dl1 h GLN 75 N 0.00 0.20 0.03 0.04 4.20 -1.13 -3.24 115.11 115.22 2dl1 h GLN 75 Ca -0.02 -0.34 -0.23 0.00 0.06 0.00 0.00 58.65 58.11 2dl1 h GLN 75 Cb 1.10 0.13 0.02 0.00 0.30 0.00 0.00 27.48 29.03 2dl1 h GLN 75 CO 0.01 1.15 -0.94 0.00 -0.67 0.00 0.00 178.83 178.39 2dl1 h MET 76 N 0.05 0.57 -0.09 1.46 -0.00 -1.53 -3.21 114.93 112.18 2dl1 h MET 76 Ca -0.11 -0.66 0.04 0.00 -0.00 0.00 0.00 59.70 58.97 2dl1 h MET 76 Cb 1.93 0.20 -0.05 0.00 -0.00 0.00 0.00 31.60 33.67 2dl1 h MET 76 CO 0.18 1.27 -0.25 1.96 -0.00 0.00 0.00 176.91 180.07 2dl1 h GLN 77 N 0.17 -0.33 -0.53 -0.10 4.20 -1.65 -2.14 115.11 114.73 2dl1 h GLN 77 Ca -0.13 0.02 0.10 0.00 0.06 0.00 0.00 58.65 58.70 2dl1 h GLN 77 Cb 1.62 0.07 -0.08 0.00 0.30 0.00 0.00 27.48 29.40 2dl1 h GLN 77 CO 0.18 -0.22 0.06 0.37 -0.67 0.00 0.00 178.83 178.56 2dl1 h GLN 78 N -0.34 0.18 -0.77 1.46 4.15 -1.66 -2.12 115.11 116.01 2dl1 h GLN 78 Ca 0.09 -0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.62 2dl1 h GLN 78 Cb 0.47 -0.04 -0.13 0.00 0.21 0.00 0.00 27.48 27.99 2dl1 h GLN 78 CO -0.29 0.12 -0.37 -0.22 -1.93 0.00 0.00 178.83 176.14 2dl1 h LYS 79 N 0.19 -0.10 0.17 1.69 1.63 -1.39 -1.53 116.57 117.23 2dl1 h LYS 79 Ca 0.27 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.08 2dl1 h LYS 79 Cb 0.39 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 2dl1 h LYS 79 CO -0.39 -0.06 -0.41 0.52 -3.45 0.00 0.00 179.45 175.66 2dl1 h MET 80 N -0.10 -0.61 -0.99 1.90 2.86 -1.23 -1.16 114.93 115.60 2dl1 h MET 80 Ca 0.27 0.04 0.32 0.00 -2.06 0.00 0.00 59.70 58.27 2dl1 h MET 80 Cb 0.57 0.14 -0.18 0.00 0.06 0.00 0.00 31.60 32.18 2dl1 h MET 80 CO -0.81 -0.41 0.19 1.63 1.06 0.00 0.00 176.91 178.57 2dl1 n LYS 81 N -4.79 -0.07 -0.07 1.72 5.02 -0.66 0.86 118.16 120.17 2dl1 n LYS 81 Ca -0.07 1.45 -0.11 0.00 -2.02 0.00 0.00 58.31 57.56 2dl1 n LYS 81 Cb 0.33 -2.39 -0.04 0.00 -0.02 0.00 0.00 35.03 32.91 2dl1 n LYS 81 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2dl1 h GLU 82 N 0.00 0.37 0.00 1.97 4.39 -0.51 -2.48 114.58 118.32 2dl1 h GLU 82 Ca 0.68 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 60.30 2dl1 h GLU 82 Cb 1.57 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 30.17 2dl1 h GLU 82 CO -0.88 0.46 -0.00 1.15 -1.16 0.00 0.00 179.01 178.58 2dl1 h THR 83 N 0.21 0.00 0.02 1.13 2.02 0.17 -3.17 112.91 113.28 2dl1 h THR 83 Ca 0.07 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 2dl1 h THR 83 Cb 0.25 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 2dl1 h THR 83 CO -0.00 0.00 -0.01 0.25 0.37 0.00 0.00 175.52 176.13 2dl1 h LEU 84 N 0.00 -0.02 -2.00 2.58 6.46 0.14 -0.88 115.31 121.60 2dl1 h LEU 84 Ca -0.00 0.00 0.39 0.00 -0.12 0.00 0.00 57.88 58.15 2dl1 h LEU 84 Cb 0.39 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.28 2dl1 h LEU 84 CO 0.00 -0.01 0.96 0.06 -0.62 0.00 0.00 178.44 178.83 2dl1 h GLN 85 N -0.04 0.00 0.00 1.25 3.07 -1.59 1.27 115.11 119.08 2dl1 h GLN 85 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.55 2dl1 h GLN 85 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.57 2dl1 h GLN 85 CO 0.00 0.00 -0.85 -0.91 0.09 0.00 0.00 178.83 177.17 2dl1 h ASN 86 N 0.00 0.17 0.00 0.06 2.35 -1.51 -3.26 115.58 113.39 2dl1 h ASN 86 Ca 0.64 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 56.19 2dl1 h ASN 86 Cb 2.56 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 40.87 2dl1 h ASN 86 CO -0.01 0.94 -0.32 0.58 -1.65 0.00 0.00 177.43 176.97 2dl1 h VAL 87 N 0.07 1.57 -1.35 2.81 2.07 0.29 -3.31 116.25 118.40 2dl1 h VAL 87 Ca -0.03 -2.30 0.41 0.00 0.82 0.00 0.00 66.70 65.60 2dl1 h VAL 87 Cb 1.47 3.09 -0.10 0.00 -1.52 0.00 0.00 31.29 34.23 2dl1 h VAL 87 CO 0.12 0.53 0.91 0.03 0.02 0.00 0.00 177.57 179.19 2dl1 h ARG 88 N -1.00 0.11 -0.18 1.57 3.08 -0.69 1.23 114.38 118.50 2dl1 h ARG 88 Ca -0.09 -0.01 -0.16 0.00 0.07 0.00 0.00 59.98 59.80 2dl1 h ARG 88 Cb 1.08 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 2dl1 h ARG 88 CO -0.05 0.07 -0.54 1.15 -1.07 0.00 0.00 179.97 179.53 2dl1 h THR 89 N 0.11 1.32 0.44 2.04 2.02 -1.67 -2.43 112.91 114.75 2dl1 h THR 89 Ca 0.76 -1.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.13 2dl1 h THR 89 Cb 2.53 1.77 0.00 0.00 -1.74 0.00 0.00 68.15 70.71 2dl1 h THR 89 CO -0.27 0.55 -0.21 0.03 0.37 0.00 0.00 175.52 175.99 2dl1 h ARG 90 N 0.41 -0.57 -0.01 6.66 2.47 0.14 -2.85 114.38 120.63 2dl1 h ARG 90 Ca 0.01 0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 2dl1 h ARG 90 Cb 1.07 0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 29.52 2dl1 h ARG 90 CO 0.10 -0.30 0.14 1.25 0.56 0.00 0.00 179.97 181.72 2dl1 h LEU 91 N -1.08 0.00 -0.25 3.04 5.85 -1.38 0.13 115.31 121.62 2dl1 h LEU 91 Ca -0.06 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.47 2dl1 h LEU 91 Cb 0.53 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 2dl1 h LEU 91 CO 0.10 0.00 -0.89 -0.33 -0.34 0.00 0.00 178.44 176.98 2dl1 h GLU 92 N 0.00 0.06 0.03 1.25 5.08 -1.35 -3.03 114.58 116.63 2dl1 h GLU 92 Ca 0.00 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 2dl1 h GLU 92 Cb 0.28 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2dl1 h GLU 92 CO -0.00 0.91 -0.37 0.82 -1.00 0.00 0.00 179.01 179.36 2dl1 h ILE 93 N 0.03 1.61 -0.37 3.13 2.04 -0.54 -3.00 117.51 120.41 2dl1 h ILE 93 Ca -0.02 -2.37 0.08 0.00 1.00 0.00 0.00 64.86 63.54 2dl1 h ILE 93 Cb 1.55 3.20 -0.07 0.00 -0.74 0.00 0.00 36.82 40.75 2dl1 h ILE 93 CO 0.12 0.60 -0.11 -0.07 0.00 0.00 0.00 178.15 178.70 2dl1 h LEU 94 N -0.84 -0.40 0.42 1.44 3.38 -1.47 0.66 115.31 118.50 2dl1 h LEU 94 Ca -0.08 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2dl1 h LEU 94 Cb 1.20 0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2dl1 h LEU 94 CO 0.01 -0.14 -0.20 -0.33 0.09 0.00 0.00 178.44 177.86 2dl1 h GLU 95 N -0.03 -0.55 0.00 1.13 5.08 -1.68 -1.85 114.58 116.69 2dl1 h GLU 95 Ca 0.18 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2dl1 h GLU 95 Cb 0.30 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2dl1 h GLU 95 CO -0.39 -0.36 0.00 1.57 -1.00 0.00 0.00 179.01 178.83 2dl1 h LYS 96 N -0.58 0.00 0.28 2.33 2.10 -1.31 -3.07 116.57 116.31 2dl1 h LYS 96 Ca -0.06 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.58 2dl1 h LYS 96 Cb 0.45 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 2dl1 h LYS 96 CO 0.10 0.00 -0.13 0.78 -2.00 0.00 0.00 179.45 178.19 2dl1 h GLY 97 N 1.06 -0.39 -1.04 0.07 0.00 0.12 -3.46 103.07 99.44 2dl1 h GLY 97 Ca 0.00 0.14 -0.19 0.00 0.00 0.00 0.00 47.33 47.28 2dl1 h GLY 97 CO 0.00 -0.14 -0.22 -0.10 0.00 0.00 0.00 176.54 176.08 2dl1 n LEU 98 N -5.03 -1.34 -3.09 3.11 7.94 -1.05 -4.71 117.00 112.83 2dl1 n LEU 98 Ca -0.07 -0.37 -0.35 0.00 -1.11 0.00 0.00 56.01 54.11 2dl1 n LEU 98 Cb 0.23 -0.74 -0.03 0.00 0.53 0.00 0.00 43.42 43.41 2dl1 n LEU 98 CO 0.20 -3.17 0.05 0.00 -1.11 0.00 0.00 177.39 173.36 2dl1 n ALA 99 N -4.29 -2.37 -3.66 1.96 0.00 -1.26 -4.97 120.51 105.91 2dl1 n ALA 99 Ca 0.06 0.32 -0.07 0.00 0.00 0.00 0.00 53.44 53.75 2dl1 n ALA 99 Cb 0.31 -1.14 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 2dl1 n ALA 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2dl1 s THR 100 N -0.60 -0.37 -1.67 0.00 2.01 -1.26 -4.98 115.64 108.77 2dl1 s THR 100 Ca 0.48 0.08 0.12 0.00 0.31 0.00 0.00 61.69 62.68 2dl1 s THR 100 Cb -0.69 -0.78 0.28 0.00 0.01 0.00 0.00 72.50 71.32 2dl1 s THR 100 CO 0.39 0.03 1.25 -1.20 -0.69 0.00 0.00 174.62 174.41 2dl1 n SER 101 N 4.81 0.00 -3.68 3.53 7.64 -1.26 -4.14 113.62 120.53 2dl1 n SER 101 Ca -0.16 -0.10 -0.30 0.00 1.01 0.00 0.00 58.87 59.32 2dl1 n SER 101 Cb 0.53 -0.16 -0.14 0.00 -1.01 0.00 0.00 64.21 63.43 2dl1 n SER 101 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2dl1 s LEU 102 N -2.33 2.00 0.31 -3.43 1.43 -1.26 -5.12 118.68 110.28 2dl1 s LEU 102 Ca 0.15 -1.88 0.11 0.00 -1.03 0.00 0.00 54.13 51.47 2dl1 s LEU 102 Cb 0.08 -0.79 -0.06 0.00 0.03 0.00 0.00 46.19 45.46 2dl1 s LEU 102 CO 0.17 -0.37 -0.14 -1.10 0.23 0.00 0.00 176.35 175.14 2dl1 s GLN 103 N 1.33 1.78 -0.10 1.70 -0.21 -1.26 -5.09 119.66 117.82 2dl1 s GLN 103 Ca 0.12 -1.83 -0.29 0.00 0.02 0.00 0.00 55.36 53.38 2dl1 s GLN 103 Cb -0.19 -1.77 -0.05 0.00 1.00 0.00 0.00 33.01 32.00 2dl1 s GLN 103 CO -0.18 0.24 1.70 -0.80 -2.12 0.00 0.00 175.29 174.14 2dl1 s ASN 104 N -3.57 6.50 -0.28 5.90 0.01 -1.26 -4.89 114.94 117.36 2dl1 s ASN 104 Ca 0.31 2.09 -0.37 0.00 -0.71 0.00 0.00 52.86 54.19 2dl1 s ASN 104 Cb -0.02 -2.53 -0.13 0.00 0.41 0.00 0.00 41.25 38.98 2dl1 s ASN 104 CO 0.16 -1.08 1.96 -0.67 -1.51 0.00 0.00 177.10 175.95 2dl1 n ASP 105 N 7.78 2.47 -4.71 -1.22 4.64 -1.26 -4.90 116.55 119.35 2dl1 n ASP 105 Ca 0.19 0.79 -0.42 0.00 -1.38 0.00 0.00 54.79 53.97 2dl1 n ASP 105 Cb 0.43 -1.23 -0.03 0.00 -1.04 0.00 0.00 41.12 39.25 2dl1 n ASP 105 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 2dl1 s LEU 106 N 5.18 4.33 -0.02 -2.67 2.96 -1.26 -5.05 118.68 122.16 2dl1 s LEU 106 Ca 1.02 1.53 0.02 0.00 -0.22 0.00 0.00 54.13 56.48 2dl1 s LEU 106 Cb -0.93 -3.46 0.00 0.00 0.50 0.00 0.00 46.19 42.31 2dl1 s LEU 106 CO 0.57 -0.27 -0.08 -1.10 -1.32 0.00 0.00 176.35 174.15 2dl1 s GLN 107 N 1.17 0.73 1.05 1.98 -0.21 -1.26 -5.14 119.66 117.98 2dl1 s GLN 107 Ca 0.48 -0.26 -0.15 0.00 0.02 0.00 0.00 55.36 55.45 2dl1 s GLN 107 Cb -0.20 -0.71 0.10 0.00 1.00 0.00 0.00 33.01 33.20 2dl1 s GLN 107 CO 0.24 0.12 0.32 0.39 -2.12 0.00 0.00 175.29 174.24 2dl1 n GLU 108 N 3.14 -1.12 -3.56 2.91 4.71 -1.26 -5.04 120.64 120.43 2dl1 n GLU 108 Ca -0.16 -0.30 -0.09 0.00 -0.01 0.00 0.00 57.16 56.61 2dl1 n GLU 108 Cb 0.56 -1.84 -0.02 0.00 -1.01 0.00 0.00 31.44 29.13 2dl1 n GLU 108 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 2dl1 s VAL 109 N -2.34 0.00 -0.60 2.62 -7.23 -1.26 -5.11 120.40 106.48 2dl1 s VAL 109 Ca 0.58 -0.22 -0.27 0.00 -1.81 0.00 0.00 61.98 60.26 2dl1 s VAL 109 Cb -0.17 -1.27 -0.02 0.00 0.56 0.00 0.00 36.38 35.47 2dl1 s VAL 109 CO 0.66 0.00 1.86 -2.16 -0.31 0.00 0.00 175.10 175.15 2dl1 s PRO 110 N -3.46 2.64 -0.30 4.82 0.04 -1.26 -4.88 135.00 132.60 2dl1 s PRO 110 Ca 0.05 0.64 -0.13 0.00 0.04 0.00 0.00 61.00 61.60 2dl1 s PRO 110 Cb -0.02 -4.38 0.17 0.00 0.04 0.00 0.00 34.50 30.31 2dl1 s PRO 110 CO -0.07 -2.71 0.99 0.45 0.04 0.00 0.00 177.00 175.70 2dl1 s SER 111 N 8.07 -0.58 0.48 6.66 0.15 -1.26 -5.18 113.70 122.04 2dl1 s SER 111 Ca 0.68 0.60 0.00 0.00 0.70 0.00 0.00 55.95 57.93 2dl1 s SER 111 Cb -0.13 1.58 0.00 0.00 -1.71 0.00 0.00 66.02 65.77 2dl1 s SER 111 CO 0.21 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.15 2dl1 n GLY 112 N 5.16 -1.39 3.15 9.45 0.00 -1.26 -4.84 105.19 115.46 2dl1 n GLY 112 Ca -0.08 -1.57 -0.43 0.00 0.00 0.00 0.00 46.02 43.94 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 -0.56 1.39 -2.05 1.61 -0.04 -1.26 -4.92 135.00 129.17 2dl1 n PRO 113 Ca 0.00 -1.81 -0.42 0.00 -0.04 0.00 0.00 63.50 61.23 2dl1 n PRO 113 Cb 0.00 -2.92 -0.03 0.00 -0.04 0.00 0.00 33.50 30.51 2dl1 n PRO 113 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dl1 s SER 114 N 5.21 6.70 0.01 3.54 0.01 -1.26 -4.89 113.70 123.02 2dl1 s SER 114 Ca 0.59 2.41 0.23 0.00 1.31 0.00 0.00 55.95 60.48 2dl1 s SER 114 Cb 0.14 -2.58 0.11 0.00 0.21 0.00 0.00 66.02 63.90 2dl1 s SER 114 CO 0.14 -0.78 1.13 -1.20 0.41 0.00 0.00 173.24 172.93 2dl1 n SER 115 N 4.72 0.73 0.00 2.44 7.64 -1.26 -5.27 113.62 122.61 2dl1 n SER 115 Ca 0.14 -0.57 0.00 0.00 1.01 0.00 0.00 58.87 59.44 2dl1 n SER 115 Cb 0.41 0.67 0.00 0.00 -1.01 0.00 0.00 64.21 64.28 2dl1 n SER 115 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64