#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c3t s GLN 2 N 0.00 4.54 0.05 3.17 0.74 -1.26 -1.90 119.66 125.00 1c3t s GLN 2 Ca 0.00 1.12 0.08 0.00 0.05 0.00 0.00 55.36 56.61 1c3t s GLN 2 Cb 0.00 -3.29 -0.03 0.00 1.10 0.00 0.00 33.01 30.79 1c3t s GLN 2 CO 0.00 0.48 -0.22 -0.51 -0.55 0.00 0.00 175.29 174.49 1c3t s LEU 3 N -0.79 2.18 -0.40 3.68 1.43 -0.49 -0.36 118.68 123.93 1c3t s LEU 3 Ca 0.37 -0.55 -0.07 0.00 -1.03 0.00 0.00 54.13 52.84 1c3t s LEU 3 Cb -0.22 -1.05 0.07 0.00 0.03 0.00 0.00 46.19 45.02 1c3t s LEU 3 CO 0.25 0.18 0.21 -0.36 0.23 0.00 0.00 176.35 176.86 1c3t s PHE 4 N -0.83 3.36 -0.08 0.29 0.40 0.05 -1.71 117.98 119.46 1c3t s PHE 4 Ca 0.09 -1.66 -0.15 0.00 -0.60 0.00 0.00 56.93 54.61 1c3t s PHE 4 Cb -0.09 -2.84 -0.05 0.00 0.51 0.00 0.00 43.02 40.55 1c3t s PHE 4 CO 0.02 -0.84 0.38 0.08 0.70 0.00 0.00 175.22 175.55 1c3t s VAL 5 N 1.37 5.18 0.43 -0.44 1.01 0.75 -2.45 120.40 126.25 1c3t s VAL 5 Ca 0.03 0.75 0.05 0.00 0.00 0.00 0.00 61.98 62.80 1c3t s VAL 5 Cb -0.22 -3.70 -0.06 0.00 0.00 0.00 0.00 36.38 32.40 1c3t s VAL 5 CO 0.01 0.46 0.02 -1.59 0.00 0.00 0.00 175.10 174.00 1c3t s LYS 6 N -0.20 2.00 0.41 2.72 0.00 -0.58 0.27 119.74 124.37 1c3t s LYS 6 Ca 0.22 -2.19 0.05 0.00 0.00 0.00 0.00 55.97 54.05 1c3t s LYS 6 Cb -0.15 -1.50 -0.06 0.00 0.00 0.00 0.00 37.83 36.12 1c3t s LYS 6 CO 0.09 -0.17 0.03 0.95 0.00 0.00 0.00 175.35 176.25 1c3t s THR 7 N -2.83 1.46 -0.34 3.79 -4.23 -0.78 -1.41 115.64 111.31 1c3t s THR 7 Ca 0.26 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.03 1c3t s THR 7 Cb 0.07 -2.70 0.28 0.00 1.34 0.00 0.00 72.50 71.49 1c3t s THR 7 CO 0.13 0.00 1.78 0.25 -0.54 0.00 0.00 174.62 176.24 1c3t h LEU 8 N 1.77 0.00 0.00 4.79 6.46 -1.91 -3.23 115.31 123.19 1c3t h LEU 8 Ca -0.42 0.00 -0.14 0.00 -0.12 0.00 0.00 57.88 57.20 1c3t h LEU 8 Cb 1.26 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.17 1c3t h LEU 8 CO 0.74 0.00 -1.02 0.35 -0.62 0.00 0.00 178.44 177.89 1c3t n THR 9 N -2.43 1.48 0.00 1.05 -2.24 -1.26 -5.04 114.28 105.84 1c3t n THR 9 Ca 0.02 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1c3t n THR 9 Cb 0.24 -2.19 0.00 0.00 -2.10 0.00 0.00 70.33 66.28 1c3t n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c3t n GLY 10 N 1.50 1.59 3.62 3.38 0.00 -1.22 -5.12 105.19 108.93 1c3t n GLY 10 Ca -0.22 -0.13 -0.64 0.00 0.00 0.00 0.00 46.02 45.03 1c3t n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1c3t n LYS 11 N 0.00 0.00 -4.03 1.61 5.02 -1.26 -4.47 118.16 115.04 1c3t n LYS 11 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 1c3t n LYS 11 Cb 0.00 -1.49 -0.16 0.00 -0.02 0.00 0.00 35.03 33.36 1c3t n LYS 11 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1c3t s THR 12 N 1.78 1.68 0.39 -0.18 2.01 -1.26 -1.86 115.64 118.19 1c3t s THR 12 Ca 0.99 -0.85 0.08 0.00 0.31 0.00 0.00 61.69 62.22 1c3t s THR 12 Cb -1.40 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 1c3t s THR 12 CO 0.71 0.35 0.22 -1.48 -0.69 0.00 0.00 174.62 173.73 1c3t s LEU 13 N 1.41 3.25 0.01 4.42 2.34 0.14 -4.95 118.68 125.31 1c3t s LEU 13 Ca 0.02 -0.87 0.04 0.00 0.06 0.00 0.00 54.13 53.39 1c3t s LEU 13 Cb -0.14 -1.73 -0.01 0.00 -0.56 0.00 0.00 46.19 43.75 1c3t s LEU 13 CO -0.10 -0.48 -0.14 -0.89 -1.06 0.00 0.00 176.35 173.68 1c3t s THR 14 N -2.50 1.10 0.03 5.48 2.01 -1.26 -0.18 115.64 120.32 1c3t s THR 14 Ca 0.42 -0.75 0.01 0.00 0.31 0.00 0.00 61.69 61.68 1c3t s THR 14 Cb -0.00 -0.95 -0.02 0.00 0.01 0.00 0.00 72.50 71.54 1c3t s THR 14 CO 0.24 0.18 -0.06 0.68 -0.69 0.00 0.00 174.62 174.98 1c3t s VAL 15 N -0.53 0.38 -0.39 3.82 -7.23 -0.69 -4.99 120.40 110.77 1c3t s VAL 15 Ca 0.04 -0.97 -0.15 0.00 -1.81 0.00 0.00 61.98 59.09 1c3t s VAL 15 Cb -0.06 -0.47 0.01 0.00 0.56 0.00 0.00 36.38 36.41 1c3t s VAL 15 CO 0.00 -0.39 0.33 -1.61 -0.31 0.00 0.00 175.10 173.12 1c3t s GLU 16 N -1.45 3.21 0.29 4.82 2.02 -1.26 -1.39 118.70 124.93 1c3t s GLU 16 Ca -0.11 -0.78 0.03 0.00 0.02 0.00 0.00 54.97 54.13 1c3t s GLU 16 Cb -0.09 -3.91 -0.04 0.00 0.10 0.00 0.00 34.13 30.19 1c3t s GLU 16 CO -0.00 -0.68 0.19 -1.17 0.02 0.00 0.00 175.26 173.63 1c3t s LEU 17 N 1.86 1.56 0.23 1.80 2.96 -0.80 -4.97 118.68 121.32 1c3t s LEU 17 Ca 0.08 -1.58 0.11 0.00 -0.22 0.00 0.00 54.13 52.52 1c3t s LEU 17 Cb -0.18 0.37 -0.05 0.00 0.50 0.00 0.00 46.19 46.84 1c3t s LEU 17 CO 0.11 -0.94 -0.18 -1.61 -1.32 0.00 0.00 176.35 172.42 1c3t s GLU 18 N -3.78 1.74 0.47 1.98 0.41 -1.26 0.18 118.70 118.44 1c3t s GLU 18 Ca 0.38 -1.58 0.32 0.00 -0.41 0.00 0.00 54.97 53.69 1c3t s GLU 18 Cb 0.05 -1.89 1.56 0.00 -1.78 0.00 0.00 34.13 32.06 1c3t s GLU 18 CO 0.20 0.37 1.97 -1.00 -0.49 0.00 0.00 175.26 176.31 1c3t h PRO 19 N 2.65 0.00 0.00 0.39 0.13 -1.96 -1.68 132.00 131.52 1c3t h PRO 19 Ca -0.44 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.65 1c3t h PRO 19 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1c3t h PRO 19 CO 0.55 0.00 -0.74 0.66 -0.23 0.00 0.00 178.00 178.24 1c3t h SER 20 N 0.00 0.00 -2.94 1.44 4.64 -1.95 0.11 113.55 114.85 1c3t h SER 20 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1c3t h SER 20 Cb 0.22 0.00 0.22 0.00 -0.31 0.00 0.00 62.40 62.52 1c3t h SER 20 CO 0.00 0.18 -0.18 0.47 -0.87 0.00 0.00 176.83 176.43 1c3t n ASP 21 N -2.91 -4.17 -4.27 4.97 8.00 -0.63 -4.71 116.55 112.83 1c3t n ASP 21 Ca -0.00 -0.87 -0.14 0.00 0.71 0.00 0.00 54.79 54.48 1c3t n ASP 21 Cb 0.63 -1.01 -0.10 0.00 -0.02 0.00 0.00 41.12 40.61 1c3t n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1c3t s THR 22 N -2.12 0.58 0.26 -3.53 -4.23 -1.26 -1.70 115.64 103.65 1c3t s THR 22 Ca 0.68 -1.99 -0.03 0.00 -1.18 0.00 0.00 61.69 59.17 1c3t s THR 22 Cb -0.12 -2.34 0.28 0.00 1.34 0.00 0.00 72.50 71.66 1c3t s THR 22 CO 0.57 -0.26 1.65 0.58 -0.54 0.00 0.00 174.62 176.62 1c3t h VAL 23 N 2.57 0.36 -0.78 2.29 2.07 -1.68 0.28 116.25 121.38 1c3t h VAL 23 Ca -0.37 -0.06 0.15 0.00 0.82 0.00 0.00 66.70 67.23 1c3t h VAL 23 Cb 1.22 0.16 -0.15 0.00 -1.52 0.00 0.00 31.29 31.01 1c3t h VAL 23 CO 0.61 0.03 -0.24 -0.33 0.02 0.00 0.00 177.57 177.67 1c3t h GLU 24 N 0.18 -0.03 0.39 1.57 5.08 -1.92 0.48 114.58 120.33 1c3t h GLU 24 Ca 0.47 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.82 1c3t h GLU 24 Cb 0.88 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1c3t h GLU 24 CO -0.63 -0.02 -0.19 -0.91 -1.00 0.00 0.00 179.01 176.26 1c3t h ASN 25 N -0.03 -0.44 -0.24 1.42 4.21 -1.36 0.51 115.58 119.65 1c3t h ASN 25 Ca 0.35 -0.04 0.06 0.00 1.21 0.00 0.00 56.30 57.89 1c3t h ASN 25 Cb 0.58 0.11 -0.07 0.00 -1.12 0.00 0.00 38.32 37.82 1c3t h ASN 25 CO -0.81 -0.25 -0.27 0.25 -1.29 0.00 0.00 177.43 175.06 1c3t h LEU 26 N -0.61 -0.86 -0.79 1.61 5.85 -0.70 -0.95 115.31 118.85 1c3t h LEU 26 Ca -0.05 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.86 1c3t h LEU 26 Cb 0.45 0.40 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 1c3t h LEU 26 CO 0.09 -0.30 0.49 0.11 -0.34 0.00 0.00 178.44 178.49 1c3t h LYS 27 N -0.28 0.91 -0.88 1.25 1.57 -0.06 -1.76 116.57 117.31 1c3t h LYS 27 Ca 0.13 -0.05 0.18 0.00 -1.87 0.00 0.00 60.65 59.04 1c3t h LYS 27 Cb 0.49 -0.20 -0.11 0.00 0.08 0.00 0.00 32.23 32.49 1c3t h LYS 27 CO -0.40 0.60 0.44 0.00 -0.57 0.00 0.00 179.45 179.52 1c3t h ALA 28 N 1.36 1.39 -0.17 3.86 0.00 0.46 0.49 119.26 126.63 1c3t h ALA 28 Ca 0.33 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 1c3t h ALA 28 Cb 0.09 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1c3t h ALA 28 CO -0.14 -0.19 -0.03 0.87 0.00 0.00 0.00 179.25 179.77 1c3t h LYS 29 N 0.55 0.32 0.00 0.00 1.79 -0.67 -1.97 116.57 116.60 1c3t h LYS 29 Ca 0.51 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 1c3t h LYS 29 Cb 0.85 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1c3t h LYS 29 CO -0.43 0.57 0.00 0.82 -1.08 0.00 0.00 179.45 179.33 1c3t h ILE 30 N 0.04 0.00 0.00 1.86 2.04 -0.68 0.33 117.51 121.10 1c3t h ILE 30 Ca 0.05 -0.08 -0.16 0.00 1.00 0.00 0.00 64.86 65.67 1c3t h ILE 30 Cb 0.44 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1c3t h ILE 30 CO 0.01 0.00 -1.38 -0.61 0.00 0.00 0.00 178.15 176.17 1c3t h GLN 31 N 0.00 0.00 0.10 2.37 4.15 -0.57 0.62 115.11 121.78 1c3t h GLN 31 Ca 0.00 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.09 1c3t h GLN 31 Cb 0.08 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 1c3t h GLN 31 CO 0.00 0.29 -1.78 0.22 -1.93 0.00 0.00 178.83 175.62 1c3t h ASP 32 N 0.00 0.31 0.12 -0.69 1.82 -0.37 -3.02 116.42 114.60 1c3t h ASP 32 Ca -0.16 -0.83 -0.01 0.00 -0.39 0.00 0.00 57.03 55.64 1c3t h ASP 32 Cb 1.57 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 41.48 1c3t h ASP 32 CO 0.05 1.76 -0.06 0.11 -1.61 0.00 0.00 179.24 179.49 1c3t h LYS 33 N -0.22 -0.15 0.00 0.28 1.79 -0.62 -3.42 116.57 114.23 1c3t h LYS 33 Ca -0.40 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 1c3t h LYS 33 Cb 1.84 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.52 1c3t h LYS 33 CO 0.01 0.32 -0.36 0.39 -1.08 0.00 0.00 179.45 178.73 1c3t n GLU 34 N -4.86 0.28 0.00 3.15 -0.58 -1.08 -5.05 120.64 112.50 1c3t n GLU 34 Ca -0.07 0.37 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 1c3t n GLU 34 Cb 0.27 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 1c3t n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1c3t n GLY 35 N 1.64 1.28 3.75 0.62 0.00 0.17 -4.96 105.19 107.68 1c3t n GLY 35 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 1c3t n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c3t s ILE 36 N -1.30 5.39 0.33 -0.61 1.01 -0.96 -4.90 121.20 120.16 1c3t s ILE 36 Ca 0.00 0.18 -0.23 0.00 0.00 0.00 0.00 60.65 60.60 1c3t s ILE 36 Cb 0.00 -3.44 -0.10 0.00 0.01 0.00 0.00 42.46 38.93 1c3t s ILE 36 CO 0.00 0.48 0.89 -2.16 0.00 0.00 0.00 174.94 174.15 1c3t s PRO 37 N 0.09 4.42 0.57 2.79 0.04 -1.26 -3.60 135.00 138.05 1c3t s PRO 37 Ca 0.09 1.17 0.26 0.00 0.04 0.00 0.00 61.00 62.56 1c3t s PRO 37 Cb -0.11 -2.67 1.63 0.00 0.04 0.00 0.00 34.50 33.39 1c3t s PRO 37 CO -0.01 0.23 2.19 -1.35 0.04 0.00 0.00 177.00 178.10 1c3t h PRO 38 N 2.91 0.00 0.00 0.56 0.11 -1.93 0.36 132.00 134.02 1c3t h PRO 38 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1c3t h PRO 38 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1c3t h PRO 38 CO 0.64 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 1c3t n ASP 39 N -4.03 0.00 0.00 -2.05 5.75 -1.26 -2.77 116.55 112.18 1c3t n ASP 39 Ca -0.01 0.39 0.00 0.00 -0.01 0.00 0.00 54.79 55.15 1c3t n ASP 39 Cb 0.16 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.80 1c3t n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1c3t n GLN 40 N -1.45 0.76 -3.21 0.11 6.02 -0.01 -4.95 117.38 114.65 1c3t n GLN 40 Ca 0.06 -0.73 -0.39 0.00 -0.01 0.00 0.00 57.00 55.93 1c3t n GLN 40 Cb 0.20 -0.76 -0.06 0.00 1.02 0.00 0.00 30.24 30.65 1c3t n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1c3t s GLN 41 N -0.32 4.35 -0.30 -1.09 -0.21 -0.45 -2.04 119.66 119.60 1c3t s GLN 41 Ca 0.00 0.60 0.01 0.00 0.02 0.00 0.00 55.36 55.99 1c3t s GLN 41 Cb 0.00 -3.46 0.09 0.00 1.00 0.00 0.00 33.01 30.64 1c3t s GLN 41 CO 0.00 0.07 0.05 1.03 -2.12 0.00 0.00 175.29 174.32 1c3t s ARG 42 N 0.87 1.16 -0.46 2.91 0.52 -0.12 -4.91 118.95 118.93 1c3t s ARG 42 Ca 0.30 -1.29 -0.22 0.00 -0.52 0.00 0.00 55.73 53.99 1c3t s ARG 42 Cb -0.16 -2.52 0.03 0.00 0.52 0.00 0.00 34.95 32.82 1c3t s ARG 42 CO 0.13 -0.87 0.73 -0.51 0.02 0.00 0.00 175.30 174.80 1c3t s LEU 43 N 1.34 4.39 -0.86 2.53 1.43 -1.26 -0.10 118.68 126.16 1c3t s LEU 43 Ca 0.06 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1c3t s LEU 43 Cb -0.18 -2.82 0.24 0.00 0.03 0.00 0.00 46.19 43.45 1c3t s LEU 43 CO -0.15 -0.89 0.86 -0.38 0.23 0.00 0.00 176.35 176.02 1c3t n ILE 44 N 6.00 3.12 -2.04 -0.59 2.08 -0.11 -2.02 119.36 125.80 1c3t n ILE 44 Ca 0.00 -5.24 -0.32 0.00 0.56 0.00 0.00 62.75 57.75 1c3t n ILE 44 Cb 0.48 -2.26 -0.04 0.00 -0.75 0.00 0.00 39.64 37.07 1c3t n ILE 44 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 1c3t s PHE 45 N -1.85 1.73 -1.24 1.39 5.36 -0.06 -3.51 117.98 119.79 1c3t s PHE 45 Ca 0.31 0.72 0.00 0.00 -0.96 0.00 0.00 56.93 57.00 1c3t s PHE 45 Cb -0.00 -4.06 0.00 0.00 -0.34 0.00 0.00 43.02 38.62 1c3t s PHE 45 CO -0.07 -2.01 0.00 0.00 -1.46 0.00 0.00 175.22 171.68 1c3t n ALA 46 N 13.47 -0.35 0.00 11.12 0.00 -1.26 0.28 120.51 143.76 1c3t n ALA 46 Ca 0.31 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1c3t n ALA 46 Cb 0.49 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1c3t n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c3t n GLY 47 N -0.39 0.95 3.49 0.00 0.00 -1.23 -5.08 105.19 102.93 1c3t n GLY 47 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1c3t n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c3t s LYS 48 N -0.30 3.17 -0.44 1.61 -0.14 0.14 -5.03 119.74 118.75 1c3t s LYS 48 Ca 0.00 -0.64 -0.27 0.00 -1.36 0.00 0.00 55.97 53.70 1c3t s LYS 48 Cb 0.00 -3.99 0.03 0.00 -1.68 0.00 0.00 37.83 32.18 1c3t s LYS 48 CO 0.00 -1.01 1.02 -1.14 -0.76 0.00 0.00 175.35 173.46 1c3t s GLN 49 N 2.54 3.69 -0.03 1.68 -0.44 -1.25 -0.88 119.66 124.96 1c3t s GLN 49 Ca 0.17 0.44 -0.30 0.00 -2.50 0.00 0.00 55.36 53.17 1c3t s GLN 49 Cb -0.16 -3.89 -0.04 0.00 -1.64 0.00 0.00 33.01 27.28 1c3t s GLN 49 CO 0.15 -1.22 1.23 -0.51 0.50 0.00 0.00 175.29 175.44 1c3t s LEU 50 N 3.98 4.30 -0.10 3.68 1.43 -0.85 -5.02 118.68 126.09 1c3t s LEU 50 Ca 0.42 1.89 -0.04 0.00 -1.03 0.00 0.00 54.13 55.37 1c3t s LEU 50 Cb -0.09 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 1c3t s LEU 50 CO 0.27 -0.59 0.06 -1.61 0.23 0.00 0.00 176.35 174.71 1c3t s GLU 51 N 2.08 3.17 0.25 1.70 2.02 -1.26 -4.67 118.70 121.98 1c3t s GLU 51 Ca 0.57 -0.29 -0.31 0.00 0.02 0.00 0.00 54.97 54.96 1c3t s GLU 51 Cb -0.26 -2.96 -0.13 0.00 0.10 0.00 0.00 34.13 30.87 1c3t s GLU 51 CO 0.24 0.73 1.40 -0.25 0.02 0.00 0.00 175.26 177.40 1c3t n ASP 52 N 2.04 2.77 0.00 -0.19 9.92 -1.26 -2.08 116.55 127.75 1c3t n ASP 52 Ca -0.19 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.22 1c3t n ASP 52 Cb 0.54 -1.43 0.00 0.00 -0.64 0.00 0.00 41.12 39.59 1c3t n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1c3t n GLY 53 N 2.09 3.14 3.84 0.44 0.00 -1.26 -5.02 105.19 108.41 1c3t n GLY 53 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1c3t n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1c3t s ARG 54 N -0.76 4.02 0.11 1.61 1.81 -0.88 -4.92 118.95 119.94 1c3t s ARG 54 Ca 0.00 0.54 -0.15 0.00 -1.72 0.00 0.00 55.73 54.40 1c3t s ARG 54 Cb 0.00 -2.96 -0.07 0.00 -0.45 0.00 0.00 34.95 31.47 1c3t s ARG 54 CO 0.00 0.49 0.53 0.95 -0.68 0.00 0.00 175.30 176.59 1c3t s THR 55 N -1.43 4.86 0.29 0.02 -4.23 -1.26 -1.96 115.64 111.94 1c3t s THR 55 Ca 0.37 0.90 0.01 0.00 -1.18 0.00 0.00 61.69 61.79 1c3t s THR 55 Cb -0.16 -3.76 0.36 0.00 1.34 0.00 0.00 72.50 70.28 1c3t s THR 55 CO 0.19 0.35 1.60 -0.07 -0.54 0.00 0.00 174.62 176.16 1c3t h LEU 56 N 3.91 -0.30 -0.67 4.79 3.38 -1.39 0.54 115.31 125.57 1c3t h LEU 56 Ca -0.49 0.24 0.09 0.00 0.09 0.00 0.00 57.88 57.81 1c3t h LEU 56 Cb 1.20 0.40 -0.07 0.00 0.09 0.00 0.00 40.66 42.28 1c3t h LEU 56 CO 0.65 -0.28 0.31 -1.28 0.09 0.00 0.00 178.44 177.93 1c3t h SER 57 N 0.07 0.39 -1.10 -0.43 0.87 -1.03 -1.10 113.55 111.23 1c3t h SER 57 Ca 0.57 0.06 0.33 0.00 -1.23 0.00 0.00 61.79 61.52 1c3t h SER 57 Cb 1.16 -0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 62.99 1c3t h SER 57 CO -0.80 0.23 0.67 0.44 -0.53 0.00 0.00 176.83 176.84 1c3t h ASP 58 N 0.54 0.44 -0.39 6.23 3.32 -0.17 1.77 116.42 128.16 1c3t h ASP 58 Ca 0.33 0.15 -0.10 0.00 0.02 0.00 0.00 57.03 57.42 1c3t h ASP 58 Cb 0.35 0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.93 1c3t h ASP 58 CO -0.27 -0.08 0.13 -1.22 -1.72 0.00 0.00 179.24 176.09 1c3t n TYR 59 N -4.84 1.32 -3.74 4.55 4.01 -0.42 -4.93 117.16 113.12 1c3t n TYR 59 Ca 0.31 -0.70 -0.24 0.00 -0.16 0.00 0.00 57.90 57.11 1c3t n TYR 59 Cb 1.06 -0.44 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 1c3t n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1c3t n ASN 60 N 0.07 -4.50 -4.96 7.72 6.94 0.60 -4.94 115.26 116.19 1c3t n ASN 60 Ca 0.21 -0.93 -0.22 0.00 -0.02 0.00 0.00 54.58 53.62 1c3t n ASN 60 Cb 0.90 -1.50 0.01 0.00 -2.36 0.00 0.00 39.78 36.84 1c3t n ASN 60 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1c3t s LEU 61 N -4.83 3.62 0.30 -4.53 2.01 -1.23 -5.05 118.68 108.98 1c3t s LEU 61 Ca 0.00 0.19 0.03 0.00 0.01 0.00 0.00 54.13 54.36 1c3t s LEU 61 Cb -0.00 -3.08 -0.06 0.00 0.01 0.00 0.00 46.19 43.06 1c3t s LEU 61 CO 0.85 -0.75 0.08 -1.10 1.01 0.00 0.00 176.35 176.44 1c3t s GLN 62 N -4.55 1.57 0.03 1.70 1.11 -1.26 -4.95 119.66 113.31 1c3t s GLN 62 Ca 0.49 -1.86 -0.30 0.00 0.01 0.00 0.00 55.36 53.70 1c3t s GLN 62 Cb -0.10 -0.60 -0.07 0.00 -1.01 0.00 0.00 33.01 31.23 1c3t s GLN 62 CO 0.37 -0.25 1.60 0.21 0.01 0.00 0.00 175.29 177.24 1c3t s LYS 63 N -3.94 4.21 -0.36 2.91 2.20 -1.26 -3.71 119.74 119.79 1c3t s LYS 63 Ca 0.37 2.23 -0.02 0.00 -0.36 0.00 0.00 55.97 58.19 1c3t s LYS 63 Cb 0.08 -3.66 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1c3t s LYS 63 CO 0.15 -0.72 0.36 0.39 -0.36 0.00 0.00 175.35 175.17 1c3t n GLU 64 N 5.81 -0.80 -4.04 4.03 1.02 0.51 -5.00 120.64 122.16 1c3t n GLU 64 Ca 0.15 1.09 -0.22 0.00 -0.02 0.00 0.00 57.16 58.16 1c3t n GLU 64 Cb 0.42 -3.76 -0.03 0.00 -0.02 0.00 0.00 31.44 28.05 1c3t n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1c3t s SER 65 N -2.41 5.89 -0.50 1.62 0.01 -1.24 -4.85 113.70 112.23 1c3t s SER 65 Ca 0.02 -0.08 -0.04 0.00 1.31 0.00 0.00 55.95 57.17 1c3t s SER 65 Cb -0.01 -1.62 0.13 0.00 0.21 0.00 0.00 66.02 64.73 1c3t s SER 65 CO 0.40 -0.03 0.31 -0.89 0.41 0.00 0.00 173.24 173.44 1c3t s THR 66 N -2.00 3.60 -0.14 1.44 2.01 -1.26 -0.77 115.64 118.53 1c3t s THR 66 Ca 0.33 -2.33 -0.13 0.00 0.31 0.00 0.00 61.69 59.87 1c3t s THR 66 Cb -0.09 -3.41 -0.05 0.00 0.01 0.00 0.00 72.50 68.97 1c3t s THR 66 CO 0.27 -0.77 0.28 -0.63 -0.69 0.00 0.00 174.62 173.07 1c3t s ILE 67 N 0.75 5.30 -0.64 1.82 1.01 -1.02 -4.64 121.20 123.77 1c3t s ILE 67 Ca 0.11 0.52 -0.21 0.00 0.00 0.00 0.00 60.65 61.07 1c3t s ILE 67 Cb -0.22 -3.60 0.09 0.00 0.01 0.00 0.00 42.46 38.73 1c3t s ILE 67 CO -0.04 0.44 0.85 -1.00 0.00 0.00 0.00 174.94 175.20 1c3t s HIS 68 N 0.12 2.84 -0.37 3.97 3.76 -1.24 -1.52 115.29 122.85 1c3t s HIS 68 Ca 0.17 -0.77 -0.23 0.00 -0.15 0.00 0.00 55.06 54.07 1c3t s HIS 68 Cb -0.13 -4.17 0.01 0.00 1.11 0.00 0.00 32.58 29.40 1c3t s HIS 68 CO 0.05 -1.48 0.80 -1.17 -0.85 0.00 0.00 174.74 172.08 1c3t s LEU 69 N 3.38 4.12 0.13 0.89 2.96 -0.50 -0.93 118.68 128.72 1c3t s LEU 69 Ca 0.18 0.38 0.10 0.00 -0.22 0.00 0.00 54.13 54.57 1c3t s LEU 69 Cb -0.20 -3.05 -0.04 0.00 0.50 0.00 0.00 46.19 43.40 1c3t s LEU 69 CO 0.08 -0.75 -0.23 0.68 -1.32 0.00 0.00 176.35 174.80 1c3t s VAL 70 N 3.15 2.51 0.45 1.68 -7.23 0.86 -3.78 120.40 118.03 1c3t s VAL 70 Ca 0.32 -1.67 -0.21 0.00 -1.81 0.00 0.00 61.98 58.62 1c3t s VAL 70 Cb -0.13 -2.13 -0.10 0.00 0.56 0.00 0.00 36.38 34.57 1c3t s VAL 70 CO 0.17 0.08 0.97 -0.76 -0.31 0.00 0.00 175.10 175.26 1c3t s LEU 71 N -2.12 3.91 0.21 1.32 2.01 -1.26 -0.94 118.68 121.81 1c3t s LEU 71 Ca 0.16 1.75 0.05 0.00 0.01 0.00 0.00 54.13 56.10 1c3t s LEU 71 Cb -0.10 -4.54 -0.03 0.00 0.01 0.00 0.00 46.19 41.52 1c3t s LEU 71 CO 0.08 -0.47 0.28 -0.60 1.01 0.00 0.00 176.35 176.65 1c3t s ARG 72 N -3.20 3.28 -0.06 1.70 3.52 -0.87 -4.86 118.95 118.46 1c3t s ARG 72 Ca 0.63 -0.79 0.06 0.00 -0.13 0.00 0.00 55.73 55.51 1c3t s ARG 72 Cb -0.11 -2.82 -0.09 0.00 -1.56 0.00 0.00 34.95 30.38 1c3t s ARG 72 CO 0.15 0.45 0.05 1.28 -0.81 0.00 0.00 175.30 176.42 1c3t n LEU 73 N -1.02 0.00 0.00 -0.88 4.32 -1.26 -4.98 117.00 113.17 1c3t n LEU 73 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.91 1c3t n LEU 73 Cb 0.56 0.13 0.00 0.00 -1.62 0.00 0.00 43.42 42.50 1c3t n LEU 73 CO 0.45 0.13 0.00 -2.11 -1.22 0.00 0.00 177.39 174.65 1c3t n ARG 74 N -2.16 0.00 0.00 3.23 1.85 -1.26 -5.14 116.66 113.18 1c3t n ARG 74 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 1c3t n ARG 74 Cb 0.62 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.03 1c3t n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1c3t n GLY 75 N 0.00 0.23 0.00 2.89 0.00 -1.26 -5.23 105.19 101.82 1c3t n GLY 75 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1c3t n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93