#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ct6 s SER 2 N 0.00 0.08 0.41 1.61 1.04 -1.26 -5.05 113.70 110.54 2ct6 s SER 2 Ca 0.00 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.15 2ct6 s SER 2 Cb 0.00 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.29 2ct6 s SER 2 CO 0.00 -0.34 0.00 -1.20 0.98 0.00 0.00 173.24 172.68 2ct6 n SER 3 N 1.54 -3.34 -4.69 7.02 7.64 -1.26 -5.14 113.62 115.39 2ct6 n SER 3 Ca -0.23 0.78 -0.30 0.00 1.01 0.00 0.00 58.87 60.13 2ct6 n SER 3 Cb 0.55 3.17 0.15 0.00 -1.01 0.00 0.00 64.21 67.07 2ct6 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2ct6 s GLY 4 N -2.35 1.64 0.24 0.23 0.00 -1.26 -4.94 107.32 100.88 2ct6 s GLY 4 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.86 2ct6 s GLY 4 CO 0.00 0.61 0.00 1.44 0.00 0.00 0.00 173.10 175.15 2ct6 n SER 5 N -4.01 -2.14 -2.26 1.64 7.64 -1.26 -4.40 113.62 108.83 2ct6 n SER 5 Ca 0.08 0.48 -0.02 0.00 1.01 0.00 0.00 58.87 60.42 2ct6 n SER 5 Cb 0.54 2.22 -0.02 0.00 -1.01 0.00 0.00 64.21 65.94 2ct6 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2ct6 n SER 6 N -2.98 -5.61 -4.76 6.43 7.64 -1.26 -4.67 113.62 108.42 2ct6 n SER 6 Ca 0.00 1.45 -0.41 0.00 1.01 0.00 0.00 58.87 60.92 2ct6 n SER 6 Cb 0.00 -4.66 -0.02 0.00 -1.01 0.00 0.00 64.21 58.52 2ct6 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2ct6 s GLY 7 N -0.54 2.75 0.62 0.23 0.00 -1.26 -4.99 107.32 104.13 2ct6 s GLY 7 Ca -0.09 1.24 -0.12 0.00 0.00 0.00 0.00 44.72 45.75 2ct6 s GLY 7 CO 0.25 2.01 1.03 1.06 0.00 0.00 0.00 173.10 177.45 2ct6 s MET 8 N -1.15 3.53 -0.26 2.90 1.00 -1.26 -5.07 119.30 118.98 2ct6 s MET 8 Ca 0.53 0.82 -0.05 0.00 0.00 0.00 0.00 55.69 56.99 2ct6 s MET 8 Cb -0.39 -2.07 0.14 0.00 0.00 0.00 0.00 34.83 32.51 2ct6 s MET 8 CO 0.48 -0.62 0.52 0.08 0.00 0.00 0.00 175.02 175.47 2ct6 s VAL 9 N -3.08 -0.83 -1.20 -6.03 1.01 -1.26 -4.77 120.40 104.24 2ct6 s VAL 9 Ca 0.56 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.36 2ct6 s VAL 9 Cb -0.11 -0.88 0.03 0.00 0.00 0.00 0.00 36.38 35.41 2ct6 s VAL 9 CO 0.51 -0.02 1.74 -0.63 0.00 0.00 0.00 175.10 176.71 2ct6 s ILE 10 N 2.74 3.92 -0.63 2.22 -1.09 -1.14 -3.46 121.20 123.75 2ct6 s ILE 10 Ca 0.08 -1.42 -0.26 0.00 -2.23 0.00 0.00 60.65 56.83 2ct6 s ILE 10 Cb -0.14 -4.97 -0.09 0.00 -1.58 0.00 0.00 42.46 35.68 2ct6 s ILE 10 CO -0.18 -1.73 2.34 -0.13 -1.23 0.00 0.00 174.94 174.02 2ct6 s ARG 11 N 5.00 1.98 -0.48 2.79 0.52 -0.31 -2.42 118.95 126.03 2ct6 s ARG 11 Ca 0.57 0.93 -0.23 0.00 -0.52 0.00 0.00 55.73 56.48 2ct6 s ARG 11 Cb 0.02 -4.67 0.03 0.00 0.52 0.00 0.00 34.95 30.86 2ct6 s ARG 11 CO 0.05 -3.66 0.79 0.08 0.02 0.00 0.00 175.30 172.59 2ct6 s VAL 12 N 12.78 4.62 -0.07 3.52 1.01 0.36 -0.83 120.40 141.79 2ct6 s VAL 12 Ca 0.92 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.84 2ct6 s VAL 12 Cb -0.15 -4.37 -0.03 0.00 0.00 0.00 0.00 36.38 31.84 2ct6 s VAL 12 CO 0.18 -0.83 1.16 -0.36 0.00 0.00 0.00 175.10 175.24 2ct6 s PHE 13 N 3.34 3.26 0.06 5.22 0.40 -1.18 0.00 117.98 129.08 2ct6 s PHE 13 Ca 0.27 1.30 0.04 0.00 -0.60 0.00 0.00 56.93 57.94 2ct6 s PHE 13 Cb -0.13 -3.37 -0.03 0.00 0.51 0.00 0.00 43.02 40.00 2ct6 s PHE 13 CO 0.20 -1.06 -0.12 0.96 0.70 0.00 0.00 175.22 175.90 2ct6 s ILE 14 N 2.21 0.92 -0.51 0.64 -5.25 -0.26 -2.00 121.20 116.94 2ct6 s ILE 14 Ca 0.54 -1.24 0.03 0.00 -0.99 0.00 0.00 60.65 58.99 2ct6 s ILE 14 Cb -0.23 -0.92 0.14 0.00 2.95 0.00 0.00 42.46 44.40 2ct6 s ILE 14 CO 0.21 -0.28 0.29 0.00 -1.79 0.00 0.00 174.94 173.36 2ct6 s ALA 15 N -1.34 2.83 0.00 2.27 0.00 -1.26 0.11 121.76 124.37 2ct6 s ALA 15 Ca -0.05 -3.05 0.00 0.00 0.00 0.00 0.00 51.96 48.86 2ct6 s ALA 15 Cb -0.10 -2.02 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2ct6 s ALA 15 CO 0.02 -2.05 0.32 0.45 0.00 0.00 0.00 175.76 174.50 2ct6 n SER 16 N 3.08 0.00 -4.33 0.00 2.88 -1.26 -2.56 113.62 111.44 2ct6 n SER 16 Ca 0.10 0.32 -0.26 0.00 -1.33 0.00 0.00 58.87 57.71 2ct6 n SER 16 Cb 0.34 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.71 2ct6 n SER 16 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2ct6 n SER 17 N -0.69 1.89 -0.06 -3.46 7.64 -1.26 -4.28 113.62 113.40 2ct6 n SER 17 Ca 0.00 -2.57 -0.13 0.00 1.01 0.00 0.00 58.87 57.18 2ct6 n SER 17 Cb 0.00 -1.49 -0.04 0.00 -1.01 0.00 0.00 64.21 61.66 2ct6 n SER 17 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ct6 n SER 18 N 15.61 1.01 0.00 6.43 3.41 -1.06 -5.03 113.62 133.99 2ct6 n SER 18 Ca 0.44 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 2ct6 n SER 18 Cb 0.45 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2ct6 n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ct6 n GLY 19 N 2.27 2.60 3.55 5.00 0.00 -1.26 -5.00 105.19 112.36 2ct6 n GLY 19 Ca -0.24 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 2ct6 n GLY 19 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ct6 n PHE 20 N 0.00 1.03 -0.42 1.61 3.72 -1.26 -4.71 117.46 117.42 2ct6 n PHE 20 Ca 0.00 -0.04 0.35 0.00 -0.05 0.00 0.00 57.45 57.70 2ct6 n PHE 20 Cb 0.00 -2.46 0.64 0.00 -0.94 0.00 0.00 39.48 36.72 2ct6 n PHE 20 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 2ct6 h VAL 21 N 7.46 0.24 -0.74 -4.37 3.04 -1.99 0.76 116.25 120.66 2ct6 h VAL 21 Ca 0.00 -0.05 0.17 0.00 -1.01 0.00 0.00 66.70 65.81 2ct6 h VAL 21 Cb 1.01 0.08 -0.13 0.00 -2.01 0.00 0.00 31.29 30.24 2ct6 h VAL 21 CO 1.04 0.03 -0.02 0.00 -1.01 0.00 0.00 177.57 177.61 2ct6 h ALA 22 N 1.53 0.74 -0.04 3.17 0.00 -2.01 0.21 119.26 122.86 2ct6 h ALA 22 Ca 0.75 0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.94 2ct6 h ALA 22 Cb 2.39 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 20.56 2ct6 h ALA 22 CO -0.31 -0.42 -0.20 0.82 0.00 0.00 0.00 179.25 179.13 2ct6 h ILE 23 N 0.09 0.51 -0.18 0.00 2.04 0.25 -1.93 117.51 118.30 2ct6 h ILE 23 Ca 0.40 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.28 2ct6 h ILE 23 Cb 0.69 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2ct6 h ILE 23 CO -0.66 0.00 -0.15 0.11 0.00 0.00 0.00 178.15 177.44 2ct6 h LYS 24 N -0.30 -0.06 -0.99 2.37 1.57 -0.63 1.61 116.57 120.14 2ct6 h LYS 24 Ca 0.07 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.11 2ct6 h LYS 24 Cb 0.40 0.01 -0.19 0.00 0.08 0.00 0.00 32.23 32.54 2ct6 h LYS 24 CO -0.22 -0.04 -0.03 1.63 -0.57 0.00 0.00 179.45 180.22 2ct6 n LYS 25 N -3.49 -0.08 0.14 3.15 5.02 -0.74 0.93 118.16 123.08 2ct6 n LYS 25 Ca -0.00 1.50 -0.14 0.00 -2.02 0.00 0.00 58.31 57.65 2ct6 n LYS 25 Cb 0.08 -2.35 -0.08 0.00 -0.02 0.00 0.00 35.03 32.66 2ct6 n LYS 25 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2ct6 h LYS 26 N 0.00 -0.31 -0.65 1.97 1.57 0.43 0.17 116.57 119.76 2ct6 h LYS 26 Ca 0.58 0.02 0.19 0.00 -1.87 0.00 0.00 60.65 59.56 2ct6 h LYS 26 Cb 1.14 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2ct6 h LYS 26 CO -0.95 -0.08 0.53 1.96 -0.57 0.00 0.00 179.45 180.34 2ct6 h GLN 27 N -0.49 0.00 0.02 3.15 4.20 0.89 -1.69 115.11 121.18 2ct6 h GLN 27 Ca -0.03 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 2ct6 h GLN 27 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2ct6 h GLN 27 CO 0.05 0.00 -0.01 1.96 -0.67 0.00 0.00 178.83 180.17 2ct6 h GLN 28 N 0.00 -0.02 -1.97 1.46 1.08 0.72 -3.25 115.11 113.13 2ct6 h GLN 28 Ca 0.31 0.00 0.57 0.00 -1.45 0.00 0.00 58.65 58.08 2ct6 h GLN 28 Cb 1.36 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 28.72 2ct6 h GLN 28 CO -0.00 -0.01 1.42 0.22 -0.95 0.00 0.00 178.83 179.50 2ct6 h ASP 29 N -1.00 0.00 0.00 1.46 1.82 0.01 0.36 116.42 119.08 2ct6 h ASP 29 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2ct6 h ASP 29 Cb 0.02 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.03 2ct6 h ASP 29 CO 0.00 -0.00 0.00 0.52 -1.61 0.00 0.00 179.24 178.15 2ct6 n VAL 30 N -3.95 0.00 -0.37 2.25 0.31 -0.70 -2.14 118.33 113.73 2ct6 n VAL 30 Ca 0.45 0.34 -0.02 0.00 -0.01 0.00 0.00 64.34 65.10 2ct6 n VAL 30 Cb 2.01 -0.99 0.03 0.00 -0.91 0.00 0.00 33.84 33.98 2ct6 n VAL 30 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 2ct6 n VAL 31 N -0.03 -0.52 -0.34 2.52 3.14 -0.91 0.47 118.33 122.66 2ct6 n VAL 31 Ca 0.00 2.27 -0.02 0.00 -2.96 0.00 0.00 64.34 63.62 2ct6 n VAL 31 Cb 0.00 -2.97 0.01 0.00 -1.06 0.00 0.00 33.84 29.82 2ct6 n VAL 31 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2ct6 n ARG 32 N -5.40 -0.24 -0.16 1.45 5.12 0.12 0.16 116.66 117.72 2ct6 n ARG 32 Ca 0.09 1.35 -0.05 0.00 -1.93 0.00 0.00 57.85 57.32 2ct6 n ARG 32 Cb 0.37 -2.00 0.05 0.00 -1.16 0.00 0.00 32.46 29.71 2ct6 n ARG 32 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2ct6 h PHE 33 N 0.00 0.45 0.05 -1.55 3.04 0.55 0.80 116.94 120.29 2ct6 h PHE 33 Ca 0.28 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.25 2ct6 h PHE 33 Cb 0.50 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 38.88 2ct6 h PHE 33 CO -0.80 0.22 -0.03 -0.07 -2.02 0.00 0.00 178.31 175.62 2ct6 h LEU 34 N 0.49 -0.06 -0.10 0.59 3.38 0.17 0.29 115.31 120.07 2ct6 h LEU 34 Ca 0.22 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2ct6 h LEU 34 Cb 0.12 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2ct6 h LEU 34 CO -0.15 0.06 0.00 -0.33 0.09 0.00 0.00 178.44 178.12 2ct6 h GLU 35 N -0.18 0.04 0.00 1.13 4.39 0.21 1.78 114.58 121.94 2ct6 h GLU 35 Ca -0.01 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 2ct6 h GLU 35 Cb 0.16 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2ct6 h GLU 35 CO 0.01 0.03 -0.05 0.00 -1.16 0.00 0.00 179.01 177.84 2ct6 h ALA 36 N 1.08 1.30 -0.40 3.43 0.00 0.75 0.26 119.26 125.68 2ct6 h ALA 36 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ct6 h ALA 36 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2ct6 h ALA 36 CO -0.07 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.33 2ct6 n ASN 37 N -3.58 3.38 -3.88 0.00 3.02 0.10 -4.95 115.26 109.34 2ct6 n ASN 37 Ca -0.02 -1.96 -0.25 0.00 -0.03 0.00 0.00 54.58 52.31 2ct6 n ASN 37 Cb 0.16 -0.26 0.01 0.00 -0.61 0.00 0.00 39.78 39.07 2ct6 n ASN 37 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ct6 n LYS 38 N 1.36 -4.23 -3.86 3.52 4.76 0.42 -4.95 118.16 115.19 2ct6 n LYS 38 Ca 0.18 0.51 -0.32 0.00 -2.87 0.00 0.00 58.31 55.82 2ct6 n LYS 38 Cb 0.57 -4.96 -0.04 0.00 -1.84 0.00 0.00 35.03 28.75 2ct6 n LYS 38 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ct6 s ILE 39 N -3.70 5.34 0.14 -0.18 1.01 0.50 -4.97 121.20 119.35 2ct6 s ILE 39 Ca 0.17 -0.24 -0.28 0.00 0.00 0.00 0.00 60.65 60.29 2ct6 s ILE 39 Cb -0.09 -3.62 -0.07 0.00 0.01 0.00 0.00 42.46 38.70 2ct6 s ILE 39 CO 0.85 0.15 0.89 -1.83 0.00 0.00 0.00 174.94 175.00 2ct6 s GLU 40 N -2.44 4.68 0.02 2.79 -1.05 -1.26 -4.49 118.70 116.96 2ct6 s GLU 40 Ca 0.35 1.34 -0.18 0.00 -0.15 0.00 0.00 54.97 56.33 2ct6 s GLU 40 Cb -0.13 -3.33 0.06 0.00 -0.44 0.00 0.00 34.13 30.29 2ct6 s GLU 40 CO 0.26 0.37 0.81 1.97 0.95 0.00 0.00 175.26 179.62 2ct6 n PHE 41 N 2.24 -0.52 -3.69 4.83 1.16 -1.26 -2.90 117.46 117.31 2ct6 n PHE 41 Ca -0.01 -0.58 -0.14 0.00 -1.87 0.00 0.00 57.45 54.85 2ct6 n PHE 41 Cb 0.49 0.27 -0.09 0.00 -1.61 0.00 0.00 39.48 38.54 2ct6 n PHE 41 CO 0.00 0.00 0.00 -1.83 -1.87 0.00 0.00 176.76 173.06 2ct6 s GLU 42 N -2.02 0.64 -0.95 3.97 -1.05 -1.02 -4.77 118.70 113.50 2ct6 s GLU 42 Ca 0.19 0.63 -0.17 0.00 -0.15 0.00 0.00 54.97 55.47 2ct6 s GLU 42 Cb -0.01 0.31 0.16 0.00 -0.44 0.00 0.00 34.13 34.15 2ct6 s GLU 42 CO 0.01 -0.09 1.10 -1.21 0.95 0.00 0.00 175.26 176.01 2ct6 s GLU 43 N 0.08 3.69 -0.86 -4.83 2.02 -1.26 0.14 118.70 117.67 2ct6 s GLU 43 Ca -0.02 -2.06 -0.25 0.00 0.02 0.00 0.00 54.97 52.67 2ct6 s GLU 43 Cb -0.04 -4.83 -0.04 0.00 0.10 0.00 0.00 34.13 29.33 2ct6 s GLU 43 CO 0.02 -1.66 1.92 0.08 0.02 0.00 0.00 175.26 175.63 2ct6 s VAL 44 N 1.91 3.45 -0.98 2.63 1.01 0.10 -4.81 120.40 123.70 2ct6 s VAL 44 Ca 0.31 -0.29 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 2ct6 s VAL 44 Cb -0.06 -4.03 -0.16 0.00 0.00 0.00 0.00 36.38 32.13 2ct6 s VAL 44 CO -0.08 -0.97 2.18 -0.62 0.00 0.00 0.00 175.10 175.60 2ct6 s ASP 45 N 7.94 3.92 0.65 3.32 -1.08 -1.25 -1.11 116.67 129.06 2ct6 s ASP 45 Ca 0.69 -0.69 0.41 0.00 -0.52 0.00 0.00 52.55 52.44 2ct6 s ASP 45 Cb -0.07 -2.58 2.26 0.00 -1.46 0.00 0.00 42.92 41.07 2ct6 s ASP 45 CO 0.02 -4.09 2.33 0.16 0.52 0.00 0.00 175.17 174.11 2ct6 h ILE 46 N 7.02 0.10 -0.11 4.11 3.07 0.52 -1.50 117.51 130.72 2ct6 h ILE 46 Ca 0.04 -0.05 -0.01 0.00 1.55 0.00 0.00 64.86 66.39 2ct6 h ILE 46 Cb 0.99 1.04 -0.00 0.00 -0.27 0.00 0.00 36.82 38.58 2ct6 h ILE 46 CO 1.05 0.00 0.02 0.74 -1.05 0.00 0.00 178.15 178.92 2ct6 h THR 47 N 0.00 1.21 0.33 0.16 2.02 -1.81 -3.31 112.91 111.51 2ct6 h THR 47 Ca -0.00 -0.64 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 2ct6 h THR 47 Cb 0.04 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2ct6 h THR 47 CO 0.00 0.19 -0.16 0.24 0.37 0.00 0.00 175.52 176.16 2ct6 h MET 48 N -0.04 -0.43 -5.74 6.66 2.86 -1.63 -3.40 114.93 113.21 2ct6 h MET 48 Ca 0.03 0.03 -0.61 0.00 -2.06 0.00 0.00 59.70 57.09 2ct6 h MET 48 Cb 0.27 0.10 -0.13 0.00 0.06 0.00 0.00 31.60 31.90 2ct6 h MET 48 CO 0.00 -0.15 0.59 -1.12 1.06 0.00 0.00 176.91 177.29 2ct6 s SER 49 N -5.09 6.27 0.11 1.22 0.01 -0.75 -4.91 113.70 110.56 2ct6 s SER 49 Ca -0.10 -0.59 -0.28 0.00 1.31 0.00 0.00 55.95 56.28 2ct6 s SER 49 Cb 0.01 -2.44 -0.09 0.00 0.21 0.00 0.00 66.02 63.71 2ct6 s SER 49 CO 0.36 -1.35 1.63 -0.08 0.41 0.00 0.00 173.24 174.21 2ct6 h GLU 50 N 9.45 -0.52 -0.90 12.44 4.57 -1.79 -2.69 114.58 135.13 2ct6 h GLU 50 Ca -0.27 0.04 0.10 0.00 -1.18 0.00 0.00 59.36 58.04 2ct6 h GLU 50 Cb 1.07 0.12 -0.12 0.00 -0.16 0.00 0.00 28.75 29.66 2ct6 h GLU 50 CO 1.13 -0.35 -0.53 1.49 -1.18 0.00 0.00 179.01 179.57 2ct6 h GLU 51 N -0.54 -0.06 -0.93 1.92 4.81 -1.91 0.48 114.58 118.35 2ct6 h GLU 51 Ca 0.02 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 59.44 2ct6 h GLU 51 Cb 0.55 0.01 -0.18 0.00 0.63 0.00 0.00 28.75 29.77 2ct6 h GLU 51 CO -0.15 -0.04 -0.24 1.96 -0.73 0.00 0.00 179.01 179.81 2ct6 h GLN 52 N -0.06 -0.00 0.64 1.92 1.08 -1.80 0.46 115.11 117.34 2ct6 h GLN 52 Ca 0.19 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.36 2ct6 h GLN 52 Cb 0.48 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.92 2ct6 h GLN 52 CO -0.89 -0.00 -0.31 -0.09 -0.95 0.00 0.00 178.83 176.59 2ct6 h ARG 53 N -0.00 -0.82 -0.79 1.46 2.43 -0.00 -2.36 114.38 114.29 2ct6 h ARG 53 Ca 0.44 0.06 0.19 0.00 -0.81 0.00 0.00 59.98 59.86 2ct6 h ARG 53 Cb 0.68 0.19 -0.13 0.00 -0.42 0.00 0.00 29.97 30.28 2ct6 h ARG 53 CO -0.96 -0.52 0.07 1.96 -1.51 0.00 0.00 179.97 179.01 2ct6 h GLN 54 N -0.94 0.13 -0.02 0.20 1.08 0.16 0.20 115.11 115.92 2ct6 h GLN 54 Ca -0.09 -0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.14 2ct6 h GLN 54 Cb 0.68 -0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 28.03 2ct6 h GLN 54 CO 0.14 0.09 -0.38 2.35 -0.95 0.00 0.00 178.83 180.08 2ct6 h TRP 55 N 0.14 -1.07 -0.51 2.96 7.01 -0.02 -1.44 115.95 123.02 2ct6 h TRP 55 Ca 0.45 0.04 0.10 0.00 2.11 0.00 0.00 58.89 61.59 2ct6 h TRP 55 Cb 0.82 0.47 -0.10 0.00 -2.10 0.00 0.00 29.16 28.25 2ct6 h TRP 55 CO -0.38 -0.46 -0.21 1.98 -2.79 0.00 0.00 178.44 176.58 2ct6 h MET 56 N -0.52 -0.09 0.00 2.65 4.05 -0.14 1.01 114.93 121.90 2ct6 h MET 56 Ca 0.06 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2ct6 h MET 56 Cb 0.61 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 2ct6 h MET 56 CO -0.31 -0.06 0.17 1.88 0.23 0.00 0.00 176.91 178.82 2ct6 h TYR 57 N -0.09 0.00 0.00 1.39 -1.99 -0.12 1.05 116.97 117.21 2ct6 h TYR 57 Ca 0.24 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.97 2ct6 h TYR 57 Cb 0.46 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.19 2ct6 h TYR 57 CO -0.50 0.00 -1.65 1.63 -0.00 0.00 0.00 178.16 177.64 2ct6 n LYS 58 N -2.28 0.55 -1.90 4.88 5.02 0.32 -4.30 118.16 120.46 2ct6 n LYS 58 Ca -0.01 -0.13 -0.29 0.00 -2.02 0.00 0.00 58.31 55.85 2ct6 n LYS 58 Cb 0.20 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 33.77 2ct6 n LYS 58 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ct6 n ASN 59 N -2.00 5.94 -3.47 4.39 5.03 0.36 -4.91 115.26 120.60 2ct6 n ASN 59 Ca -0.02 -3.77 -0.04 0.00 0.87 0.00 0.00 54.58 51.63 2ct6 n ASN 59 Cb 0.47 -0.61 -0.06 0.00 -1.02 0.00 0.00 39.78 38.56 2ct6 n ASN 59 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2ct6 s VAL 60 N -4.87 -0.79 0.90 2.41 1.01 -0.83 -4.84 120.40 113.39 2ct6 s VAL 60 Ca 0.54 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.44 2ct6 s VAL 60 Cb 0.44 -0.85 0.13 0.00 0.00 0.00 0.00 36.38 36.11 2ct6 s VAL 60 CO -0.06 -0.01 1.13 -2.16 0.00 0.00 0.00 175.10 174.01 2ct6 s PRO 61 N 2.71 1.22 0.25 2.72 0.04 -1.26 -4.86 135.00 135.82 2ct6 s PRO 61 Ca 0.06 0.31 0.12 0.00 0.04 0.00 0.00 61.00 61.53 2ct6 s PRO 61 Cb -0.14 -1.85 0.25 0.00 0.04 0.00 0.00 34.50 32.81 2ct6 s PRO 61 CO -0.17 -2.15 1.54 -1.00 0.04 0.00 0.00 177.00 175.26 2ct6 h PRO 62 N -1.46 0.00 0.00 0.56 0.13 -1.99 -0.30 132.00 128.94 2ct6 h PRO 62 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2ct6 h PRO 62 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2ct6 h PRO 62 CO 0.62 0.66 0.00 -0.85 -0.23 0.00 0.00 178.00 178.20 2ct6 n GLU 63 N -3.58 0.01 -0.03 0.86 0.28 -1.26 -2.57 120.64 114.34 2ct6 n GLU 63 Ca -0.00 0.20 -0.01 0.00 -0.16 0.00 0.00 57.16 57.18 2ct6 n GLU 63 Cb 0.69 -1.52 -0.08 0.00 1.43 0.00 0.00 31.44 31.96 2ct6 n GLU 63 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2ct6 n LYS 64 N -1.54 1.70 -1.69 3.44 4.76 -1.06 -5.00 118.16 118.77 2ct6 n LYS 64 Ca 0.04 -0.04 -0.67 0.00 -2.87 0.00 0.00 58.31 54.78 2ct6 n LYS 64 Cb 0.22 -1.24 -0.10 0.00 -1.84 0.00 0.00 35.03 32.06 2ct6 n LYS 64 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2ct6 n LYS 65 N -2.18 0.04 -1.54 1.97 5.02 -0.15 -4.89 118.16 116.44 2ct6 n LYS 65 Ca -0.11 0.01 -0.29 0.00 -2.02 0.00 0.00 58.31 55.91 2ct6 n LYS 65 Cb 0.62 -1.52 0.15 0.00 -0.02 0.00 0.00 35.03 34.26 2ct6 n LYS 65 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2ct6 s PRO 66 N 3.38 0.91 0.00 1.97 0.04 -1.26 -4.76 135.00 135.28 2ct6 s PRO 66 Ca 1.07 0.20 0.00 0.00 0.04 0.00 0.00 61.00 62.30 2ct6 s PRO 66 Cb -1.49 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2ct6 s PRO 66 CO 0.80 -2.34 0.00 2.41 0.04 0.00 0.00 177.00 177.91 2ct6 n THR 67 N -3.84 0.00 -3.71 1.26 -1.04 -1.26 -4.51 114.28 101.18 2ct6 n THR 67 Ca 0.08 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.99 2ct6 n THR 67 Cb 0.59 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.05 2ct6 n THR 67 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2ct6 s GLN 68 N 0.00 1.11 2.89 -2.82 -1.52 -1.26 -5.13 119.66 112.93 2ct6 s GLN 68 Ca 0.00 -0.81 0.00 0.00 -1.95 0.00 0.00 55.36 52.60 2ct6 s GLN 68 Cb 0.00 0.46 0.00 0.00 -0.22 0.00 0.00 33.01 33.25 2ct6 s GLN 68 CO 0.00 -0.43 0.00 0.41 -0.25 0.00 0.00 175.29 175.02 2ct6 n GLY 69 N -0.23 0.15 3.34 3.09 0.00 -1.26 -4.81 105.19 105.47 2ct6 n GLY 69 Ca -0.14 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 2ct6 n GLY 69 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ct6 n ASN 70 N -1.76 -2.82 -4.72 1.61 0.23 -1.26 -4.79 115.26 101.75 2ct6 n ASN 70 Ca 0.00 0.31 -0.42 0.00 -0.53 0.00 0.00 54.58 53.94 2ct6 n ASN 70 Cb 0.00 -1.12 -0.03 0.00 -2.08 0.00 0.00 39.78 36.55 2ct6 n ASN 70 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 2ct6 s PRO 71 N -3.32 4.48 0.24 -0.53 0.04 -1.26 -4.79 135.00 129.86 2ct6 s PRO 71 Ca 0.54 1.73 0.09 0.00 0.04 0.00 0.00 61.00 63.39 2ct6 s PRO 71 Cb -0.21 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 2ct6 s PRO 71 CO 0.70 -0.17 0.04 -0.51 0.04 0.00 0.00 177.00 177.10 2ct6 s LEU 72 N 0.73 3.35 0.90 -3.56 1.43 -1.26 -4.89 118.68 115.37 2ct6 s LEU 72 Ca 0.56 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 2ct6 s LEU 72 Cb -0.29 -1.90 0.13 0.00 0.03 0.00 0.00 46.19 44.16 2ct6 s LEU 72 CO 0.30 0.01 1.13 -2.16 0.23 0.00 0.00 176.35 175.87 2ct6 s PRO 73 N -3.54 1.22 0.73 1.29 0.04 -1.26 -4.62 135.00 128.86 2ct6 s PRO 73 Ca 0.31 0.31 -0.11 0.00 0.04 0.00 0.00 61.00 61.55 2ct6 s PRO 73 Cb -0.07 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.65 2ct6 s PRO 73 CO 0.21 -2.15 1.07 -1.25 0.04 0.00 0.00 177.00 174.92 2ct6 s PRO 74 N -5.27 2.61 -0.41 0.56 0.04 -1.26 -4.81 135.00 126.46 2ct6 s PRO 74 Ca 0.64 0.84 0.04 0.00 0.04 0.00 0.00 61.00 62.56 2ct6 s PRO 74 Cb -0.15 -1.96 0.18 0.00 0.04 0.00 0.00 34.50 32.61 2ct6 s PRO 74 CO 0.53 -1.30 0.37 1.04 0.04 0.00 0.00 177.00 177.69 2ct6 n GLN 75 N -3.25 0.25 -1.63 4.56 1.13 -0.85 -3.48 117.38 114.11 2ct6 n GLN 75 Ca 0.07 -3.13 -0.46 0.00 -1.94 0.00 0.00 57.00 51.55 2ct6 n GLN 75 Cb 0.55 -1.62 -0.03 0.00 0.11 0.00 0.00 30.24 29.25 2ct6 n GLN 75 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 2ct6 n ILE 76 N 2.70 1.18 -3.43 5.09 -0.00 -0.84 -3.11 119.36 120.96 2ct6 n ILE 76 Ca 0.29 -0.30 -0.16 0.00 -0.00 0.00 0.00 62.75 62.58 2ct6 n ILE 76 Cb 0.49 -1.18 -0.11 0.00 -0.00 0.00 0.00 39.64 38.84 2ct6 n ILE 76 CO 0.00 0.00 0.00 -0.36 -0.00 0.00 0.00 176.55 176.19 2ct6 s PHE 77 N -0.35 -0.46 -1.02 1.39 0.08 -0.01 -3.06 117.98 114.55 2ct6 s PHE 77 Ca 0.67 0.27 -0.23 0.00 0.12 0.00 0.00 56.93 57.76 2ct6 s PHE 77 Cb -0.72 -0.30 0.05 0.00 -0.57 0.00 0.00 43.02 41.49 2ct6 s PHE 77 CO 0.53 -0.71 1.43 1.21 -0.10 0.00 0.00 175.22 177.58 2ct6 s ASN 78 N 2.39 6.51 0.02 1.36 3.84 -1.05 -1.16 114.94 126.85 2ct6 s ASN 78 Ca 0.09 -1.49 0.00 0.00 0.21 0.00 0.00 52.86 51.67 2ct6 s ASN 78 Cb -0.15 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 37.99 2ct6 s ASN 78 CO -0.18 -1.48 0.00 0.61 -2.79 0.00 0.00 177.10 173.26 2ct6 n GLY 79 N 6.80 1.99 0.14 1.21 0.00 -1.23 -2.17 105.19 111.93 2ct6 n GLY 79 Ca 0.33 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2ct6 n GLY 79 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ct6 n ASP 80 N 5.90 0.26 -4.44 1.61 5.68 -1.26 -4.97 116.55 119.33 2ct6 n ASP 80 Ca 0.00 -1.45 -0.37 0.00 -0.50 0.00 0.00 54.79 52.48 2ct6 n ASP 80 Cb 0.00 -0.07 -0.12 0.00 -1.14 0.00 0.00 41.12 39.78 2ct6 n ASP 80 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 2ct6 s ARG 81 N -0.20 3.57 -0.18 0.11 3.52 -0.92 -5.04 118.95 119.81 2ct6 s ARG 81 Ca 0.01 -0.54 -0.29 0.00 -0.13 0.00 0.00 55.73 54.79 2ct6 s ARG 81 Cb 0.01 -3.36 -0.06 0.00 -1.56 0.00 0.00 34.95 29.98 2ct6 s ARG 81 CO 0.00 -0.24 2.18 0.98 -0.81 0.00 0.00 175.30 177.42 2ct6 n TYR 82 N 4.93 2.04 -0.03 5.12 9.36 -1.26 -2.53 117.16 134.78 2ct6 n TYR 82 Ca -0.16 -0.15 -0.01 0.00 3.32 0.00 0.00 57.90 60.90 2ct6 n TYR 82 Cb 0.51 -2.73 -0.00 0.00 -0.63 0.00 0.00 39.34 36.48 2ct6 n TYR 82 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2ct6 n GLY 84 N 1.78 3.23 3.95 0.00 0.00 -1.17 -4.98 105.19 107.99 2ct6 n GLY 84 Ca -0.02 -1.10 -0.28 0.00 0.00 0.00 0.00 46.02 44.62 2ct6 n GLY 84 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ct6 s ASP 85 N 0.00 3.17 0.31 1.61 -4.77 -1.26 -1.98 116.67 113.75 2ct6 s ASP 85 Ca 0.00 0.00 0.04 0.00 -3.30 0.00 0.00 52.55 49.30 2ct6 s ASP 85 Cb 0.00 -0.04 0.82 0.00 -1.09 0.00 0.00 42.92 42.61 2ct6 s ASP 85 CO 0.00 -2.67 1.59 0.22 0.70 0.00 0.00 175.17 175.01 2ct6 h TYR 86 N -1.48 0.17 -0.28 2.11 3.20 -1.92 0.34 116.97 119.12 2ct6 h TYR 86 Ca -0.42 0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.57 2ct6 h TYR 86 Cb 1.23 0.08 -0.08 0.00 1.54 0.00 0.00 36.73 39.50 2ct6 h TYR 86 CO -1.16 -0.38 -0.45 0.22 -1.64 0.00 0.00 178.16 174.75 2ct6 h ASP 87 N 0.06 -1.45 -0.15 -2.11 1.82 -1.91 0.51 116.42 113.17 2ct6 h ASP 87 Ca 0.62 0.20 0.05 0.00 -0.39 0.00 0.00 57.03 57.51 2ct6 h ASP 87 Cb 1.33 0.61 -0.05 0.00 0.68 0.00 0.00 39.33 41.90 2ct6 h ASP 87 CO -0.83 -0.40 -0.19 -1.28 -1.61 0.00 0.00 179.24 174.93 2ct6 h SER 88 N -0.42 -0.58 0.06 2.28 0.87 -0.69 0.15 113.55 115.23 2ct6 h SER 88 Ca 0.10 0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2ct6 h SER 88 Cb 0.61 0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 2ct6 h SER 88 CO -0.50 -0.23 -0.25 0.15 -0.53 0.00 0.00 176.83 175.47 2ct6 h PHE 89 N -0.22 -0.73 -0.45 2.24 3.57 -0.20 0.91 116.94 122.06 2ct6 h PHE 89 Ca 0.11 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.71 2ct6 h PHE 89 Cb 0.38 0.31 -0.10 0.00 2.79 0.00 0.00 35.95 39.33 2ct6 h PHE 89 CO -0.31 -0.29 -0.35 0.35 -2.23 0.00 0.00 178.31 175.49 2ct6 h PHE 90 N -0.36 -0.98 -0.78 0.41 3.57 0.13 0.76 116.94 119.69 2ct6 h PHE 90 Ca -0.00 0.06 0.18 0.00 3.53 0.00 0.00 57.97 61.74 2ct6 h PHE 90 Cb 0.36 0.49 -0.12 0.00 2.79 0.00 0.00 35.95 39.48 2ct6 h PHE 90 CO -0.36 -0.39 0.20 0.93 -2.23 0.00 0.00 178.31 176.45 2ct6 h GLU 91 N -0.25 0.25 0.00 1.11 4.39 -0.42 1.03 114.58 120.70 2ct6 h GLU 91 Ca 0.18 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.81 2ct6 h GLU 91 Cb 0.55 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2ct6 h GLU 91 CO -0.58 0.17 -0.24 0.77 -1.16 0.00 0.00 179.01 177.97 2ct6 h SER 92 N 0.26 0.00 -0.26 1.42 0.02 0.17 -3.08 113.55 112.09 2ct6 h SER 92 Ca 0.45 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.38 2ct6 h SER 92 Cb 0.82 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 2ct6 h SER 92 CO -0.55 0.24 0.08 0.50 -1.14 0.00 0.00 176.83 175.96 2ct6 h LYS 93 N 0.00 0.40 0.00 3.45 3.64 0.74 0.99 116.57 125.79 2ct6 h LYS 93 Ca -0.00 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2ct6 h LYS 93 Cb 0.86 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2ct6 h LYS 93 CO 0.03 0.47 -0.03 0.93 -2.27 0.00 0.00 179.45 178.58 2ct6 h GLU 94 N 0.25 0.00 -0.03 1.90 5.08 -1.07 0.16 114.58 120.87 2ct6 h GLU 94 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2ct6 h GLU 94 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2ct6 h GLU 94 CO -0.00 0.03 -0.07 0.43 -1.00 0.00 0.00 179.01 178.39 2ct6 n SER 95 N -4.14 2.77 -3.50 1.42 7.64 -0.79 -4.97 113.62 112.05 2ct6 n SER 95 Ca -0.03 -1.90 -0.21 0.00 1.01 0.00 0.00 58.87 57.75 2ct6 n SER 95 Cb 0.11 0.07 0.06 0.00 -1.01 0.00 0.00 64.21 63.44 2ct6 n SER 95 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2ct6 n ASN 96 N 1.08 -4.22 0.00 6.43 3.02 0.26 -4.90 115.26 116.92 2ct6 n ASN 96 Ca 0.14 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 2ct6 n ASN 96 Cb 0.57 -4.46 0.00 0.00 -0.61 0.00 0.00 39.78 35.28 2ct6 n ASN 96 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2ct6 n THR 97 N -3.86 0.17 -0.34 3.41 -2.24 0.27 -4.81 114.28 106.88 2ct6 n THR 97 Ca -0.17 -0.44 -0.01 0.00 -2.27 0.00 0.00 64.05 61.17 2ct6 n THR 97 Cb 0.64 1.14 0.04 0.00 -2.10 0.00 0.00 70.33 70.04 2ct6 n THR 97 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2ct6 n VAL 98 N -0.08 -0.46 -0.16 2.28 0.31 -1.23 0.20 118.33 119.19 2ct6 n VAL 98 Ca 0.00 2.07 -0.04 0.00 -0.01 0.00 0.00 64.34 66.36 2ct6 n VAL 98 Cb 0.13 -2.74 0.02 0.00 -0.91 0.00 0.00 33.84 30.34 2ct6 n VAL 98 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2ct6 h PHE 99 N 0.00 -0.60 -0.24 3.52 -1.00 -1.88 0.54 116.94 117.29 2ct6 h PHE 99 Ca 0.31 0.06 -0.08 0.00 2.81 0.00 0.00 57.97 61.07 2ct6 h PHE 99 Cb 0.53 0.34 -0.01 0.00 3.61 0.00 0.00 35.95 40.43 2ct6 h PHE 99 CO -0.77 -0.32 -0.17 0.77 -1.61 0.00 0.00 178.31 176.21 2ct6 h SER 100 N -0.12 0.56 -1.07 2.17 0.02 0.78 1.48 113.55 117.37 2ct6 h SER 100 Ca 0.23 -0.44 0.29 0.00 -0.84 0.00 0.00 61.79 61.02 2ct6 h SER 100 Cb 0.48 -0.16 -0.11 0.00 0.14 0.00 0.00 62.40 62.76 2ct6 h SER 100 CO -0.57 0.88 0.67 0.15 -1.14 0.00 0.00 176.83 176.82 2ct6 h PHE 101 N 0.24 0.72 0.00 3.45 3.57 0.35 1.03 116.94 126.30 2ct6 h PHE 101 Ca 0.05 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.40 2ct6 h PHE 101 Cb 0.70 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 2ct6 h PHE 101 CO 0.07 0.01 -1.00 -0.07 -2.23 0.00 0.00 178.31 175.09 2ct6 h LEU 102 N 0.38 0.00 0.00 0.59 3.38 -0.78 -3.45 115.31 115.43 2ct6 h LEU 102 Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.61 2ct6 h LEU 102 Cb 1.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.36 2ct6 h LEU 102 CO -0.37 0.72 0.00 0.61 0.09 0.00 0.00 178.44 179.49 2ct6 n GLY 103 N 1.34 1.76 3.72 0.83 0.00 0.36 -4.52 105.19 108.68 2ct6 n GLY 103 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2ct6 n GLY 103 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ct6 s LEU 104 N 0.00 4.16 0.14 0.99 1.43 0.50 -4.85 118.68 121.05 2ct6 s LEU 104 Ca 0.00 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 2ct6 s LEU 104 Cb 0.00 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.15 2ct6 s LEU 104 CO 0.00 0.19 0.00 2.29 0.23 0.00 0.00 176.35 179.06 2ct6 n LYS 105 N 3.47 -4.08 0.00 1.70 2.85 -1.26 -3.42 118.16 117.42 2ct6 n LYS 105 Ca -0.16 3.03 0.00 0.00 -1.05 0.00 0.00 58.31 60.13 2ct6 n LYS 105 Cb 0.52 -3.15 0.00 0.00 -0.65 0.00 0.00 35.03 31.75 2ct6 n LYS 105 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2ct6 n SER 106 N 1.39 0.00 0.00 -5.58 7.64 -1.26 -4.76 113.62 111.05 2ct6 n SER 106 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2ct6 n SER 106 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2ct6 n SER 106 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ct6 n GLY 107 N 0.00 -0.01 3.45 0.23 0.00 -1.26 -4.25 105.19 103.35 2ct6 n GLY 107 Ca 0.00 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 2ct6 n GLY 107 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ct6 n PRO 108 N 0.00 2.37 -3.81 1.61 -0.04 -1.26 -4.93 135.00 128.94 2ct6 n PRO 108 Ca 0.00 -2.75 -0.34 0.00 -0.04 0.00 0.00 63.50 60.37 2ct6 n PRO 108 Cb 0.00 -3.51 -0.05 0.00 -0.04 0.00 0.00 33.50 29.90 2ct6 n PRO 108 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2ct6 s SER 109 N 5.08 6.45 -0.11 3.54 1.04 -1.26 -4.75 113.70 123.69 2ct6 s SER 109 Ca 0.59 0.48 -0.03 0.00 0.48 0.00 0.00 55.95 57.48 2ct6 s SER 109 Cb 0.04 -2.06 0.01 0.00 0.10 0.00 0.00 66.02 64.12 2ct6 s SER 109 CO 0.09 0.24 0.06 -1.20 0.98 0.00 0.00 173.24 173.42 2ct6 n SER 110 N 0.99 -5.65 0.00 7.02 7.64 -1.26 -5.06 113.62 117.30 2ct6 n SER 110 Ca -0.11 1.02 0.00 0.00 1.01 0.00 0.00 58.87 60.79 2ct6 n SER 110 Cb 0.53 -3.29 0.00 0.00 -1.01 0.00 0.00 64.21 60.44 2ct6 n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64