#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctq s SER 2 N 0.00 -0.11 0.56 1.61 1.04 -1.26 -5.18 113.70 110.36 2ctq s SER 2 Ca 0.00 -0.10 0.03 0.00 0.48 0.00 0.00 55.95 56.36 2ctq s SER 2 Cb 0.00 0.19 0.05 0.00 0.10 0.00 0.00 66.02 66.36 2ctq s SER 2 CO 0.00 -0.34 0.77 -0.44 0.98 0.00 0.00 173.24 174.22 2ctq s SER 3 N -2.65 5.19 -0.29 7.02 0.01 -1.26 -5.12 113.70 116.59 2ctq s SER 3 Ca 0.12 -0.19 -0.23 0.00 1.31 0.00 0.00 55.95 56.96 2ctq s SER 3 Cb 0.02 -0.63 0.17 0.00 0.21 0.00 0.00 66.02 65.79 2ctq s SER 3 CO -0.04 -1.20 1.26 -0.83 0.41 0.00 0.00 173.24 172.84 2ctq s GLY 4 N -4.48 0.23 -1.05 3.44 0.00 -1.26 -5.09 107.32 99.12 2ctq s GLY 4 Ca 0.59 3.31 -0.19 0.00 0.00 0.00 0.00 44.72 48.43 2ctq s GLY 4 CO 0.38 2.10 1.36 -0.56 0.00 0.00 0.00 173.10 176.38 2ctq s SER 5 N 0.36 6.67 0.78 1.64 0.01 -1.26 -5.00 113.70 116.90 2ctq s SER 5 Ca 0.02 -2.02 -0.07 0.00 1.31 0.00 0.00 55.95 55.19 2ctq s SER 5 Cb -0.04 -2.48 0.12 0.00 0.21 0.00 0.00 66.02 63.83 2ctq s SER 5 CO -0.12 -1.19 1.09 -0.94 0.41 0.00 0.00 173.24 172.49 2ctq s SER 6 N 4.06 4.18 0.00 2.44 1.04 -1.26 -5.11 113.70 119.05 2ctq s SER 6 Ca 0.41 0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.93 2ctq s SER 6 Cb -0.02 -0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2ctq s SER 6 CO -0.06 -2.00 0.00 0.61 0.98 0.00 0.00 173.24 172.77 2ctq n GLY 7 N -3.11 0.82 2.96 7.32 0.00 -1.26 -5.03 105.19 106.89 2ctq n GLY 7 Ca 0.13 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 2ctq n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ctq s MET 8 N 0.00 1.54 -0.47 1.61 1.00 -1.26 -4.98 119.30 116.74 2ctq s MET 8 Ca 0.00 -1.40 0.03 0.00 0.00 0.00 0.00 55.69 54.32 2ctq s MET 8 Cb 0.00 -2.78 0.45 0.00 0.00 0.00 0.00 34.83 32.50 2ctq s MET 8 CO 0.00 -0.78 1.57 -3.47 0.00 0.00 0.00 175.02 172.34 2ctq n ASP 9 N 4.50 6.18 -4.35 3.03 2.03 -1.26 -4.91 116.55 121.77 2ctq n ASP 9 Ca -0.05 -3.77 -0.46 0.00 0.52 0.00 0.00 54.79 51.04 2ctq n ASP 9 Cb 0.43 -0.63 -0.01 0.00 -0.72 0.00 0.00 41.12 40.18 2ctq n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ctq s ALA 10 N -3.71 4.37 -0.02 -1.67 0.00 -1.26 -5.00 121.76 114.47 2ctq s ALA 10 Ca 0.57 -3.56 0.05 0.00 0.00 0.00 0.00 51.96 49.02 2ctq s ALA 10 Cb 0.45 -3.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 2ctq s ALA 10 CO 0.00 -2.33 -0.16 0.42 0.00 0.00 0.00 175.76 173.70 2ctq s ILE 11 N -0.29 1.30 0.75 0.00 1.01 -1.26 -5.12 121.20 117.58 2ctq s ILE 11 Ca 0.28 -0.69 -0.17 0.00 0.00 0.00 0.00 60.65 60.06 2ctq s ILE 11 Cb -0.09 -1.08 -0.14 0.00 0.01 0.00 0.00 42.46 41.15 2ctq s ILE 11 CO -0.08 0.37 -0.39 0.00 0.00 0.00 0.00 174.94 174.84 2ctq n LEU 12 N 2.76 -4.44 -4.56 2.97 -0.00 -1.26 -4.76 117.00 107.71 2ctq n LEU 12 Ca -0.15 0.43 -0.40 0.00 -0.00 0.00 0.00 56.01 55.89 2ctq n LEU 12 Cb 0.54 -0.84 -0.03 0.00 -0.00 0.00 0.00 43.42 43.09 2ctq n LEU 12 CO 0.24 -5.25 1.36 0.20 -0.00 0.00 0.00 177.39 173.94 2ctq s ASN 13 N -1.04 6.25 -0.20 1.45 -0.87 -1.26 -4.82 114.94 114.44 2ctq s ASN 13 Ca 0.50 -0.95 0.04 0.00 -1.57 0.00 0.00 52.86 50.88 2ctq s ASN 13 Cb -0.34 -2.56 0.40 0.00 -0.02 0.00 0.00 41.25 38.73 2ctq s ASN 13 CO 0.73 -1.74 1.39 0.00 -2.57 0.00 0.00 177.10 174.91 2ctq n TYR 14 N 9.51 1.49 -0.32 2.20 0.18 -1.26 -4.65 117.16 124.31 2ctq n TYR 14 Ca 0.21 -0.92 -0.08 0.00 1.88 0.00 0.00 57.90 58.99 2ctq n TYR 14 Cb 0.50 -0.52 -0.07 0.00 -0.38 0.00 0.00 39.34 38.87 2ctq n TYR 14 CO 0.00 0.00 0.00 -2.13 -2.08 0.00 0.00 176.86 172.65 2ctq n ARG 15 N -0.12 -0.33 -0.10 -3.48 3.00 -1.26 -3.24 116.66 111.13 2ctq n ARG 15 Ca 0.26 1.14 -0.17 0.00 -0.00 0.00 0.00 57.85 59.09 2ctq n ARG 15 Cb 1.01 -1.68 -0.09 0.00 0.00 0.00 0.00 32.46 31.70 2ctq n ARG 15 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2ctq n SER 16 N -4.95 2.12 -3.98 6.15 7.64 -1.26 -4.98 113.62 114.36 2ctq n SER 16 Ca 0.02 0.02 -0.33 0.00 1.01 0.00 0.00 58.87 59.59 2ctq n SER 16 Cb 0.20 -0.43 -0.06 0.00 -1.01 0.00 0.00 64.21 62.91 2ctq n SER 16 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2ctq n GLU 17 N -3.39 -1.04 -2.01 1.43 0.28 -1.20 -4.77 120.64 109.93 2ctq n GLU 17 Ca -0.38 0.11 -0.39 0.00 -0.16 0.00 0.00 57.16 56.34 2ctq n GLU 17 Cb 0.85 -4.24 0.02 0.00 1.43 0.00 0.00 31.44 29.50 2ctq n GLU 17 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2ctq n ASP 18 N -2.04 7.40 -3.79 -1.84 5.75 -1.26 -4.88 116.55 115.89 2ctq n ASP 18 Ca 0.09 -3.71 -0.28 0.00 -0.01 0.00 0.00 54.79 50.88 2ctq n ASP 18 Cb 0.41 -1.12 -0.16 0.00 -1.03 0.00 0.00 41.12 39.22 2ctq n ASP 18 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ctq s THR 19 N -4.48 0.79 -0.67 2.12 2.01 -1.26 -5.06 115.64 109.10 2ctq s THR 19 Ca 0.50 -0.72 0.05 0.00 0.31 0.00 0.00 61.69 61.84 2ctq s THR 19 Cb 0.38 -1.23 0.20 0.00 0.01 0.00 0.00 72.50 71.86 2ctq s THR 19 CO -0.33 -0.17 0.57 -1.84 -0.69 0.00 0.00 174.62 172.16 2ctq n GLU 20 N 4.95 1.95 -3.53 4.92 0.00 -1.26 -5.07 120.64 122.60 2ctq n GLU 20 Ca -0.10 -4.46 -0.26 0.00 0.00 0.00 0.00 57.16 52.34 2ctq n GLU 20 Cb 0.46 -2.22 -0.02 0.00 0.00 0.00 0.00 31.44 29.66 2ctq n GLU 20 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2ctq s ASP 21 N -1.72 6.36 0.05 -1.84 2.15 -1.26 -5.02 116.67 115.40 2ctq s ASP 21 Ca 0.30 0.46 -0.23 0.00 0.43 0.00 0.00 52.55 53.52 2ctq s ASP 21 Cb 0.03 -2.04 -0.14 0.00 -0.30 0.00 0.00 42.92 40.47 2ctq s ASP 21 CO -0.12 -0.17 1.53 1.88 -0.17 0.00 0.00 175.17 178.12 2ctq h TYR 22 N 1.44 0.15 0.00 -5.34 -1.99 -2.00 -2.24 116.97 106.99 2ctq h TYR 22 Ca -0.49 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.22 2ctq h TYR 22 Cb 1.20 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.89 2ctq h TYR 22 CO 0.54 0.34 0.11 1.88 -0.00 0.00 0.00 178.16 181.02 2ctq h TYR 23 N -0.08 0.00 0.16 4.88 -1.99 -1.96 -0.96 116.97 117.02 2ctq h TYR 23 Ca 0.03 0.00 -0.35 0.00 2.00 0.00 0.00 58.73 60.40 2ctq h TYR 23 Cb 0.27 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.00 2ctq h TYR 23 CO 0.01 0.00 -1.83 1.15 -0.00 0.00 0.00 178.16 177.49 2ctq h THR 24 N 0.00 0.82 -0.67 -2.88 2.02 -1.68 0.70 112.91 111.22 2ctq h THR 24 Ca 0.00 -2.44 0.13 0.00 0.77 0.00 0.00 66.41 64.88 2ctq h THR 24 Cb 0.22 2.66 -0.10 0.00 -1.74 0.00 0.00 68.15 69.19 2ctq h THR 24 CO 0.00 0.87 0.16 -0.07 0.37 0.00 0.00 175.52 176.85 2ctq h LEU 25 N 0.06 0.04 -0.48 2.58 3.38 -0.64 0.05 115.31 120.29 2ctq h LEU 25 Ca -0.37 0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2ctq h LEU 25 Cb 2.05 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.97 2ctq h LEU 25 CO 0.14 0.00 -0.49 0.18 0.09 0.00 0.00 178.44 178.36 2ctq n LEU 26 N -5.12 1.24 -2.61 1.67 4.77 -1.18 -4.95 117.00 110.82 2ctq n LEU 26 Ca 0.11 -0.41 -0.19 0.00 -0.03 0.00 0.00 56.01 55.49 2ctq n LEU 26 Cb 0.38 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.42 2ctq n LEU 26 CO 0.15 0.25 -0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2ctq n GLY 27 N 1.42 -0.35 3.91 -0.72 0.00 0.00 -4.33 105.19 105.13 2ctq n GLY 27 Ca 0.09 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 2ctq n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ctq s ASP 29 N -4.27 0.37 0.47 0.00 1.01 -1.26 -4.61 116.67 108.38 2ctq s ASP 29 Ca 0.44 -0.85 0.31 0.00 0.71 0.00 0.00 52.55 53.16 2ctq s ASP 29 Cb -0.03 0.22 1.41 0.00 1.01 0.00 0.00 42.92 45.53 2ctq s ASP 29 CO 0.27 -0.60 1.72 1.05 0.21 0.00 0.00 175.17 177.82 2ctq h GLU 30 N 3.21 0.14 -0.28 8.23 4.11 -2.01 0.89 114.58 128.86 2ctq h GLU 30 Ca -0.34 -0.01 -0.13 0.00 0.07 0.00 0.00 59.36 58.96 2ctq h GLU 30 Cb 1.16 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2ctq h GLU 30 CO 0.61 0.09 -0.36 -0.07 0.07 0.00 0.00 179.01 179.35 2ctq h LEU 31 N 0.14 0.66 -9.98 3.06 3.38 -2.05 -3.44 115.31 107.09 2ctq h LEU 31 Ca 0.68 -0.28 -0.53 0.00 0.09 0.00 0.00 57.88 57.84 2ctq h LEU 31 Cb 2.28 -0.18 0.10 0.00 0.09 0.00 0.00 40.66 42.94 2ctq h LEU 31 CO -0.20 0.96 0.63 -0.44 0.09 0.00 0.00 178.44 179.48 2ctq s SER 32 N -6.83 6.04 0.27 -0.43 0.01 0.31 -5.03 113.70 108.05 2ctq s SER 32 Ca -0.08 2.71 0.06 0.00 1.31 0.00 0.00 55.95 59.96 2ctq s SER 32 Cb 0.12 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 2ctq s SER 32 CO 0.83 -1.04 0.30 -0.44 0.41 0.00 0.00 173.24 173.30 2ctq s SER 33 N -0.75 5.80 0.24 2.44 0.01 -1.26 -4.79 113.70 115.39 2ctq s SER 33 Ca 0.60 -0.18 -0.12 0.00 1.31 0.00 0.00 55.95 57.57 2ctq s SER 33 Cb -0.39 -1.46 0.33 0.00 0.21 0.00 0.00 66.02 64.71 2ctq s SER 33 CO 0.50 -0.15 1.45 0.52 0.41 0.00 0.00 173.24 175.96 2ctq n VAL 34 N -1.35 -0.44 -0.24 3.43 0.31 -1.26 -0.27 118.33 118.52 2ctq n VAL 34 Ca -0.06 2.15 -0.09 0.00 -0.01 0.00 0.00 64.34 66.33 2ctq n VAL 34 Cb 0.58 -2.91 -0.05 0.00 -0.91 0.00 0.00 33.84 30.55 2ctq n VAL 34 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2ctq h GLU 35 N 0.00 -0.20 0.36 5.55 5.08 -2.00 -0.99 114.58 122.38 2ctq h GLU 35 Ca 0.39 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.74 2ctq h GLU 35 Cb 0.62 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2ctq h GLU 35 CO -0.94 -0.13 -0.17 1.96 -1.00 0.00 0.00 179.01 178.73 2ctq h GLN 36 N -0.20 -0.46 -0.90 2.33 4.20 -1.02 -2.88 115.11 116.18 2ctq h GLN 36 Ca 0.18 0.03 0.33 0.00 0.06 0.00 0.00 58.65 59.25 2ctq h GLN 36 Cb 0.55 0.11 -0.16 0.00 0.30 0.00 0.00 27.48 28.27 2ctq h GLN 36 CO -0.73 -0.19 0.31 -0.89 -0.67 0.00 0.00 178.83 176.65 2ctq n ILE 37 N -5.21 -0.38 0.09 2.54 5.41 0.07 0.41 119.36 122.28 2ctq n ILE 37 Ca -0.10 1.89 -0.13 0.00 1.00 0.00 0.00 62.75 65.41 2ctq n ILE 37 Cb 0.26 -2.94 -0.08 0.00 -0.71 0.00 0.00 39.64 36.16 2ctq n ILE 37 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2ctq h LEU 38 N 0.00 -0.21 -0.85 1.39 3.38 -1.07 -1.81 115.31 116.14 2ctq h LEU 38 Ca 0.68 -0.26 0.18 0.00 0.09 0.00 0.00 57.88 58.56 2ctq h LEU 38 Cb 1.69 0.05 -0.16 0.00 0.09 0.00 0.00 40.66 42.33 2ctq h LEU 38 CO -0.75 0.18 -0.19 0.00 0.09 0.00 0.00 178.44 177.77 2ctq h ALA 39 N 0.09 0.61 0.08 1.53 0.00 0.17 0.48 119.26 122.21 2ctq h ALA 39 Ca -0.02 0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2ctq h ALA 39 Cb 0.46 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2ctq h ALA 39 CO 0.04 -0.41 -0.04 0.93 0.00 0.00 0.00 179.25 179.78 2ctq h GLU 40 N 0.01 -0.10 -0.65 0.00 5.08 -1.39 -2.05 114.58 115.48 2ctq h GLU 40 Ca 0.42 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.94 2ctq h GLU 40 Cb 0.66 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 2ctq h GLU 40 CO -0.87 0.24 0.45 0.35 -1.00 0.00 0.00 179.01 178.18 2ctq h PHE 41 N -0.45 0.23 0.33 4.33 3.57 -0.17 0.23 116.94 125.02 2ctq h PHE 41 Ca -0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2ctq h PHE 41 Cb 0.38 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.05 2ctq h PHE 41 CO 0.04 0.09 -0.16 0.87 -2.23 0.00 0.00 178.31 176.92 2ctq h LYS 42 N 0.19 -0.43 -0.71 1.11 1.57 0.04 -1.92 116.57 116.42 2ctq h LYS 42 Ca 0.31 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 59.21 2ctq h LYS 42 Cb 0.97 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.31 2ctq h LYS 42 CO -0.06 -0.29 0.36 -0.39 -0.57 0.00 0.00 179.45 178.51 2ctq h VAL 43 N -0.96 0.87 -0.16 0.50 -1.51 -1.05 0.15 116.25 114.09 2ctq h VAL 43 Ca -0.05 -0.21 -0.05 0.00 -1.23 0.00 0.00 66.70 65.16 2ctq h VAL 43 Cb 0.34 0.19 -0.01 0.00 -2.13 0.00 0.00 31.29 29.68 2ctq h VAL 43 CO 0.07 0.11 -0.11 0.03 -1.23 0.00 0.00 177.57 176.45 2ctq h ARG 44 N 0.62 0.25 -0.04 5.19 3.08 -0.66 -0.52 114.38 122.32 2ctq h ARG 44 Ca 0.34 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.30 2ctq h ARG 44 Cb 0.34 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2ctq h ARG 44 CO -0.25 0.37 -0.12 0.00 -1.07 0.00 0.00 179.97 178.90 2ctq h ALA 45 N 1.65 0.06 -0.23 0.04 0.00 -0.24 -3.00 119.26 117.54 2ctq h ALA 45 Ca 0.05 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2ctq h ALA 45 Cb 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2ctq h ALA 45 CO 0.02 -0.03 0.09 -0.07 0.00 0.00 0.00 179.25 179.26 2ctq h LEU 46 N -0.41 0.32 -2.53 0.00 -0.00 -0.89 0.31 115.31 112.10 2ctq h LEU 46 Ca -0.00 -0.16 0.01 0.00 -0.00 0.00 0.00 57.88 57.73 2ctq h LEU 46 Cb 0.75 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 41.33 2ctq h LEU 46 CO 0.03 0.39 0.13 -0.33 -0.00 0.00 0.00 178.44 178.66 2ctq h GLU 47 N 0.22 0.00 -0.17 1.13 5.08 -1.18 -1.20 114.58 118.46 2ctq h GLU 47 Ca 0.08 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.27 2ctq h GLU 47 Cb 0.17 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.19 2ctq h GLU 47 CO -0.01 0.00 -0.78 0.00 -1.00 0.00 0.00 179.01 177.23 2ctq s HIS 49 N -2.43 3.47 -0.02 0.00 5.04 0.10 -4.60 115.29 116.85 2ctq s HIS 49 Ca 0.38 1.50 -0.25 0.00 -1.54 0.00 0.00 55.06 55.14 2ctq s HIS 49 Cb 0.38 -3.38 -0.20 0.00 0.04 0.00 0.00 32.58 29.42 2ctq s HIS 49 CO -0.08 -1.00 1.23 -1.00 -2.34 0.00 0.00 174.74 171.55 2ctq h PRO 50 N 5.02 -0.05 -0.89 2.88 0.13 -1.83 -0.83 132.00 136.42 2ctq h PRO 50 Ca -0.45 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.86 2ctq h PRO 50 Cb 1.21 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 32.25 2ctq h PRO 50 CO 0.73 0.41 0.47 0.22 -0.23 0.00 0.00 178.00 179.60 2ctq h ASP 51 N -0.55 0.55 0.01 1.44 3.58 -1.97 0.39 116.42 119.86 2ctq h ASP 51 Ca -0.01 0.10 -0.25 0.00 0.42 0.00 0.00 57.03 57.30 2ctq h ASP 51 Cb 0.49 0.02 0.02 0.00 1.72 0.00 0.00 39.33 41.58 2ctq h ASP 51 CO 0.01 0.19 -0.96 0.50 -2.88 0.00 0.00 179.24 176.10 2ctq h LYS 52 N 0.61 0.69 -2.28 0.28 1.63 -1.94 -3.37 116.57 112.19 2ctq h LYS 52 Ca 0.51 -0.68 -0.60 0.00 -0.85 0.00 0.00 60.65 59.03 2ctq h LYS 52 Cb 0.78 0.18 -0.41 0.00 -0.60 0.00 0.00 32.23 32.18 2ctq h LYS 52 CO -0.40 1.28 -0.69 0.72 -3.45 0.00 0.00 179.45 176.91 2ctq n HIS 53 N -3.86 2.79 0.04 1.91 8.25 -0.32 -4.90 115.22 119.12 2ctq n HIS 53 Ca -0.09 -4.05 -0.05 0.00 -0.26 0.00 0.00 57.72 53.26 2ctq n HIS 53 Cb 0.84 -0.51 0.14 0.00 1.12 0.00 0.00 29.99 31.58 2ctq n HIS 53 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2ctq h PRO 54 N 4.35 0.41 -1.55 -0.41 0.13 -0.47 -3.13 132.00 131.33 2ctq h PRO 54 Ca 0.17 -0.22 0.47 0.00 -0.87 0.00 0.00 66.00 65.56 2ctq h PRO 54 Cb 0.72 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 31.76 2ctq h PRO 54 CO 0.74 0.78 1.07 1.05 -0.23 0.00 0.00 178.00 181.41 2ctq h GLU 55 N 0.34 0.04 -4.98 0.86 4.11 -1.91 -3.33 114.58 109.71 2ctq h GLU 55 Ca 0.02 -0.00 -0.64 0.00 0.07 0.00 0.00 59.36 58.81 2ctq h GLU 55 Cb 0.91 -0.01 -0.21 0.00 0.50 0.00 0.00 28.75 29.95 2ctq h GLU 55 CO 0.08 0.03 -0.60 0.54 0.07 0.00 0.00 179.01 179.13 2ctq s ASN 56 N -4.37 5.36 0.08 3.06 4.22 -1.18 -4.99 114.94 117.11 2ctq s ASN 56 Ca -0.06 -0.13 -0.16 0.00 -2.14 0.00 0.00 52.86 50.36 2ctq s ASN 56 Cb 0.28 -1.96 -0.10 0.00 1.28 0.00 0.00 41.25 40.74 2ctq s ASN 56 CO 0.85 -0.01 1.40 1.55 -2.04 0.00 0.00 177.10 178.85 2ctq h PRO 57 N 8.06 0.60 -1.00 3.55 0.13 -1.86 -3.17 132.00 138.31 2ctq h PRO 57 Ca -0.37 -0.32 0.30 0.00 -0.87 0.00 0.00 66.00 64.74 2ctq h PRO 57 Cb 1.18 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 2ctq h PRO 57 CO 0.59 0.91 0.56 0.87 -0.23 0.00 0.00 178.00 180.70 2ctq h LYS 58 N 0.31 0.36 -0.59 0.86 6.56 -1.94 -1.98 116.57 120.15 2ctq h LYS 58 Ca 0.04 -0.02 0.05 0.00 -1.06 0.00 0.00 60.65 59.66 2ctq h LYS 58 Cb 0.80 -0.08 -0.07 0.00 -0.57 0.00 0.00 32.23 32.31 2ctq h LYS 58 CO 0.06 0.24 -0.35 0.00 -2.06 0.00 0.00 179.45 177.34 2ctq n ALA 59 N -2.32 -0.38 -0.28 3.86 0.00 -1.20 0.89 120.51 121.08 2ctq n ALA 59 Ca 0.30 0.50 0.09 0.00 0.00 0.00 0.00 53.44 54.34 2ctq n ALA 59 Cb 0.92 0.02 0.22 0.00 0.00 0.00 0.00 19.45 20.61 2ctq n ALA 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ctq h VAL 60 N 0.00 0.28 -0.53 0.00 2.07 -1.57 0.25 116.25 116.75 2ctq h VAL 60 Ca 0.09 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 2ctq h VAL 60 Cb 0.24 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 2ctq h VAL 60 CO -0.56 0.02 0.24 -0.33 0.02 0.00 0.00 177.57 176.97 2ctq h GLU 61 N 0.13 0.77 -0.09 1.57 3.07 0.40 0.61 114.58 121.03 2ctq h GLU 61 Ca 0.49 -0.12 0.03 0.00 -0.50 0.00 0.00 59.36 59.25 2ctq h GLU 61 Cb 0.93 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.70 2ctq h GLU 61 CO -0.70 0.65 0.07 1.15 -1.40 0.00 0.00 179.01 178.78 2ctq h THR 62 N 0.71 0.86 0.00 1.13 2.02 0.18 -2.53 112.91 115.28 2ctq h THR 62 Ca 0.18 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.26 2ctq h THR 62 Cb 0.14 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2ctq h THR 62 CO -0.02 0.00 -0.56 0.15 0.37 0.00 0.00 175.52 175.46 2ctq h PHE 63 N 0.00 0.00 -1.25 3.16 3.04 -0.63 -2.98 116.94 118.29 2ctq h PHE 63 Ca 0.04 0.00 0.36 0.00 3.98 0.00 0.00 57.97 62.35 2ctq h PHE 63 Cb 0.18 0.00 -0.08 0.00 2.56 0.00 0.00 35.95 38.61 2ctq h PHE 63 CO 0.00 1.15 0.85 1.96 -2.02 0.00 0.00 178.31 180.25 2ctq h GLN 64 N -1.00 0.13 0.06 1.11 1.08 -0.66 0.73 115.11 116.56 2ctq h GLN 64 Ca -0.15 -0.01 -0.27 0.00 -1.45 0.00 0.00 58.65 56.77 2ctq h GLN 64 Cb 1.08 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.46 2ctq h GLN 64 CO -0.09 0.09 -1.42 1.57 -0.95 0.00 0.00 178.83 178.03 2ctq h LYS 65 N 0.14 0.12 -0.40 1.46 2.10 -1.58 -3.10 116.57 115.31 2ctq h LYS 65 Ca 0.66 -0.21 -0.10 0.00 -2.00 0.00 0.00 60.65 59.00 2ctq h LYS 65 Cb 2.24 0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 33.64 2ctq h LYS 65 CO -0.17 0.95 -0.14 -0.07 -2.00 0.00 0.00 179.45 178.01 2ctq h LEU 66 N 0.03 0.82 -1.06 7.07 3.38 0.49 -2.06 115.31 123.98 2ctq h LEU 66 Ca -0.18 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.34 2ctq h LEU 66 Cb 1.94 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.46 2ctq h LEU 66 CO 0.13 1.02 -0.30 0.06 0.09 0.00 0.00 178.44 179.44 2ctq h GLN 67 N 0.61 0.00 0.33 1.13 3.07 -0.83 -2.95 115.11 116.47 2ctq h GLN 67 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.82 2ctq h GLN 67 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.25 2ctq h GLN 67 CO 0.05 0.30 -0.16 -0.22 0.09 0.00 0.00 178.83 178.89 2ctq h LYS 68 N 0.00 -0.42 -0.75 0.06 1.63 -1.42 -3.21 116.57 112.45 2ctq h LYS 68 Ca -0.00 0.03 0.17 0.00 -0.85 0.00 0.00 60.65 60.00 2ctq h LYS 68 Cb 0.80 0.10 -0.12 0.00 -0.60 0.00 0.00 32.23 32.41 2ctq h LYS 68 CO 0.04 -0.28 0.14 0.00 -3.45 0.00 0.00 179.45 175.90 2ctq h ALA 69 N -1.20 0.94 -0.09 5.00 0.00 -1.45 -2.07 119.26 120.40 2ctq h ALA 69 Ca -0.05 0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2ctq h ALA 69 Cb 0.34 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2ctq h ALA 69 CO 0.07 -0.38 -0.18 -0.22 0.00 0.00 0.00 179.25 178.55 2ctq h LYS 70 N 0.22 -0.15 -0.76 0.00 3.64 -1.62 0.86 116.57 118.76 2ctq h LYS 70 Ca 0.43 0.01 0.17 0.00 -1.27 0.00 0.00 60.65 59.99 2ctq h LYS 70 Cb 0.76 0.03 -0.12 0.00 -0.41 0.00 0.00 32.23 32.49 2ctq h LYS 70 CO -0.56 -0.10 0.16 1.49 -2.27 0.00 0.00 179.45 178.17 2ctq h GLU 71 N -0.16 0.23 -0.81 1.90 4.81 -1.44 1.02 114.58 120.13 2ctq h GLU 71 Ca 0.02 -0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 2ctq h GLU 71 Cb 0.20 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.46 2ctq h GLU 71 CO -0.17 0.15 0.45 0.82 -0.73 0.00 0.00 179.01 179.53 2ctq h ILE 72 N 0.24 0.89 0.00 2.32 1.08 -0.60 -1.71 117.51 119.72 2ctq h ILE 72 Ca 0.44 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.65 2ctq h ILE 72 Cb 0.78 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 2ctq h ILE 72 CO -0.56 0.14 -0.07 -0.07 -0.69 0.00 0.00 178.15 176.90 2ctq h LEU 73 N 0.75 0.00 -1.10 1.44 3.38 0.16 0.42 115.31 120.36 2ctq h LEU 73 Ca 0.39 0.00 0.36 0.00 0.09 0.00 0.00 57.88 58.72 2ctq h LEU 73 Cb 0.38 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.04 2ctq h LEU 73 CO -0.26 0.20 0.74 0.35 0.09 0.00 0.00 178.44 179.56 2ctq n THR 74 N -2.95 -0.13 -2.88 0.22 -2.24 0.32 -4.02 114.28 102.60 2ctq n THR 74 Ca -0.01 1.22 -0.41 0.00 -2.27 0.00 0.00 64.05 62.58 2ctq n THR 74 Cb 0.04 -2.02 -0.04 0.00 -2.10 0.00 0.00 70.33 66.21 2ctq n THR 74 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2ctq s ASN 75 N -4.23 7.11 0.36 3.42 -0.87 -0.64 -4.94 114.94 115.14 2ctq s ASN 75 Ca -0.05 1.34 0.11 0.00 -1.57 0.00 0.00 52.86 52.69 2ctq s ASN 75 Cb 0.21 -2.48 0.70 0.00 -0.02 0.00 0.00 41.25 39.66 2ctq s ASN 75 CO 0.60 -0.26 1.83 -0.33 -2.57 0.00 0.00 177.10 176.37 2ctq h GLU 76 N 6.96 0.11 0.01 -0.60 5.08 -1.87 0.72 114.58 124.98 2ctq h GLU 76 Ca -0.37 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2ctq h GLU 76 Cb 1.18 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2ctq h GLU 76 CO 0.78 0.41 -0.00 1.05 -1.00 0.00 0.00 179.01 180.25 2ctq h GLU 77 N 0.10 -0.01 -0.01 2.33 4.11 -1.90 -2.61 114.58 116.59 2ctq h GLU 77 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.44 2ctq h GLU 77 Cb 0.60 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2ctq h GLU 77 CO 0.04 0.47 -0.01 0.77 0.07 0.00 0.00 179.01 180.35 2ctq h SER 78 N -0.49 0.02 -0.72 3.06 0.02 -1.70 -2.91 113.55 110.83 2ctq h SER 78 Ca -0.00 -0.45 0.21 0.00 -0.84 0.00 0.00 61.79 60.71 2ctq h SER 78 Cb 0.48 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 2ctq h SER 78 CO 0.00 0.47 0.54 -0.09 -1.14 0.00 0.00 176.83 176.60 2ctq h ARG 79 N -0.42 0.00 0.44 3.45 2.43 0.23 0.10 114.38 120.61 2ctq h ARG 79 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2ctq h ARG 79 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2ctq h ARG 79 CO 0.00 0.00 -0.21 0.00 -1.51 0.00 0.00 179.97 178.25 2ctq h ALA 80 N 1.60 -0.61 -0.33 2.80 0.00 -1.31 -3.20 119.26 118.20 2ctq h ALA 80 Ca 0.34 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.17 2ctq h ALA 80 Cb 1.41 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2ctq h ALA 80 CO -0.00 -0.57 0.23 0.07 0.00 0.00 0.00 179.25 178.97 2ctq h ARG 81 N -1.10 0.22 -0.73 0.00 0.11 -1.22 -1.93 114.38 109.72 2ctq h ARG 81 Ca -0.06 -0.01 0.10 0.00 0.10 0.00 0.00 59.98 60.10 2ctq h ARG 81 Cb 0.45 -0.05 -0.07 0.00 1.11 0.00 0.00 29.97 31.41 2ctq h ARG 81 CO 0.10 0.15 0.37 -0.92 0.10 0.00 0.00 179.97 179.77 2ctq h TYR 82 N 0.23 0.66 -0.47 4.08 5.03 -0.85 -1.23 116.97 124.42 2ctq h TYR 82 Ca 0.15 0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.38 2ctq h TYR 82 Cb 0.29 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.37 2ctq h TYR 82 CO -0.00 0.23 -0.15 0.22 -1.32 0.00 0.00 178.16 177.15 2ctq h ASP 83 N 0.62 0.89 -0.62 -2.11 1.82 -1.34 -3.02 116.42 112.66 2ctq h ASP 83 Ca 0.36 -0.30 0.08 0.00 -0.39 0.00 0.00 57.03 56.79 2ctq h ASP 83 Cb 0.39 -0.24 -0.07 0.00 0.68 0.00 0.00 39.33 40.10 2ctq h ASP 83 CO -0.28 1.04 0.28 -0.74 -1.61 0.00 0.00 179.24 177.93 2ctq h HIS 84 N 0.79 0.49 -0.41 0.28 2.76 -1.14 -0.75 115.15 117.17 2ctq h HIS 84 Ca 0.12 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.29 2ctq h HIS 84 Cb 0.68 -0.13 -0.02 0.00 1.55 0.00 0.00 27.41 29.49 2ctq h HIS 84 CO 0.04 0.17 0.14 2.35 -1.30 0.00 0.00 177.93 179.33 2ctq h TRP 85 N 0.50 0.60 -0.15 5.26 7.01 -1.31 -1.90 115.95 125.95 2ctq h TRP 85 Ca 0.30 -0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.21 2ctq h TRP 85 Cb 0.32 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.18 2ctq h TRP 85 CO -0.13 0.49 -0.17 0.00 -2.79 0.00 0.00 178.44 175.84 2ctq h ARG 86 N 0.59 0.24 -0.08 2.65 3.08 -1.05 -1.74 114.38 118.08 2ctq h ARG 86 Ca 0.14 -0.06 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 2ctq h ARG 86 Cb 0.17 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.19 2ctq h ARG 86 CO -0.01 0.42 -0.41 0.00 -1.07 0.00 0.00 179.97 178.90 2ctq h ARG 87 N 0.23 0.42 0.00 0.04 3.08 -0.79 -3.05 114.38 114.31 2ctq h ARG 87 Ca 0.04 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.75 2ctq h ARG 87 Cb 0.45 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2ctq h ARG 87 CO 0.03 0.98 0.00 0.43 -1.07 0.00 0.00 179.97 180.34 2ctq n SER 88 N -4.33 0.00 -3.91 7.04 7.64 -0.93 -4.88 113.62 114.24 2ctq n SER 88 Ca -0.08 0.37 -0.28 0.00 1.01 0.00 0.00 58.87 59.89 2ctq n SER 88 Cb 0.55 -0.44 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 2ctq n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ctq n GLN 89 N -1.44 -0.76 -1.11 1.43 1.13 -0.67 -4.80 117.38 111.16 2ctq n GLN 89 Ca 0.05 0.01 -0.35 0.00 -1.94 0.00 0.00 57.00 54.78 2ctq n GLN 89 Cb 0.19 -2.29 0.10 0.00 0.11 0.00 0.00 30.24 28.35 2ctq n GLN 89 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 2ctq n MET 90 N -3.81 0.14 0.04 -1.09 2.81 -1.25 -4.89 117.12 109.07 2ctq n MET 90 Ca -0.19 0.10 -0.01 0.00 -1.81 0.00 0.00 57.70 55.79 2ctq n MET 90 Cb 0.49 -2.04 0.28 0.00 -0.71 0.00 0.00 33.22 31.23 2ctq n MET 90 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2ctq h SER 91 N -0.81 0.39 -2.72 7.83 0.02 -1.98 -3.43 113.55 112.85 2ctq h SER 91 Ca -0.45 -0.11 -0.53 0.00 -0.84 0.00 0.00 61.79 59.86 2ctq h SER 91 Cb 1.32 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 2ctq h SER 91 CO 0.42 0.58 -0.38 0.00 -1.14 0.00 0.00 176.83 176.32 2ctq s MET 92 N -4.65 3.49 0.80 3.45 0.23 -1.26 -5.10 119.30 116.26 2ctq s MET 92 Ca -0.06 -0.44 -0.11 0.00 -1.03 0.00 0.00 55.69 54.05 2ctq s MET 92 Cb 0.15 -2.88 0.07 0.00 -1.53 0.00 0.00 34.83 30.64 2ctq s MET 92 CO 0.77 0.43 1.09 -1.25 -2.03 0.00 0.00 175.02 174.03 2ctq s PRO 93 N -3.35 2.06 0.09 3.16 0.04 -1.26 -4.81 135.00 130.92 2ctq s PRO 93 Ca 0.37 1.10 -0.26 0.00 0.04 0.00 0.00 61.00 62.25 2ctq s PRO 93 Cb -0.11 -1.88 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 2ctq s PRO 93 CO 0.29 -1.76 1.42 0.35 0.04 0.00 0.00 177.00 177.34 2ctq h PHE 94 N -1.21 -1.22 -0.86 0.56 3.04 -1.97 -0.68 116.94 114.59 2ctq h PHE 94 Ca -0.45 0.04 0.33 0.00 3.98 0.00 0.00 57.97 61.87 2ctq h PHE 94 Cb 1.24 0.54 -0.16 0.00 2.56 0.00 0.00 35.95 40.14 2ctq h PHE 94 CO 0.55 -0.43 0.34 0.00 -2.02 0.00 0.00 178.31 176.75 2ctq n GLN 95 N -4.75 -0.06 -0.10 1.11 -0.00 -1.26 0.18 117.38 112.50 2ctq n GLN 95 Ca -0.05 1.21 -0.12 0.00 -0.00 0.00 0.00 57.00 58.04 2ctq n GLN 95 Cb 0.30 -2.10 -0.04 0.00 -0.00 0.00 0.00 30.24 28.39 2ctq n GLN 95 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 2ctq h GLN 96 N 0.00 0.56 -0.03 2.61 5.75 -1.51 -3.29 115.11 119.20 2ctq h GLN 96 Ca 0.67 -0.21 0.02 0.00 -0.15 0.00 0.00 58.65 58.97 2ctq h GLN 96 Cb 1.69 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 30.17 2ctq h GLN 96 CO -0.70 0.76 -0.35 2.35 -2.65 0.00 0.00 178.83 178.23 2ctq h TRP 97 N 0.32 -1.04 -0.74 3.99 7.01 0.27 -2.37 115.95 123.38 2ctq h TRP 97 Ca 0.07 0.04 0.10 0.00 2.11 0.00 0.00 58.89 61.20 2ctq h TRP 97 Cb 0.55 0.46 -0.11 0.00 -2.10 0.00 0.00 29.16 27.96 2ctq h TRP 97 CO 0.05 -0.37 -0.35 0.39 -2.79 0.00 0.00 178.44 175.38 2ctq n GLU 98 N -4.43 -0.23 -0.31 2.65 4.71 -0.98 0.19 120.64 122.23 2ctq n GLU 98 Ca -0.05 1.13 0.18 0.00 -0.01 0.00 0.00 57.16 58.42 2ctq n GLU 98 Cb 0.25 -1.68 0.37 0.00 -1.01 0.00 0.00 31.44 29.37 2ctq n GLU 98 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ctq h ALA 99 N 0.78 1.53 0.44 0.62 0.00 -1.49 1.97 119.26 123.12 2ctq h ALA 99 Ca 0.21 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 2ctq h ALA 99 Cb 0.39 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2ctq h ALA 99 CO -0.72 -0.53 -0.21 -0.07 0.00 0.00 0.00 179.25 177.71 2ctq h LEU 100 N 0.22 -0.50 0.55 0.00 -0.00 0.22 -3.38 115.31 112.41 2ctq h LEU 100 Ca 0.63 0.02 -0.03 0.00 -0.00 0.00 0.00 57.88 58.50 2ctq h LEU 100 Cb 1.36 0.13 0.01 0.00 -0.00 0.00 0.00 40.66 42.16 2ctq h LEU 100 CO -0.67 -0.22 -0.26 -0.55 -0.00 0.00 0.00 178.44 176.74 2ctq h ASN 101 N -0.88 -0.63 -3.04 -0.43 7.08 -0.58 -3.40 115.58 113.70 2ctq h ASN 101 Ca -0.06 0.02 -0.57 0.00 -3.08 0.00 0.00 56.30 52.61 2ctq h ASN 101 Cb 0.46 0.16 -0.04 0.00 -2.08 0.00 0.00 38.32 36.82 2ctq h ASN 101 CO 0.10 -0.36 1.14 -0.62 -2.08 0.00 0.00 177.43 175.61 2ctq s ASP 102 N -3.79 6.21 -0.54 6.14 2.15 0.66 -4.95 116.67 122.55 2ctq s ASP 102 Ca -0.11 1.06 0.04 0.00 0.43 0.00 0.00 52.55 53.97 2ctq s ASP 102 Cb 0.01 -2.53 0.13 0.00 -0.30 0.00 0.00 42.92 40.23 2ctq s ASP 102 CO 0.32 -1.50 0.29 -0.94 -0.17 0.00 0.00 175.17 173.17 2ctq s SER 103 N 4.62 4.36 0.05 -0.34 1.04 -1.26 -4.16 113.70 118.00 2ctq s SER 103 Ca 0.68 -3.11 0.13 0.00 0.48 0.00 0.00 55.95 54.13 2ctq s SER 103 Cb -0.17 -1.63 -0.18 0.00 0.10 0.00 0.00 66.02 64.14 2ctq s SER 103 CO 0.32 -0.21 0.91 1.62 0.98 0.00 0.00 173.24 176.86 2ctq h VAL 104 N 5.36 0.95 -2.47 5.02 3.04 -1.92 -3.49 116.25 122.75 2ctq h VAL 104 Ca -0.05 -2.64 0.16 0.00 -1.01 0.00 0.00 66.70 63.15 2ctq h VAL 104 Cb 0.88 2.42 -0.07 0.00 -2.01 0.00 0.00 31.29 32.50 2ctq h VAL 104 CO 0.69 0.54 0.45 -1.59 -1.01 0.00 0.00 177.57 176.65 2ctq s LYS 105 N -2.73 1.32 -0.39 4.17 -2.85 -1.26 -5.11 119.74 112.89 2ctq s LYS 105 Ca -0.02 -0.74 -0.40 0.00 -1.00 0.00 0.00 55.97 53.80 2ctq s LYS 105 Cb 0.09 0.44 -0.15 0.00 -2.06 0.00 0.00 37.83 36.14 2ctq s LYS 105 CO 0.81 -0.61 2.03 2.41 0.10 0.00 0.00 175.35 180.09 2ctq n THR 106 N -0.49 0.15 -2.64 3.79 -1.04 -1.26 -4.89 114.28 107.90 2ctq n THR 106 Ca -0.06 -0.11 -0.38 0.00 -2.04 0.00 0.00 64.05 61.46 2ctq n THR 106 Cb 0.60 -1.11 -0.05 0.00 -1.82 0.00 0.00 70.33 67.95 2ctq n THR 106 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2ctq s SER 107 N 5.70 7.18 0.00 8.00 0.15 -1.26 -5.03 113.70 128.43 2ctq s SER 107 Ca 1.10 2.00 0.00 0.00 0.70 0.00 0.00 55.95 59.75 2ctq s SER 107 Cb -1.15 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 60.56 2ctq s SER 107 CO 0.61 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.47 2ctq n GLY 108 N 0.73 1.74 3.56 9.45 0.00 -1.26 -5.09 105.19 114.32 2ctq n GLY 108 Ca 0.02 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 2ctq n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ctq s PRO 109 N -1.64 2.58 0.23 1.61 0.04 -1.26 -4.83 135.00 131.73 2ctq s PRO 109 Ca 0.00 -0.05 -0.06 0.00 0.04 0.00 0.00 61.00 60.93 2ctq s PRO 109 Cb 0.00 -4.88 0.36 0.00 0.04 0.00 0.00 34.50 30.02 2ctq s PRO 109 CO 0.00 -3.20 1.80 0.77 0.04 0.00 0.00 177.00 176.41 2ctq h SER 110 N 12.27 0.57 0.20 6.66 0.02 -2.00 -2.67 113.55 128.60 2ctq h SER 110 Ca 0.00 0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2ctq h SER 110 Cb 1.05 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.49 2ctq h SER 110 CO 1.21 0.33 -0.46 0.28 -1.14 0.00 0.00 176.83 177.05 2ctq h SER 111 N 0.70 -1.35 0.00 3.07 0.02 -2.08 -3.57 113.55 110.34 2ctq h SER 111 Ca 0.37 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 2ctq h SER 111 Cb 0.36 0.49 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2ctq h SER 111 CO -0.25 -0.54 0.00 0.61 -1.14 0.00 0.00 176.83 175.51