#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 -0.13 0.02 1.61 1.04 -1.26 -5.18 113.70 109.80 2ctq s SER 2 Ca 0.00 -0.15 0.04 0.00 0.48 0.00 0.00 55.95 56.32 2ctq s SER 2 Cb 0.00 0.25 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 2ctq s SER 2 CO 0.00 -0.44 -0.11 -0.94 0.98 0.00 0.00 173.24 172.73 2ctq s SER 3 N -2.75 1.29 0.00 7.02 1.04 -1.26 -5.14 113.70 113.91 2ctq s SER 3 Ca 0.12 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2ctq s SER 3 Cb 0.02 -0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.04 2ctq s SER 3 CO -0.03 0.04 0.00 0.61 0.98 0.00 0.00 173.24 174.84 2ctq n GLY 4 N 2.29 1.10 3.59 7.32 0.00 -1.26 -5.12 105.19 113.10 2ctq n GLY 4 Ca -0.16 -0.01 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 2ctq n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ctq s SER 5 N -1.02 -0.19 0.48 1.61 0.15 -1.26 -5.17 113.70 108.30 2ctq s SER 5 Ca 0.00 0.09 -0.18 0.00 0.70 0.00 0.00 55.95 56.56 2ctq s SER 5 Cb 0.00 0.19 -0.09 0.00 -1.71 0.00 0.00 66.02 64.41 2ctq s SER 5 CO 0.00 -0.27 0.96 -0.55 1.20 0.00 0.00 173.24 174.58 2ctq s SER 6 N -1.80 6.73 0.00 5.45 0.15 -1.26 -5.07 113.70 117.90 2ctq s SER 6 Ca 0.07 1.59 0.00 0.00 0.70 0.00 0.00 55.95 58.31 2ctq s SER 6 Cb -0.01 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2ctq s SER 6 CO -0.05 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.51 2ctq n GLY 7 N -1.22 0.95 3.86 9.45 0.00 -1.26 -5.02 105.19 111.95 2ctq n GLY 7 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 2ctq n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ctq s MET 8 N 0.32 3.77 0.15 1.61 -2.45 -1.26 -5.08 119.30 116.35 2ctq s MET 8 Ca 0.00 0.74 -0.24 0.00 -1.25 0.00 0.00 55.69 54.94 2ctq s MET 8 Cb 0.00 -2.18 0.06 0.00 1.25 0.00 0.00 34.83 33.97 2ctq s MET 8 CO 0.00 -0.33 0.74 0.34 1.05 0.00 0.00 175.02 176.82 2ctq s ASP 9 N -3.56 -0.40 -1.47 1.11 2.15 -1.26 -4.96 116.67 108.29 2ctq s ASP 9 Ca 0.55 -0.20 -0.07 0.00 0.43 0.00 0.00 52.55 53.26 2ctq s ASP 9 Cb -0.10 0.57 0.03 0.00 -0.30 0.00 0.00 42.92 43.11 2ctq s ASP 9 CO 0.40 -0.97 0.73 0.00 -0.17 0.00 0.00 175.17 175.16 2ctq n ALA 10 N -0.38 -1.09 -2.56 3.66 0.00 -1.26 -4.91 120.51 113.97 2ctq n ALA 10 Ca -0.11 0.26 -0.43 0.00 0.00 0.00 0.00 53.44 53.17 2ctq n ALA 10 Cb 0.62 -4.07 -0.02 0.00 0.00 0.00 0.00 19.45 15.99 2ctq n ALA 10 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2ctq s ILE 11 N -3.17 4.26 -0.06 0.00 1.01 -1.26 -5.00 121.20 116.98 2ctq s ILE 11 Ca 0.41 1.38 -0.02 0.00 0.00 0.00 0.00 60.65 62.41 2ctq s ILE 11 Cb -0.19 -4.43 0.04 0.00 0.01 0.00 0.00 42.46 37.88 2ctq s ILE 11 CO 0.51 -0.73 0.12 -0.76 0.00 0.00 0.00 174.94 174.08 2ctq s LEU 12 N 4.28 0.44 -0.55 2.97 1.43 -1.26 -5.07 118.68 120.92 2ctq s LEU 12 Ca 0.50 0.24 0.07 0.00 -1.03 0.00 0.00 54.13 53.91 2ctq s LEU 12 Cb -0.11 0.20 0.30 0.00 0.03 0.00 0.00 46.19 46.61 2ctq s LEU 12 CO 0.25 -0.19 0.80 -0.46 0.23 0.00 0.00 176.35 176.98 2ctq n ASN 13 N 4.72 3.20 -1.10 2.29 0.23 -1.26 -4.82 115.26 118.51 2ctq n ASN 13 Ca -0.16 -3.39 0.11 0.00 -0.53 0.00 0.00 54.58 50.61 2ctq n ASN 13 Cb 0.51 -0.61 0.26 0.00 -2.08 0.00 0.00 39.78 37.85 2ctq n ASN 13 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ctq n TYR 14 N 0.39 0.58 -2.49 -2.53 0.18 -1.26 -4.72 117.16 107.31 2ctq n TYR 14 Ca 0.29 -0.29 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 2ctq n TYR 14 Cb 0.45 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.41 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 1.33 3.32 0.00 -3.48 0.00 -1.26 -4.58 116.66 111.98 2ctq n ARG 15 Ca 0.20 -3.43 0.00 0.00 -0.00 0.00 0.00 57.85 54.62 2ctq n ARG 15 Cb 0.56 -3.15 0.00 0.00 0.00 0.00 0.00 32.46 29.87 2ctq n ARG 15 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2ctq n SER 16 N 5.78 0.00 -4.32 6.15 2.88 -1.26 -5.13 113.62 117.72 2ctq n SER 16 Ca 0.43 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.80 2ctq n SER 16 Cb 0.41 -0.11 -0.10 0.00 -0.75 0.00 0.00 64.21 63.65 2ctq n SER 16 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2ctq s GLU 17 N -0.91 1.41 -0.21 -1.46 2.02 -1.26 -5.15 118.70 113.15 2ctq s GLU 17 Ca 0.00 -1.76 -0.06 0.00 0.02 0.00 0.00 54.97 53.16 2ctq s GLU 17 Cb 0.00 -0.31 -0.03 0.00 0.10 0.00 0.00 34.13 33.89 2ctq s GLU 17 CO 0.00 -0.28 0.04 0.34 0.02 0.00 0.00 175.26 175.38 2ctq s ASP 18 N -3.32 5.15 0.00 -0.19 2.15 -1.26 -5.10 116.67 114.11 2ctq s ASP 18 Ca 0.37 -0.11 0.04 0.00 0.43 0.00 0.00 52.55 53.28 2ctq s ASP 18 Cb 0.08 -1.89 -0.01 0.00 -0.30 0.00 0.00 42.92 40.79 2ctq s ASP 18 CO 0.13 0.08 -0.14 -0.89 -0.17 0.00 0.00 175.17 174.18 2ctq s THR 19 N 0.95 1.12 -0.43 1.71 2.01 -1.26 -5.11 115.64 114.63 2ctq s THR 19 Ca 0.03 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.33 2ctq s THR 19 Cb -0.14 -0.95 0.12 0.00 0.01 0.00 0.00 72.50 71.54 2ctq s THR 19 CO 0.02 0.24 0.19 -1.83 -0.69 0.00 0.00 174.62 172.56 2ctq s GLU 20 N -0.52 1.91 0.02 4.92 -1.05 -1.26 -5.05 118.70 117.67 2ctq s GLU 20 Ca 0.05 -2.03 0.03 0.00 -0.15 0.00 0.00 54.97 52.86 2ctq s GLU 20 Cb -0.06 -3.45 -0.01 0.00 -0.44 0.00 0.00 34.13 30.16 2ctq s GLU 20 CO -0.00 -1.05 -0.09 -0.51 0.95 0.00 0.00 175.26 174.56 2ctq s ASP 21 N 1.12 1.10 0.18 0.83 1.01 -1.26 -5.05 116.67 114.61 2ctq s ASP 21 Ca 0.11 -0.32 -0.13 0.00 0.71 0.00 0.00 52.55 52.93 2ctq s ASP 21 Cb -0.22 -0.07 0.15 0.00 1.01 0.00 0.00 42.92 43.79 2ctq s ASP 21 CO -0.05 0.01 1.78 1.88 0.21 0.00 0.00 175.17 179.00 2ctq h TYR 22 N 5.33 0.47 -0.05 4.23 -1.99 -1.99 -0.57 116.97 122.41 2ctq h TYR 22 Ca -0.33 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.43 2ctq h TYR 22 Cb 1.19 -0.14 -0.00 0.00 2.00 0.00 0.00 36.73 39.78 2ctq h TYR 22 CO 0.50 0.22 0.04 1.88 -0.00 0.00 0.00 178.16 180.80 2ctq h TYR 23 N 0.50 0.00 -0.15 4.88 0.05 -1.96 -2.07 116.97 118.22 2ctq h TYR 23 Ca 0.23 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.88 2ctq h TYR 23 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.90 2ctq h TYR 23 CO -0.11 0.00 -0.42 1.15 -1.05 0.00 0.00 178.16 177.73 2ctq h THR 24 N 0.00 1.35 -0.68 -2.88 2.02 -1.38 0.74 112.91 112.08 2ctq h THR 24 Ca 0.02 -1.70 0.13 0.00 0.77 0.00 0.00 66.41 65.64 2ctq h THR 24 Cb 0.10 2.03 -0.13 0.00 -1.74 0.00 0.00 68.15 68.41 2ctq h THR 24 CO -0.00 0.52 -0.22 -0.07 0.37 0.00 0.00 175.52 176.12 2ctq h LEU 25 N 0.18 -0.79 -2.39 2.58 3.38 -0.90 0.35 115.31 117.71 2ctq h LEU 25 Ca -0.01 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2ctq h LEU 25 Cb 1.04 0.48 0.00 0.00 0.09 0.00 0.00 40.66 42.27 2ctq h LEU 25 CO 0.09 -0.25 0.00 0.18 0.09 0.00 0.00 178.44 178.55 2ctq n LEU 26 N -5.47 3.50 -4.30 1.67 4.77 -1.22 -4.94 117.00 111.00 2ctq n LEU 26 Ca 0.08 -1.70 -0.35 0.00 -0.03 0.00 0.00 56.01 54.01 2ctq n LEU 26 Cb 0.36 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2ctq n LEU 26 CO 0.01 0.85 -0.23 0.61 -1.33 0.00 0.00 177.39 177.29 2ctq n GLY 27 N 1.54 -0.30 3.75 -0.72 0.00 0.12 -4.77 105.19 104.81 2ctq n GLY 27 Ca 0.22 0.13 -0.33 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.86 0.15 0.43 0.00 1.11 -1.26 -4.65 116.67 108.59 2ctq s ASP 29 Ca 0.06 -0.91 0.25 0.00 0.18 0.00 0.00 52.55 52.12 2ctq s ASP 29 Cb 0.01 0.37 1.27 0.00 1.07 0.00 0.00 42.92 45.63 2ctq s ASP 29 CO 0.03 -0.80 1.72 1.05 1.18 0.00 0.00 175.17 178.35 2ctq h GLU 30 N 2.71 0.23 -0.40 8.23 4.11 -2.02 0.88 114.58 128.33 2ctq h GLU 30 Ca -0.33 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.06 2ctq h GLU 30 Cb 1.21 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 2ctq h GLU 30 CO 0.54 0.15 0.16 -0.07 0.07 0.00 0.00 179.01 179.86 2ctq h LEU 31 N 0.24 0.51 -9.80 3.06 3.38 -2.05 -3.42 115.31 107.22 2ctq h LEU 31 Ca 0.68 -0.05 -0.52 0.00 0.09 0.00 0.00 57.88 58.08 2ctq h LEU 31 Cb 1.99 -0.13 0.04 0.00 0.09 0.00 0.00 40.66 42.65 2ctq h LEU 31 CO -0.32 0.47 0.59 -0.44 0.09 0.00 0.00 178.44 178.83 2ctq s SER 32 N -6.69 6.96 0.41 -0.43 0.01 0.31 -5.03 113.70 109.24 2ctq s SER 32 Ca -0.08 2.48 -0.02 0.00 1.31 0.00 0.00 55.95 59.63 2ctq s SER 32 Cb 0.16 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 2ctq s SER 32 CO 0.75 -0.42 0.66 -0.44 0.41 0.00 0.00 173.24 174.21 2ctq s SER 33 N -0.35 6.29 0.54 2.44 0.01 -1.26 -4.81 113.70 116.56 2ctq s SER 33 Ca 0.50 0.69 0.32 0.00 1.31 0.00 0.00 55.95 58.77 2ctq s SER 33 Cb -0.36 -2.14 1.48 0.00 0.21 0.00 0.00 66.02 65.21 2ctq s SER 33 CO 0.45 -0.43 1.88 1.62 0.41 0.00 0.00 173.24 177.17 2ctq h VAL 34 N 0.52 0.52 -0.11 3.43 3.04 -1.95 0.55 116.25 122.24 2ctq h VAL 34 Ca -0.48 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.19 2ctq h VAL 34 Cb 1.21 0.54 -0.00 0.00 -2.01 0.00 0.00 31.29 31.03 2ctq h VAL 34 CO 0.62 0.00 -0.01 -0.33 -1.01 0.00 0.00 177.57 176.84 2ctq h GLU 35 N 0.00 0.21 -0.11 4.17 4.39 -1.99 -2.32 114.58 118.93 2ctq h GLU 35 Ca 0.42 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 60.02 2ctq h GLU 35 Cb 1.73 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.36 2ctq h GLU 35 CO -0.00 0.48 -0.06 1.96 -1.16 0.00 0.00 179.01 180.22 2ctq h GLN 36 N -0.08 0.23 -0.93 2.33 4.20 -1.34 -3.13 115.11 116.38 2ctq h GLN 36 Ca 0.03 -0.10 0.17 0.00 0.06 0.00 0.00 58.65 58.81 2ctq h GLN 36 Cb 0.39 -0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.06 2ctq h GLN 36 CO 0.01 0.59 0.52 0.82 -0.67 0.00 0.00 178.83 180.10 2ctq h ILE 37 N -0.14 0.71 -0.78 2.54 2.04 -1.15 -0.11 117.51 120.63 2ctq h ILE 37 Ca 0.02 -0.24 0.06 0.00 1.00 0.00 0.00 64.86 65.71 2ctq h ILE 37 Cb 0.53 -0.04 -0.06 0.00 -0.74 0.00 0.00 36.82 36.51 2ctq h ILE 37 CO 0.02 0.13 0.46 -0.07 0.00 0.00 0.00 178.15 178.68 2ctq h LEU 38 N 0.69 0.70 0.40 1.44 3.38 -1.36 -1.62 115.31 118.94 2ctq h LEU 38 Ca 0.52 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.50 2ctq h LEU 38 Cb 0.78 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2ctq h LEU 38 CO -0.38 0.44 -0.34 0.00 0.09 0.00 0.00 178.44 178.26 2ctq h ALA 39 N 1.39 -1.06 -0.99 1.53 0.00 -1.00 0.14 119.26 119.26 2ctq h ALA 39 Ca 0.35 -0.14 0.22 0.00 0.00 0.00 0.00 54.91 55.34 2ctq h ALA 39 Cb 0.20 0.54 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 2ctq h ALA 39 CO -0.19 -1.07 0.62 0.93 0.00 0.00 0.00 179.25 179.55 2ctq h GLU 40 N -0.72 0.54 0.15 0.00 5.08 -1.38 -1.06 114.58 117.19 2ctq h GLU 40 Ca -0.05 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2ctq h GLU 40 Cb 0.61 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2ctq h GLU 40 CO -0.01 0.36 -0.07 0.35 -1.00 0.00 0.00 179.01 178.64 2ctq h PHE 41 N 0.56 -0.19 -0.18 4.33 3.57 -0.81 0.37 116.94 124.59 2ctq h PHE 41 Ca 0.56 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 62.11 2ctq h PHE 41 Cb 1.17 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.91 2ctq h PHE 41 CO -0.00 0.09 -0.25 0.87 -2.23 0.00 0.00 178.31 176.79 2ctq h LYS 42 N -0.46 -0.28 0.25 1.11 1.57 0.50 0.18 116.57 119.44 2ctq h LYS 42 Ca -0.02 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2ctq h LYS 42 Cb 0.36 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2ctq h LYS 42 CO 0.03 -0.19 -0.12 -0.39 -0.57 0.00 0.00 179.45 178.22 2ctq h VAL 43 N -0.29 0.81 -0.74 0.50 -1.51 -1.34 -0.37 116.25 113.31 2ctq h VAL 43 Ca 0.11 -0.58 0.17 0.00 -1.23 0.00 0.00 66.70 65.18 2ctq h VAL 43 Cb 0.46 1.13 -0.12 0.00 -2.13 0.00 0.00 31.29 30.63 2ctq h VAL 43 CO -0.34 0.12 0.09 0.03 -1.23 0.00 0.00 177.57 176.24 2ctq h ARG 44 N -0.64 0.17 0.00 5.19 3.08 -0.05 0.42 114.38 122.56 2ctq h ARG 44 Ca -0.03 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 2ctq h ARG 44 Cb 0.45 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 2ctq h ARG 44 CO 0.06 0.11 -0.55 0.00 -1.07 0.00 0.00 179.97 178.52 2ctq h ALA 45 N 1.66 0.98 0.46 0.04 0.00 -0.62 -2.75 119.26 119.03 2ctq h ALA 45 Ca 0.42 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2ctq h ALA 45 Cb 0.73 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2ctq h ALA 45 CO -0.59 0.68 -0.22 -0.07 0.00 0.00 0.00 179.25 179.05 2ctq h LEU 46 N 0.00 -0.53 -2.60 0.00 3.38 0.15 0.76 115.31 116.47 2ctq h LEU 46 Ca -0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2ctq h LEU 46 Cb 1.04 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2ctq h LEU 46 CO 0.07 -0.18 0.13 1.05 0.09 0.00 0.00 178.44 179.60 2ctq h GLU 47 N -1.02 0.00 -0.59 1.13 4.11 -0.81 -0.80 114.58 116.60 2ctq h GLU 47 Ca -0.06 0.00 -0.43 0.00 0.07 0.00 0.00 59.36 58.94 2ctq h GLU 47 Cb 0.48 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 29.38 2ctq h GLU 47 CO 0.10 0.00 -0.78 0.00 0.07 0.00 0.00 179.01 178.40 2ctq s HIS 49 N -3.50 3.94 0.19 0.00 2.46 0.25 -4.51 115.29 114.13 2ctq s HIS 49 Ca 0.47 1.88 -0.05 0.00 0.47 0.00 0.00 55.06 57.83 2ctq s HIS 49 Cb 0.40 -2.96 0.11 0.00 -0.13 0.00 0.00 32.58 30.00 2ctq s HIS 49 CO 0.01 0.43 1.54 -1.00 -2.47 0.00 0.00 174.74 173.25 2ctq h PRO 50 N 4.01 0.70 -0.49 2.88 0.13 -1.84 -3.07 132.00 134.32 2ctq h PRO 50 Ca -0.45 -0.37 0.04 0.00 -0.87 0.00 0.00 66.00 64.35 2ctq h PRO 50 Cb 1.20 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 2ctq h PRO 50 CO 0.67 0.99 0.25 0.22 -0.23 0.00 0.00 178.00 179.90 2ctq h ASP 51 N 0.57 0.35 -0.51 1.44 3.58 -1.96 -2.40 116.42 117.49 2ctq h ASP 51 Ca 0.04 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.52 2ctq h ASP 51 Cb 0.96 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.94 2ctq h ASP 51 CO 0.09 0.24 0.31 0.11 -2.88 0.00 0.00 179.24 177.11 2ctq h LYS 52 N 0.48 0.69 -3.34 0.28 1.79 -1.93 -3.31 116.57 111.23 2ctq h LYS 52 Ca 0.22 -0.06 -0.70 0.00 -2.18 0.00 0.00 60.65 57.93 2ctq h LYS 52 Cb 0.13 -0.15 -0.36 0.00 -1.58 0.00 0.00 32.23 30.27 2ctq h LYS 52 CO -0.15 0.50 -0.16 -1.01 -1.08 0.00 0.00 179.45 177.54 2ctq s HIS 53 N -6.01 3.81 1.02 -1.35 3.76 -0.92 -5.08 115.29 110.52 2ctq s HIS 53 Ca -0.13 -3.00 -0.13 0.00 -0.15 0.00 0.00 55.06 51.65 2ctq s HIS 53 Cb 0.12 -3.21 0.20 0.00 1.11 0.00 0.00 32.58 30.80 2ctq s HIS 53 CO 0.75 -0.74 1.09 -1.25 -0.85 0.00 0.00 174.74 173.74 2ctq s PRO 54 N -1.16 0.22 -1.83 8.40 0.04 -1.10 -3.77 135.00 135.79 2ctq s PRO 54 Ca 0.26 0.45 0.00 0.00 0.04 0.00 0.00 61.00 61.75 2ctq s PRO 54 Cb -0.09 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.73 2ctq s PRO 54 CO -0.11 -2.86 0.00 0.39 0.04 0.00 0.00 177.00 174.46 2ctq n GLU 55 N -4.25 -1.65 -3.52 4.56 4.71 -1.26 -4.94 120.64 114.28 2ctq n GLU 55 Ca 0.05 1.03 -0.24 0.00 -0.01 0.00 0.00 57.16 58.00 2ctq n GLU 55 Cb 0.58 -5.58 -0.14 0.00 -1.01 0.00 0.00 31.44 25.28 2ctq n GLU 55 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 2ctq s ASN 56 N -2.27 2.40 0.13 1.62 2.47 -1.25 -5.02 114.94 113.02 2ctq s ASN 56 Ca 0.00 -0.77 -0.12 0.00 0.42 0.00 0.00 52.86 52.39 2ctq s ASN 56 Cb 0.00 -0.00 -0.05 0.00 -1.45 0.00 0.00 41.25 39.75 2ctq s ASN 56 CO 0.00 -0.38 1.46 1.55 -3.72 0.00 0.00 177.10 176.01 2ctq h PRO 57 N 8.36 0.89 -1.00 0.43 0.13 -1.92 -3.20 132.00 135.69 2ctq h PRO 57 Ca -0.17 -0.46 0.37 0.00 -0.87 0.00 0.00 66.00 64.87 2ctq h PRO 57 Cb 1.09 0.02 -0.18 0.00 0.13 0.00 0.00 31.00 32.06 2ctq h PRO 57 CO 0.35 1.11 0.38 0.87 -0.23 0.00 0.00 178.00 180.48 2ctq h LYS 58 N 0.69 0.02 0.64 0.86 1.57 -1.97 0.23 116.57 118.60 2ctq h LYS 58 Ca 0.06 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2ctq h LYS 58 Cb 0.95 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.26 2ctq h LYS 58 CO 0.09 0.01 -0.31 0.00 -0.57 0.00 0.00 179.45 178.68 2ctq h ALA 59 N 1.99 -0.85 -1.05 3.86 0.00 -1.90 -2.63 119.26 118.68 2ctq h ALA 59 Ca 0.77 -0.19 0.31 0.00 0.00 0.00 0.00 54.91 55.79 2ctq h ALA 59 Cb 1.90 0.33 -0.13 0.00 0.00 0.00 0.00 17.79 19.89 2ctq h ALA 59 CO -0.81 -0.96 0.63 0.28 0.00 0.00 0.00 179.25 178.39 2ctq h VAL 60 N -0.90 0.36 -0.67 0.00 2.07 -0.70 0.52 116.25 116.94 2ctq h VAL 60 Ca -0.09 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.24 2ctq h VAL 60 Cb 0.67 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 2ctq h VAL 60 CO 0.14 0.07 0.15 -0.33 0.02 0.00 0.00 177.57 177.62 2ctq h GLU 61 N 0.36 1.08 0.00 1.57 4.39 -1.12 0.20 114.58 121.06 2ctq h GLU 61 Ca 0.70 -0.27 -0.04 0.00 0.34 0.00 0.00 59.36 60.09 2ctq h GLU 61 Cb 1.67 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 30.18 2ctq h GLU 61 CO -0.50 0.97 -0.21 1.15 -1.16 0.00 0.00 179.01 179.26 2ctq h THR 62 N 1.00 0.61 0.05 1.13 2.02 0.33 -2.42 112.91 115.64 2ctq h THR 62 Ca 0.21 -0.98 -0.30 0.00 0.77 0.00 0.00 66.41 66.11 2ctq h THR 62 Cb 0.38 1.64 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 2ctq h THR 62 CO 0.00 0.21 -1.68 0.15 0.37 0.00 0.00 175.52 174.58 2ctq h PHE 63 N 0.00 0.20 -0.12 3.16 3.57 -0.73 -3.10 116.94 119.92 2ctq h PHE 63 Ca -0.00 -0.15 -0.10 0.00 3.53 0.00 0.00 57.97 61.25 2ctq h PHE 63 Cb 0.63 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2ctq h PHE 63 CO 0.00 1.25 -0.38 1.96 -2.23 0.00 0.00 178.31 178.91 2ctq h GLN 64 N 0.03 0.26 0.04 1.11 1.08 -0.46 -2.37 115.11 114.80 2ctq h GLN 64 Ca -0.28 -0.12 -0.23 0.00 -1.45 0.00 0.00 58.65 56.57 2ctq h GLN 64 Cb 2.00 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 29.40 2ctq h GLN 64 CO 0.10 0.61 -1.10 1.57 -0.95 0.00 0.00 178.83 179.06 2ctq h LYS 65 N 0.22 0.09 -0.45 1.46 2.10 -1.57 -3.18 116.57 115.24 2ctq h LYS 65 Ca 0.02 -0.15 -0.10 0.00 -2.00 0.00 0.00 60.65 58.42 2ctq h LYS 65 Cb 0.78 0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.15 2ctq h LYS 65 CO 0.06 1.06 -0.09 -0.07 -2.00 0.00 0.00 179.45 178.41 2ctq h LEU 66 N 0.02 0.87 -1.41 7.07 3.38 -1.44 -2.80 115.31 121.01 2ctq h LEU 66 Ca -0.06 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.49 2ctq h LEU 66 Cb 1.84 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.35 2ctq h LEU 66 CO 0.15 1.02 -0.29 0.06 0.09 0.00 0.00 178.44 179.47 2ctq h GLN 67 N 0.70 0.00 0.00 1.13 3.07 -1.52 -2.78 115.11 115.72 2ctq h GLN 67 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.86 2ctq h GLN 67 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.19 2ctq h GLN 67 CO 0.04 0.29 0.00 1.63 0.09 0.00 0.00 178.83 180.89 2ctq n LYS 68 N -4.16 0.00 -0.42 0.06 4.76 -1.08 -2.31 118.16 115.02 2ctq n LYS 68 Ca -0.02 0.26 0.36 0.00 -2.87 0.00 0.00 58.31 56.04 2ctq n LYS 68 Cb 0.34 -1.09 0.64 0.00 -1.84 0.00 0.00 35.03 33.08 2ctq n LYS 68 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ctq h ALA 69 N -2.00 2.57 0.71 7.82 0.00 -1.60 0.26 119.26 127.02 2ctq h ALA 69 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2ctq h ALA 69 Cb 0.00 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2ctq h ALA 69 CO 0.00 -1.28 -0.40 -0.22 0.00 0.00 0.00 179.25 177.36 2ctq h LYS 70 N 0.04 -0.99 -0.20 0.00 3.64 -1.52 0.15 116.57 117.69 2ctq h LYS 70 Ca 0.85 0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 60.28 2ctq h LYS 70 Cb 2.54 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 34.58 2ctq h LYS 70 CO -0.55 -0.66 0.06 1.49 -2.27 0.00 0.00 179.45 177.52 2ctq h GLU 71 N -1.03 0.31 -0.86 1.90 4.22 -0.19 0.42 114.58 119.35 2ctq h GLU 71 Ca -0.09 -0.07 0.11 0.00 0.08 0.00 0.00 59.36 59.39 2ctq h GLU 71 Cb 0.81 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.94 2ctq h GLU 71 CO 0.12 0.41 0.49 0.82 -2.18 0.00 0.00 179.01 178.67 2ctq h ILE 72 N 0.15 0.88 0.05 2.32 1.08 -0.80 -1.89 117.51 119.30 2ctq h ILE 72 Ca 0.06 -0.27 -0.00 0.00 -0.39 0.00 0.00 64.86 64.26 2ctq h ILE 72 Cb 0.22 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 33.99 2ctq h ILE 72 CO -0.00 0.15 -0.02 -0.07 -0.69 0.00 0.00 178.15 177.51 2ctq h LEU 73 N 0.80 -0.05 -0.72 1.44 3.38 -0.52 0.44 115.31 120.08 2ctq h LEU 73 Ca 0.43 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.62 2ctq h LEU 73 Cb 0.43 0.01 -0.13 0.00 0.09 0.00 0.00 40.66 41.06 2ctq h LEU 73 CO -0.27 0.27 0.12 0.35 0.09 0.00 0.00 178.44 179.00 2ctq n THR 74 N -3.87 -0.30 -2.75 0.22 -2.24 0.14 -4.02 114.28 101.47 2ctq n THR 74 Ca -0.01 1.54 -0.42 0.00 -2.27 0.00 0.00 64.05 62.90 2ctq n THR 74 Cb 0.02 -2.32 -0.03 0.00 -2.10 0.00 0.00 70.33 65.90 2ctq n THR 74 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2ctq s ASN 75 N -4.91 7.24 0.16 3.42 3.84 -0.71 -4.92 114.94 119.05 2ctq s ASN 75 Ca -0.09 1.51 -0.13 0.00 0.21 0.00 0.00 52.86 54.37 2ctq s ASN 75 Cb 0.22 -2.54 0.04 0.00 -0.55 0.00 0.00 41.25 38.42 2ctq s ASN 75 CO 0.56 -0.34 1.67 -0.33 -2.79 0.00 0.00 177.10 175.87 2ctq h GLU 76 N 6.98 0.84 -0.07 0.43 5.08 -1.85 -0.39 114.58 125.59 2ctq h GLU 76 Ca -0.36 -0.20 0.02 0.00 -1.00 0.00 0.00 59.36 57.83 2ctq h GLU 76 Cb 1.18 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2ctq h GLU 76 CO 0.80 0.80 -0.05 1.05 -1.00 0.00 0.00 179.01 180.61 2ctq h GLU 77 N 0.74 -0.06 0.37 2.33 4.11 -1.91 0.17 114.58 120.32 2ctq h GLU 77 Ca 0.17 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.58 2ctq h GLU 77 Cb 0.33 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2ctq h GLU 77 CO 0.00 -0.04 -0.18 0.77 0.07 0.00 0.00 179.01 179.63 2ctq h SER 78 N -0.06 -0.42 -0.10 3.06 0.02 -1.72 -2.36 113.55 111.97 2ctq h SER 78 Ca 0.05 -0.11 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2ctq h SER 78 Cb 0.13 0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.72 2ctq h SER 78 CO -0.11 -0.12 -0.33 -0.09 -1.14 0.00 0.00 176.83 175.04 2ctq h ARG 79 N -0.73 -0.41 -0.40 3.45 2.43 0.17 -0.06 114.38 118.83 2ctq h ARG 79 Ca -0.05 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 2ctq h ARG 79 Cb 0.50 0.09 -0.09 0.00 -0.42 0.00 0.00 29.97 30.05 2ctq h ARG 79 CO 0.08 -0.27 -0.26 0.00 -1.51 0.00 0.00 179.97 178.01 2ctq h ALA 80 N 0.36 -0.03 -0.25 2.80 0.00 -0.69 0.14 119.26 121.59 2ctq h ALA 80 Ca 0.09 0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.17 2ctq h ALA 80 Cb 0.56 0.59 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2ctq h ALA 80 CO -0.34 -0.64 -0.01 0.00 0.00 0.00 0.00 179.25 178.25 2ctq h ARG 81 N -0.19 0.06 -0.01 0.00 2.47 -0.86 -2.49 114.38 113.36 2ctq h ARG 81 Ca 0.19 -0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.93 2ctq h ARG 81 Cb 0.49 -0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.77 2ctq h ARG 81 CO -0.52 0.04 -0.13 -0.92 0.56 0.00 0.00 179.97 179.00 2ctq h TYR 82 N 0.06 -0.33 -1.02 3.04 3.20 -0.01 -1.79 116.97 120.11 2ctq h TYR 82 Ca 0.12 0.01 0.27 0.00 3.14 0.00 0.00 58.73 62.27 2ctq h TYR 82 Cb 0.16 0.15 -0.12 0.00 1.54 0.00 0.00 36.73 38.45 2ctq h TYR 82 CO -0.21 -0.19 0.61 -0.44 -1.64 0.00 0.00 178.16 176.29 2ctq h ASP 83 N -0.21 0.60 0.62 -2.11 3.32 -0.44 0.86 116.42 119.05 2ctq h ASP 83 Ca 0.05 0.14 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 2ctq h ASP 83 Cb 0.27 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 2ctq h ASP 83 CO -0.13 0.06 -0.46 -0.74 -1.72 0.00 0.00 179.24 176.24 2ctq h HIS 84 N 0.50 0.00 0.16 4.55 -0.00 -0.91 -2.84 115.15 116.61 2ctq h HIS 84 Ca 0.66 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 61.02 2ctq h HIS 84 Cb 1.38 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.80 2ctq h HIS 84 CO -0.01 0.46 -0.07 2.35 -0.00 0.00 0.00 177.93 180.66 2ctq h TRP 85 N 0.00 -0.19 -1.04 5.26 7.01 0.12 -3.25 115.95 123.85 2ctq h TRP 85 Ca -0.00 -0.00 0.29 0.00 2.11 0.00 0.00 58.89 61.28 2ctq h TRP 85 Cb 0.89 0.06 -0.06 0.00 -2.10 0.00 0.00 29.16 27.96 2ctq h TRP 85 CO 0.00 -0.03 0.73 0.07 -2.79 0.00 0.00 178.44 176.42 2ctq h ARG 86 N -1.04 0.12 -0.70 2.65 0.11 -1.03 0.39 114.38 114.87 2ctq h ARG 86 Ca -0.02 -0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.01 2ctq h ARG 86 Cb 0.25 -0.03 -0.03 0.00 1.11 0.00 0.00 29.97 31.27 2ctq h ARG 86 CO 0.04 0.08 0.28 0.00 0.10 0.00 0.00 179.97 180.46 2ctq h ARG 87 N 0.12 1.04 0.00 0.08 3.08 -1.57 -2.18 114.38 114.95 2ctq h ARG 87 Ca 0.52 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2ctq h ARG 87 Cb 1.84 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.71 2ctq h ARG 87 CO -0.09 0.85 -0.13 0.77 -1.07 0.00 0.00 179.97 180.30 2ctq h SER 88 N 1.02 0.00 -6.37 7.04 0.02 -0.31 -3.48 113.55 111.47 2ctq h SER 88 Ca 0.24 -0.01 -0.47 0.00 -0.84 0.00 0.00 61.79 60.71 2ctq h SER 88 Cb 0.20 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2ctq h SER 88 CO -0.02 0.00 -0.89 0.00 -1.14 0.00 0.00 176.83 174.79 2ctq n GLN 89 N -2.84 -3.17 -1.17 3.45 6.02 -0.63 -4.89 117.38 114.15 2ctq n GLN 89 Ca 0.04 0.45 -0.34 0.00 -0.01 0.00 0.00 57.00 57.14 2ctq n GLN 89 Cb 0.51 -4.56 0.11 0.00 1.02 0.00 0.00 30.24 27.32 2ctq n GLN 89 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2ctq n MET 90 N -4.34 0.25 -0.31 -1.09 2.81 -1.26 -4.89 117.12 108.29 2ctq n MET 90 Ca -0.27 0.15 0.02 0.00 -1.81 0.00 0.00 57.70 55.79 2ctq n MET 90 Cb 0.67 -2.22 0.20 0.00 -0.71 0.00 0.00 33.22 31.16 2ctq n MET 90 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2ctq h SER 91 N -0.69 0.97 -3.24 7.83 4.64 -2.00 -3.42 113.55 117.63 2ctq h SER 91 Ca -0.46 -0.01 -0.51 0.00 -0.47 0.00 0.00 61.79 60.34 2ctq h SER 91 Cb 1.32 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2ctq h SER 91 CO 0.44 0.66 -0.11 0.00 -0.87 0.00 0.00 176.83 176.96 2ctq s MET 92 N -5.96 3.63 0.94 4.77 0.23 -1.26 -5.09 119.30 116.57 2ctq s MET 92 Ca -0.12 0.04 -0.12 0.00 -1.03 0.00 0.00 55.69 54.46 2ctq s MET 92 Cb 0.19 -2.61 0.16 0.00 -1.53 0.00 0.00 34.83 31.04 2ctq s MET 92 CO 0.80 0.16 1.09 -1.25 -2.03 0.00 0.00 175.02 173.80 2ctq s PRO 93 N -3.69 0.87 0.11 3.16 0.04 -1.26 -4.87 135.00 129.36 2ctq s PRO 93 Ca 0.45 0.68 -0.18 0.00 0.04 0.00 0.00 61.00 61.98 2ctq s PRO 93 Cb -0.11 -1.77 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 2ctq s PRO 93 CO 0.31 -2.47 1.65 0.35 0.04 0.00 0.00 177.00 176.88 2ctq h PHE 94 N -1.71 0.41 -1.06 0.56 3.57 -1.98 -2.41 116.94 114.32 2ctq h PHE 94 Ca -0.52 -0.03 0.31 0.00 3.53 0.00 0.00 57.97 61.26 2ctq h PHE 94 Cb 1.30 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.88 2ctq h PHE 94 CO 0.36 0.42 1.09 -0.56 -2.23 0.00 0.00 178.31 177.39 2ctq h GLN 95 N 0.29 0.00 0.00 1.11 3.07 -2.02 0.17 115.11 117.73 2ctq h GLN 95 Ca 0.09 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.69 2ctq h GLN 95 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.72 2ctq h GLN 95 CO -0.01 0.00 -0.86 0.37 0.09 0.00 0.00 178.83 178.42 2ctq h GLN 96 N 0.00 0.00 -0.91 0.06 -0.00 -1.81 -3.38 115.11 109.08 2ctq h GLN 96 Ca 0.50 0.00 0.25 0.00 -0.00 0.00 0.00 58.65 59.40 2ctq h GLN 96 Cb 2.67 0.00 -0.14 0.00 0.00 0.00 0.00 27.48 30.01 2ctq h GLN 96 CO -0.01 0.72 0.33 2.35 0.00 0.00 0.00 178.83 182.22 2ctq h TRP 97 N -1.00 0.51 -0.69 3.99 7.01 -0.49 -1.18 115.95 124.11 2ctq h TRP 97 Ca -0.21 0.05 0.07 0.00 2.11 0.00 0.00 58.89 60.91 2ctq h TRP 97 Cb 1.02 -0.08 -0.10 0.00 -2.10 0.00 0.00 29.16 27.89 2ctq h TRP 97 CO 0.05 -0.18 -0.55 0.93 -2.79 0.00 0.00 178.44 175.90 2ctq h GLU 98 N 0.26 -0.20 -0.51 2.65 5.08 -1.45 0.09 114.58 120.51 2ctq h GLU 98 Ca 0.59 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 59.07 2ctq h GLU 98 Cb 1.22 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 30.41 2ctq h GLU 98 CO -0.63 -0.13 -0.17 0.00 -1.00 0.00 0.00 179.01 177.08 2ctq h ALA 99 N 0.30 0.25 -1.01 3.43 0.00 -1.41 0.19 119.26 121.02 2ctq h ALA 99 Ca 0.13 0.19 0.25 0.00 0.00 0.00 0.00 54.91 55.48 2ctq h ALA 99 Cb 0.52 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.70 2ctq h ALA 99 CO -0.76 -0.49 0.66 -0.07 0.00 0.00 0.00 179.25 178.59 2ctq h LEU 100 N -0.05 0.39 0.36 0.00 4.07 -0.95 -2.19 115.31 116.95 2ctq h LEU 100 Ca 0.24 0.06 -0.02 0.00 0.08 0.00 0.00 57.88 58.25 2ctq h LEU 100 Cb 0.43 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.17 2ctq h LEU 100 CO -0.55 0.10 -0.18 0.78 -1.08 0.00 0.00 178.44 177.52 2ctq h ASN 101 N 0.36 -0.41 -3.71 -0.43 2.35 0.15 -3.43 115.58 110.45 2ctq h ASN 101 Ca 0.55 -0.03 -0.63 0.00 -0.55 0.00 0.00 56.30 55.64 2ctq h ASN 101 Cb 1.46 0.11 -0.15 0.00 0.05 0.00 0.00 38.32 39.79 2ctq h ASN 101 CO -0.23 0.03 -0.24 -0.62 -1.65 0.00 0.00 177.43 174.72 2ctq s ASP 102 N -5.01 6.24 -0.99 5.81 -1.08 -0.66 -5.02 116.67 115.96 2ctq s ASP 102 Ca -0.08 0.19 -0.19 0.00 -0.52 0.00 0.00 52.55 51.94 2ctq s ASP 102 Cb 0.01 -2.21 0.11 0.00 -1.46 0.00 0.00 42.92 39.37 2ctq s ASP 102 CO 0.26 -0.22 1.26 -0.44 0.52 0.00 0.00 175.17 176.55 2ctq s SER 103 N 1.66 6.65 -1.20 -0.34 0.01 -1.25 -4.58 113.70 114.65 2ctq s SER 103 Ca 0.15 -2.00 -0.10 0.00 1.31 0.00 0.00 55.95 55.31 2ctq s SER 103 Cb -0.16 -2.45 0.21 0.00 0.21 0.00 0.00 66.02 63.83 2ctq s SER 103 CO 0.10 -1.15 1.58 1.33 0.41 0.00 0.00 173.24 175.51 2ctq n VAL 104 N 5.81 4.54 0.30 3.43 0.24 -1.26 -4.78 118.33 126.61 2ctq n VAL 104 Ca 0.29 -4.92 0.17 0.00 -2.04 0.00 0.00 64.34 57.84 2ctq n VAL 104 Cb 0.49 -2.36 0.94 0.00 -1.47 0.00 0.00 33.84 31.44 2ctq n VAL 104 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 2ctq h LYS 105 N 6.20 0.00 -0.16 7.34 2.10 -2.01 -2.46 116.57 127.58 2ctq h LYS 105 Ca 0.31 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.93 2ctq h LYS 105 Cb 0.73 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.05 2ctq h LYS 105 CO 1.38 0.03 -0.03 1.15 -2.00 0.00 0.00 179.45 179.99 2ctq h THR 106 N 0.00 1.28 -6.45 0.07 2.02 -2.03 -3.46 112.91 104.34 2ctq h THR 106 Ca -0.00 -0.95 -0.43 0.00 0.77 0.00 0.00 66.41 65.80 2ctq h THR 106 Cb 0.10 1.58 -0.27 0.00 -1.74 0.00 0.00 68.15 67.83 2ctq h THR 106 CO 0.00 0.28 -0.62 -1.54 0.37 0.00 0.00 175.52 174.01 2ctq n SER 107 N -4.70 -1.55 0.00 4.18 3.41 -0.93 -4.38 113.62 109.65 2ctq n SER 107 Ca -0.05 -0.71 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 2ctq n SER 107 Cb 0.25 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 62.81 2ctq n SER 107 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ctq n GLY 108 N -0.88 0.31 0.00 5.00 0.00 -1.26 -2.89 105.19 105.47 2ctq n GLY 108 Ca 0.08 -0.88 0.06 0.00 0.00 0.00 0.00 46.02 45.28 2ctq n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ctq n PRO 109 N 0.00 0.49 -4.00 1.61 -0.04 -1.26 -4.84 135.00 126.95 2ctq n PRO 109 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 2ctq n PRO 109 Cb 0.00 -1.38 -0.00 0.00 -0.04 0.00 0.00 33.50 32.08 2ctq n PRO 109 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ctq n SER 110 N -0.88 -2.56 -4.69 3.54 3.41 -1.14 -4.90 113.62 106.40 2ctq n SER 110 Ca 0.09 -0.93 -0.33 0.00 -0.26 0.00 0.00 58.87 57.45 2ctq n SER 110 Cb 0.04 -3.30 0.14 0.00 -0.26 0.00 0.00 64.21 60.83 2ctq n SER 110 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2ctq s SER 111 N -3.75 3.31 0.00 4.04 1.04 -1.26 -5.19 113.70 111.88 2ctq s SER 111 Ca 0.41 2.31 0.00 0.00 0.48 0.00 0.00 55.95 59.16 2ctq s SER 111 Cb -0.22 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.32 2ctq s SER 111 CO 0.88 -2.86 0.00 0.61 0.98 0.00 0.00 173.24 172.85