#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj0 n SER 2 N 0.00 -5.10 -3.92 1.61 2.88 -1.26 -5.00 113.62 102.83 2dj0 n SER 2 Ca 0.00 -0.51 -0.28 0.00 -1.33 0.00 0.00 58.87 56.75 2dj0 n SER 2 Cb 0.00 -4.64 -0.17 0.00 -0.75 0.00 0.00 64.21 58.66 2dj0 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dj0 s SER 3 N -3.50 2.54 0.00 -3.46 1.04 -1.26 -4.91 113.70 104.15 2dj0 s SER 3 Ca 0.41 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2dj0 s SER 3 Cb -0.18 -0.93 0.00 0.00 0.10 0.00 0.00 66.02 65.01 2dj0 s SER 3 CO 0.66 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.36 2dj0 n GLY 4 N 4.88 0.25 3.07 7.32 0.00 -1.26 -5.16 105.19 114.29 2dj0 n GLY 4 Ca -0.13 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 2dj0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj0 s SER 5 N 0.00 1.98 -0.03 1.61 0.01 -1.26 -5.13 113.70 110.88 2dj0 s SER 5 Ca 0.00 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 56.93 2dj0 s SER 5 Cb 0.00 -0.83 0.02 0.00 0.21 0.00 0.00 66.02 65.42 2dj0 s SER 5 CO 0.00 0.07 -0.02 -0.55 0.41 0.00 0.00 173.24 173.15 2dj0 s SER 6 N 0.48 0.62 -0.80 2.44 0.15 -1.26 -4.91 113.70 110.42 2dj0 s SER 6 Ca -0.13 -0.07 -0.15 0.00 0.70 0.00 0.00 55.95 56.30 2dj0 s SER 6 Cb -0.15 -0.30 0.02 0.00 -1.71 0.00 0.00 66.02 63.89 2dj0 s SER 6 CO 0.04 -0.07 0.49 0.61 1.20 0.00 0.00 173.24 175.52 2dj0 n GLY 7 N 3.98 -0.81 3.23 9.45 0.00 -1.26 -4.93 105.19 114.84 2dj0 n GLY 7 Ca -0.25 0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2dj0 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dj0 s TYR 8 N -3.36 2.64 0.09 1.61 1.13 -1.26 -5.10 117.35 113.10 2dj0 s TYR 8 Ca 0.21 -1.08 0.08 0.00 -1.41 0.00 0.00 57.07 54.86 2dj0 s TYR 8 Cb -0.12 -1.77 -0.03 0.00 -1.10 0.00 0.00 41.96 38.94 2dj0 s TYR 8 CO 0.72 -0.45 -0.20 0.42 -2.51 0.00 0.00 175.55 173.53 2dj0 s ILE 9 N 0.51 1.64 -0.43 -3.49 1.01 -1.26 -4.85 121.20 114.34 2dj0 s ILE 9 Ca -0.14 -1.48 -0.19 0.00 0.00 0.00 0.00 60.65 58.84 2dj0 s ILE 9 Cb -0.17 -1.49 0.03 0.00 0.01 0.00 0.00 42.46 40.83 2dj0 s ILE 9 CO 0.05 -0.05 0.53 -0.75 0.00 0.00 0.00 174.94 174.72 2dj0 s LYS 10 N -1.82 3.17 0.69 2.79 2.20 -1.19 -4.97 119.74 120.61 2dj0 s LYS 10 Ca 0.06 -0.62 -0.11 0.00 -0.36 0.00 0.00 55.97 54.93 2dj0 s LYS 10 Cb -0.10 -3.97 0.00 0.00 -1.51 0.00 0.00 37.83 32.25 2dj0 s LYS 10 CO 0.04 -0.94 1.06 0.71 -0.36 0.00 0.00 175.35 175.86 2dj0 s TYR 11 N 2.43 3.29 0.00 4.03 1.51 -1.26 -3.00 117.35 124.35 2dj0 s TYR 11 Ca 0.16 1.25 0.00 0.00 -1.01 0.00 0.00 57.07 57.47 2dj0 s TYR 11 Cb -0.16 -2.91 -0.00 0.00 -0.11 0.00 0.00 41.96 38.78 2dj0 s TYR 11 CO 0.16 -1.13 -0.00 -0.06 -1.11 0.00 0.00 175.55 173.41 2dj0 s PHE 12 N -3.18 0.00 1.01 2.71 0.08 -1.20 -4.88 117.98 112.52 2dj0 s PHE 12 Ca 0.57 -0.01 -0.17 0.00 0.12 0.00 0.00 56.93 57.45 2dj0 s PHE 12 Cb -0.12 -0.00 0.23 0.00 -0.57 0.00 0.00 43.02 42.56 2dj0 s PHE 12 CO 0.54 -0.00 1.33 -1.71 -0.10 0.00 0.00 175.22 175.28 2dj0 n ASN 13 N 3.06 -0.03 0.21 1.36 5.15 -1.26 -4.70 115.26 119.04 2dj0 n ASN 13 Ca -0.12 -1.47 0.10 0.00 -0.60 0.00 0.00 54.58 52.49 2dj0 n ASN 13 Cb 0.60 -1.03 0.32 0.00 -0.53 0.00 0.00 39.78 39.14 2dj0 n ASN 13 CO 0.00 0.00 0.00 -2.24 1.40 0.00 0.00 177.26 176.42 2dj0 h ASP 14 N -1.83 0.00 0.00 1.20 3.04 -1.99 -2.54 116.42 114.30 2dj0 h ASP 14 Ca -0.43 0.00 -0.37 0.00 -3.24 0.00 0.00 57.03 52.98 2dj0 h ASP 14 Cb 1.20 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 39.44 2dj0 h ASP 14 CO 0.30 0.21 -2.22 1.17 -2.04 0.00 0.00 179.24 176.67 2dj0 n LYS 15 N -3.24 0.51 -0.33 4.15 3.00 -1.26 -4.55 118.16 116.44 2dj0 n LYS 15 Ca 0.02 0.22 0.04 0.00 -0.00 0.00 0.00 58.31 58.59 2dj0 n LYS 15 Cb 0.51 -1.37 0.23 0.00 0.00 0.00 0.00 35.03 34.40 2dj0 n LYS 15 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 2dj0 h THR 16 N -0.88 1.05 -0.59 3.15 1.35 -1.95 -1.50 112.91 113.54 2dj0 h THR 16 Ca -0.56 -0.36 0.17 0.00 -0.55 0.00 0.00 66.41 65.10 2dj0 h THR 16 Cb 1.48 -0.10 -0.02 0.00 -1.73 0.00 0.00 68.15 67.77 2dj0 h THR 16 CO -0.34 0.19 1.00 -0.29 -0.25 0.00 0.00 175.52 175.83 2dj0 h ILE 17 N 1.06 0.04 0.00 6.82 2.10 -1.69 0.78 117.51 126.63 2dj0 h ILE 17 Ca 0.41 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.35 2dj0 h ILE 17 Cb 0.23 0.13 0.00 0.00 -1.09 0.00 0.00 36.82 36.09 2dj0 h ILE 17 CO -0.17 0.00 -0.35 -0.78 -1.08 0.00 0.00 178.15 175.78 2dj0 h ASP 18 N 0.00 0.00 -0.91 2.19 3.58 -1.55 -3.20 116.42 116.53 2dj0 h ASP 18 Ca 0.28 0.00 0.21 0.00 0.42 0.00 0.00 57.03 57.94 2dj0 h ASP 18 Cb 2.27 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 43.20 2dj0 h ASP 18 CO -0.00 0.63 0.45 1.05 -2.88 0.00 0.00 179.24 178.49 2dj0 h GLU 19 N -0.92 0.46 0.53 0.28 4.11 -1.09 0.64 114.58 118.58 2dj0 h GLU 19 Ca 0.00 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.38 2dj0 h GLU 19 Cb 0.35 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.50 2dj0 h GLU 19 CO 0.00 0.31 -0.25 1.49 0.07 0.00 0.00 179.01 180.62 2dj0 h GLU 20 N 0.48 -0.68 0.00 1.06 4.57 -1.12 -1.50 114.58 117.38 2dj0 h GLU 20 Ca 0.56 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.79 2dj0 h GLU 20 Cb 1.04 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2dj0 h GLU 20 CO -0.49 -0.40 0.00 1.28 -1.18 0.00 0.00 179.01 178.21 2dj0 n LEU 21 N -5.35 0.00 -0.02 1.64 4.77 -0.61 -1.27 117.00 116.17 2dj0 n LEU 21 Ca -0.12 0.43 -0.04 0.00 -0.03 0.00 0.00 56.01 56.25 2dj0 n LEU 21 Cb 0.31 -0.43 -0.12 0.00 -2.33 0.00 0.00 43.42 40.85 2dj0 n LEU 21 CO 0.35 -0.34 -0.59 1.21 -1.33 0.00 0.00 177.39 176.69 2dj0 n GLU 22 N -1.43 0.64 0.00 3.23 2.13 0.12 -3.01 120.64 122.33 2dj0 n GLU 22 Ca 0.02 0.17 0.11 0.00 0.66 0.00 0.00 57.16 58.12 2dj0 n GLU 22 Cb 0.06 -1.72 0.12 0.00 0.27 0.00 0.00 31.44 30.16 2dj0 n GLU 22 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 2dj0 n ARG 23 N -2.87 0.09 -0.45 5.31 1.85 -0.39 -4.06 116.66 116.14 2dj0 n ARG 23 Ca -0.17 -0.06 0.07 0.00 -1.00 0.00 0.00 57.85 56.68 2dj0 n ARG 23 Cb 0.96 -1.50 0.13 0.00 -1.05 0.00 0.00 32.46 31.00 2dj0 n ARG 23 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2dj0 n ASP 24 N -1.40 1.65 0.00 2.89 9.92 -0.67 -4.90 116.55 124.04 2dj0 n ASP 24 Ca 0.05 -3.05 0.00 0.00 -0.53 0.00 0.00 54.79 51.26 2dj0 n ASP 24 Cb 0.34 -0.41 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 2dj0 n ASP 24 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2dj0 n LYS 25 N -0.91 0.00 -0.60 -1.24 5.02 -1.16 -0.13 118.16 119.13 2dj0 n LYS 25 Ca 0.13 0.78 0.47 0.00 -2.02 0.00 0.00 58.31 57.67 2dj0 n LYS 25 Cb 0.72 -1.39 0.75 0.00 -0.02 0.00 0.00 35.03 35.09 2dj0 n LYS 25 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2dj0 n ARG 26 N -2.35 -0.01 -3.09 1.97 0.00 -1.26 -1.43 116.66 110.47 2dj0 n ARG 26 Ca 0.00 1.13 -0.39 0.00 -0.00 0.00 0.00 57.85 58.59 2dj0 n ARG 26 Cb 0.00 -2.45 -0.06 0.00 -0.00 0.00 0.00 32.46 29.95 2dj0 n ARG 26 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2dj0 s VAL 27 N -4.98 4.59 0.34 8.89 1.01 0.82 -4.39 120.40 126.67 2dj0 s VAL 27 Ca -0.06 1.50 -0.27 0.00 0.00 0.00 0.00 61.98 63.15 2dj0 s VAL 27 Cb 0.28 -4.04 -0.09 0.00 0.00 0.00 0.00 36.38 32.53 2dj0 s VAL 27 CO 0.85 0.50 1.05 -0.89 0.00 0.00 0.00 175.10 176.60 2dj0 s THR 28 N -0.86 3.70 -0.02 3.92 2.01 -1.26 -4.39 115.64 118.75 2dj0 s THR 28 Ca 0.34 1.49 0.00 0.00 0.31 0.00 0.00 61.69 63.82 2dj0 s THR 28 Cb -0.21 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.47 2dj0 s THR 28 CO 0.23 0.19 0.02 0.26 -0.69 0.00 0.00 174.62 174.62 2dj0 s TRP 29 N -1.44 0.11 -0.30 4.92 0.52 -0.88 -3.57 118.94 118.30 2dj0 s TRP 29 Ca 0.51 0.10 -0.01 0.00 0.02 0.00 0.00 56.10 56.71 2dj0 s TRP 29 Cb -0.26 -0.29 0.05 0.00 -1.15 0.00 0.00 33.47 31.83 2dj0 s TRP 29 CO 0.32 -0.10 -0.00 -1.50 0.02 0.00 0.00 176.95 175.69 2dj0 s ILE 30 N 1.08 2.93 -0.16 2.03 2.07 -1.16 -2.15 121.20 125.84 2dj0 s ILE 30 Ca -0.09 -1.43 -0.05 0.00 -1.41 0.00 0.00 60.65 57.66 2dj0 s ILE 30 Cb -0.13 -2.70 -0.04 0.00 0.13 0.00 0.00 42.46 39.72 2dj0 s ILE 30 CO -0.03 -0.12 0.03 -0.69 -1.91 0.00 0.00 174.94 172.22 2dj0 s VAL 31 N 1.23 4.48 -0.38 4.00 1.01 -1.21 -1.50 120.40 128.03 2dj0 s VAL 31 Ca -0.05 -0.15 -0.14 0.00 0.00 0.00 0.00 61.98 61.64 2dj0 s VAL 31 Cb -0.20 -2.98 0.01 0.00 0.00 0.00 0.00 36.38 33.21 2dj0 s VAL 31 CO -0.02 0.50 0.27 -0.70 0.00 0.00 0.00 175.10 175.16 2dj0 s GLU 32 N 0.13 3.14 -0.55 2.72 2.12 -0.95 -3.09 118.70 122.21 2dj0 s GLU 32 Ca 0.03 -0.90 -0.24 0.00 0.36 0.00 0.00 54.97 54.22 2dj0 s GLU 32 Cb -0.13 -3.90 0.04 0.00 0.26 0.00 0.00 34.13 30.40 2dj0 s GLU 32 CO 0.01 -0.64 0.92 -0.06 -0.54 0.00 0.00 175.26 174.95 2dj0 s PHE 33 N 1.69 2.80 0.22 5.30 0.40 0.63 -2.89 117.98 126.13 2dj0 s PHE 33 Ca 0.05 -0.08 0.06 0.00 -0.60 0.00 0.00 56.93 56.36 2dj0 s PHE 33 Cb -0.18 -4.05 -0.05 0.00 0.51 0.00 0.00 43.02 39.25 2dj0 s PHE 33 CO 0.10 -1.35 -0.09 -0.59 0.70 0.00 0.00 175.22 173.99 2dj0 s PHE 34 N 3.87 1.68 0.07 0.36 -0.12 -1.25 -1.31 117.98 121.28 2dj0 s PHE 34 Ca 0.29 -0.69 0.05 0.00 -0.05 0.00 0.00 56.93 56.54 2dj0 s PHE 34 Cb -0.13 -0.87 -0.04 0.00 -0.63 0.00 0.00 43.02 41.35 2dj0 s PHE 34 CO 0.18 0.24 -0.07 0.00 -0.05 0.00 0.00 175.22 175.52 2dj0 s ALA 35 N -3.10 3.05 0.48 1.99 0.00 -1.26 -0.30 121.76 122.62 2dj0 s ALA 35 Ca 0.24 -1.14 0.24 0.00 0.00 0.00 0.00 51.96 51.30 2dj0 s ALA 35 Cb 0.02 -1.04 1.46 0.00 0.00 0.00 0.00 23.12 23.56 2dj0 s ALA 35 CO 0.07 0.65 2.12 -2.95 0.00 0.00 0.00 175.76 175.65 2dj0 h ASN 36 N 3.86 0.00 -0.61 0.00 7.08 -1.93 -0.45 115.58 123.52 2dj0 h ASN 36 Ca -0.48 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.74 2dj0 h ASN 36 Cb 1.17 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.41 2dj0 h ASN 36 CO 0.54 0.09 0.00 -2.67 -2.08 0.00 0.00 177.43 173.31 2dj0 n TRP 37 N -3.92 1.03 -2.77 4.14 4.27 -1.26 -4.86 117.44 114.07 2dj0 n TRP 37 Ca -0.02 -0.46 -0.43 0.00 -3.89 0.00 0.00 57.50 52.70 2dj0 n TRP 37 Cb 0.18 -0.09 -0.04 0.00 -1.36 0.00 0.00 31.31 30.01 2dj0 n TRP 37 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 2dj0 s SER 38 N -0.94 6.31 -0.05 -0.67 0.15 -0.18 -4.90 113.70 113.43 2dj0 s SER 38 Ca 0.43 -0.39 -0.26 0.00 0.70 0.00 0.00 55.95 56.44 2dj0 s SER 38 Cb 0.25 -2.46 -0.21 0.00 -1.71 0.00 0.00 66.02 61.89 2dj0 s SER 38 CO 0.26 -1.36 1.12 0.78 1.20 0.00 0.00 173.24 175.25 2dj0 h ASN 39 N 9.45 -0.04 -0.21 5.45 2.35 -1.89 -3.07 115.58 127.63 2dj0 h ASN 39 Ca -0.27 -0.55 0.06 0.00 -0.55 0.00 0.00 56.30 55.00 2dj0 h ASN 39 Cb 1.07 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 2dj0 h ASN 39 CO 1.14 0.54 0.53 0.44 -1.65 0.00 0.00 177.43 178.43 2dj0 h ASP 40 N -0.64 0.00 0.24 5.81 5.19 -1.92 0.57 116.42 125.66 2dj0 h ASP 40 Ca -0.00 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.26 2dj0 h ASP 40 Cb 0.58 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.08 2dj0 h ASP 40 CO 0.01 0.00 -0.55 0.00 -3.12 0.00 0.00 179.24 175.58 2dj0 h GLN 42 N 0.26 0.40 0.00 0.00 3.07 0.05 0.57 115.11 119.46 2dj0 h GLN 42 Ca 0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 58.65 58.69 2dj0 h GLN 42 Cb 1.04 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 28.51 2dj0 h GLN 42 CO 0.09 0.27 -0.14 1.03 0.09 0.00 0.00 178.83 180.17 2dj0 h SER 43 N 0.42 0.00 0.51 0.06 0.87 -1.64 -2.82 113.55 110.94 2dj0 h SER 43 Ca 0.44 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.96 2dj0 h SER 43 Cb 1.07 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.02 2dj0 h SER 43 CO -0.16 0.14 -1.53 0.33 -0.53 0.00 0.00 176.83 175.08 2dj0 n PHE 44 N -3.32 0.54 -0.30 2.24 7.35 0.17 -4.30 117.46 119.84 2dj0 n PHE 44 Ca 0.00 0.16 -0.08 0.00 -0.76 0.00 0.00 57.45 56.77 2dj0 n PHE 44 Cb 0.37 -0.80 -0.07 0.00 0.35 0.00 0.00 39.48 39.32 2dj0 n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2dj0 n ALA 45 N -2.28 -0.46 -0.05 3.13 0.00 0.32 -0.12 120.51 121.06 2dj0 n ALA 45 Ca -0.05 0.61 -0.10 0.00 0.00 0.00 0.00 53.44 53.90 2dj0 n ALA 45 Cb 0.64 -0.06 0.05 0.00 0.00 0.00 0.00 19.45 20.08 2dj0 n ALA 45 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2dj0 h PRO 46 N 0.00 0.70 0.45 0.00 0.13 -1.78 -2.88 132.00 128.63 2dj0 h PRO 46 Ca 0.11 -0.37 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2dj0 h PRO 46 Cb 0.29 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.42 2dj0 h PRO 46 CO -0.67 0.99 -0.43 0.82 -0.23 0.00 0.00 178.00 178.48 2dj0 h ILE 47 N 0.57 0.14 -0.02 -3.56 2.04 -0.74 -1.41 117.51 114.53 2dj0 h ILE 47 Ca 0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.93 2dj0 h ILE 47 Cb 0.95 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 2dj0 h ILE 47 CO 0.09 0.00 -0.15 0.22 0.00 0.00 0.00 178.15 178.30 2dj0 h TYR 48 N -0.89 -0.40 -0.64 1.37 3.20 -0.59 -1.93 116.97 117.09 2dj0 h TYR 48 Ca -0.05 0.01 0.13 0.00 3.14 0.00 0.00 58.73 61.96 2dj0 h TYR 48 Cb 0.78 0.18 -0.12 0.00 1.54 0.00 0.00 36.73 39.11 2dj0 h TYR 48 CO -0.22 -0.23 -0.21 0.00 -1.64 0.00 0.00 178.16 175.87 2dj0 h ALA 49 N 0.71 0.31 -0.33 1.82 0.00 -1.37 0.13 119.26 120.53 2dj0 h ALA 49 Ca 0.06 0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.23 2dj0 h ALA 49 Cb 0.32 0.58 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 2dj0 h ALA 49 CO -0.16 -0.49 0.15 -0.44 0.00 0.00 0.00 179.25 178.31 2dj0 h ASP 50 N -0.05 0.20 0.66 0.00 3.32 -0.87 -2.18 116.42 117.50 2dj0 h ASP 50 Ca 0.30 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.34 2dj0 h ASP 50 Cb 0.51 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 2dj0 h ASP 50 CO -0.68 0.16 -0.40 -0.07 -1.72 0.00 0.00 179.24 176.53 2dj0 h LEU 51 N 0.31 -0.99 -0.48 1.55 3.38 -0.25 -2.62 115.31 116.20 2dj0 h LEU 51 Ca 0.14 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.21 2dj0 h LEU 51 Cb 0.08 0.29 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 2dj0 h LEU 51 CO -0.12 -0.61 -0.38 0.77 0.09 0.00 0.00 178.44 178.19 2dj0 h SER 52 N -0.98 -1.34 -0.99 -0.43 4.64 -0.77 0.34 113.55 114.01 2dj0 h SER 52 Ca -0.09 0.19 0.36 0.00 -0.47 0.00 0.00 61.79 61.78 2dj0 h SER 52 Cb 0.78 0.58 -0.17 0.00 -0.31 0.00 0.00 62.40 63.28 2dj0 h SER 52 CO 0.09 -0.21 0.45 -0.07 -0.87 0.00 0.00 176.83 176.23 2dj0 h LEU 53 N -0.12 0.22 0.58 5.97 3.38 -1.40 1.56 115.31 125.51 2dj0 h LEU 53 Ca 0.08 0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.26 2dj0 h LEU 53 Cb 0.33 0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.35 2dj0 h LEU 53 CO -0.52 -0.33 -0.28 0.50 0.09 0.00 0.00 178.44 177.90 2dj0 h LYS 54 N 0.10 -0.76 -0.58 1.13 3.64 0.01 -2.90 116.57 117.22 2dj0 h LYS 54 Ca 0.76 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 60.19 2dj0 h LYS 54 Cb 1.87 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.86 2dj0 h LYS 54 CO -0.74 -0.45 0.00 0.66 -2.27 0.00 0.00 179.45 176.65 2dj0 n TYR 55 N -5.35 0.37 -2.46 1.91 4.02 0.27 -4.62 117.16 111.31 2dj0 n TYR 55 Ca -0.12 -0.14 -0.43 0.00 -0.01 0.00 0.00 57.90 57.20 2dj0 n TYR 55 Cb 0.34 -0.11 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 2dj0 n TYR 55 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2dj0 n ASN 56 N 0.08 4.91 -2.38 7.72 4.13 0.51 -4.51 115.26 125.72 2dj0 n ASN 56 Ca 0.06 -3.00 -0.10 0.00 1.68 0.00 0.00 54.58 53.22 2dj0 n ASN 56 Cb 0.33 -1.58 -0.02 0.00 -1.54 0.00 0.00 39.78 36.96 2dj0 n ASN 56 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dj0 s THR 58 N -2.71 3.11 0.00 0.00 2.01 -1.26 -3.37 115.64 113.42 2dj0 s THR 58 Ca 0.20 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.32 2dj0 s THR 58 Cb -0.01 -3.17 0.00 0.00 0.01 0.00 0.00 72.50 69.34 2dj0 s THR 58 CO 0.15 -0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 2dj0 n GLY 59 N 5.73 2.25 3.63 4.40 0.00 -1.26 -5.09 105.19 114.85 2dj0 n GLY 59 Ca 0.29 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 2dj0 n GLY 59 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dj0 s LEU 60 N 0.00 3.61 0.21 0.99 2.96 -1.22 -4.33 118.68 120.91 2dj0 s LEU 60 Ca 0.00 0.08 0.11 0.00 -0.22 0.00 0.00 54.13 54.10 2dj0 s LEU 60 Cb 0.00 -1.87 -0.05 0.00 0.50 0.00 0.00 46.19 44.78 2dj0 s LEU 60 CO 0.00 0.27 -0.20 0.20 -1.32 0.00 0.00 176.35 175.30 2dj0 s ASN 61 N -0.22 3.64 0.06 3.68 -0.87 -1.23 -3.83 114.94 116.17 2dj0 s ASN 61 Ca 0.06 -0.85 0.10 0.00 -1.57 0.00 0.00 52.86 50.59 2dj0 s ASN 61 Cb -0.12 -0.36 -0.03 0.00 -0.02 0.00 0.00 41.25 40.71 2dj0 s ASN 61 CO 0.02 0.09 -0.26 -0.36 -2.57 0.00 0.00 177.10 174.02 2dj0 s PHE 62 N -1.90 2.29 0.23 2.20 0.40 -1.26 -2.97 117.98 116.97 2dj0 s PHE 62 Ca 0.24 -0.41 -0.04 0.00 -0.60 0.00 0.00 56.93 56.13 2dj0 s PHE 62 Cb -0.07 -1.35 -0.03 0.00 0.51 0.00 0.00 43.02 42.08 2dj0 s PHE 62 CO 0.12 0.16 0.26 0.20 0.70 0.00 0.00 175.22 176.67 2dj0 s GLY 63 N -1.39 1.26 -0.17 4.36 0.00 -0.56 -3.14 107.32 107.67 2dj0 s GLY 63 Ca 0.12 -1.49 -0.10 0.00 0.00 0.00 0.00 44.72 43.25 2dj0 s GLY 63 CO 0.03 -1.17 0.42 0.54 0.00 0.00 0.00 173.10 172.92 2dj0 s LYS 64 N -3.99 0.41 -0.31 2.90 1.02 -1.16 -2.25 119.74 116.36 2dj0 s LYS 64 Ca 0.34 0.80 -0.01 0.00 0.02 0.00 0.00 55.97 57.13 2dj0 s LYS 64 Cb 0.04 -0.02 0.10 0.00 -0.52 0.00 0.00 37.83 37.43 2dj0 s LYS 64 CO 0.13 -0.16 0.09 0.54 -0.92 0.00 0.00 175.35 175.03 2dj0 s VAL 65 N 1.40 0.90 -0.45 3.17 0.11 -1.14 -3.24 120.40 121.15 2dj0 s VAL 65 Ca -0.10 -1.39 -0.28 0.00 -2.93 0.00 0.00 61.98 57.29 2dj0 s VAL 65 Cb -0.08 -1.67 -0.08 0.00 -1.53 0.00 0.00 36.38 33.02 2dj0 s VAL 65 CO -0.13 -0.65 2.38 -0.90 -3.33 0.00 0.00 175.10 172.46 2dj0 n ASP 66 N 4.84 2.36 0.09 3.54 5.75 -1.26 -3.85 116.55 128.01 2dj0 n ASP 66 Ca -0.02 -0.20 -0.13 0.00 -0.01 0.00 0.00 54.79 54.42 2dj0 n ASP 66 Cb 0.42 -1.50 -0.13 0.00 -1.03 0.00 0.00 41.12 38.88 2dj0 n ASP 66 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 2dj0 h VAL 67 N 7.55 1.55 -0.44 2.12 -1.51 -0.95 -2.80 116.25 121.77 2dj0 h VAL 67 Ca -0.27 -3.17 0.13 0.00 -1.23 0.00 0.00 66.70 62.16 2dj0 h VAL 67 Cb 1.27 2.91 -0.02 0.00 -2.13 0.00 0.00 31.29 33.32 2dj0 h VAL 67 CO 1.12 0.92 0.94 1.23 -1.23 0.00 0.00 177.57 180.55 2dj0 h GLY 68 N 2.04 0.00 0.00 5.19 0.00 -1.84 -0.34 103.07 108.12 2dj0 h GLY 68 Ca -0.10 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 2dj0 h GLY 68 CO 0.18 0.00 -1.22 -2.13 0.00 0.00 0.00 176.54 173.37 2dj0 n ARG 69 N -2.96 1.59 -1.88 4.80 0.63 -1.24 -4.80 116.66 112.80 2dj0 n ARG 69 Ca 0.09 0.01 -0.42 0.00 -0.92 0.00 0.00 57.85 56.61 2dj0 n ARG 69 Cb 1.09 -1.08 0.00 0.00 0.45 0.00 0.00 32.46 32.92 2dj0 n ARG 69 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2dj0 n TYR 70 N -2.40 3.60 0.29 -0.14 4.02 -0.14 -4.71 117.16 117.68 2dj0 n TYR 70 Ca -0.06 -2.95 0.19 0.00 -0.01 0.00 0.00 57.90 55.07 2dj0 n TYR 70 Cb 0.59 -2.50 1.01 0.00 -0.02 0.00 0.00 39.34 38.41 2dj0 n TYR 70 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dj0 h THR 71 N 4.13 0.00 -0.01 -0.72 1.03 -1.88 -0.07 112.91 115.39 2dj0 h THR 71 Ca 0.54 0.00 -0.14 0.00 -0.01 0.00 0.00 66.41 66.80 2dj0 h THR 71 Cb 0.66 0.82 -0.02 0.00 -1.07 0.00 0.00 68.15 68.54 2dj0 h THR 71 CO 1.82 0.00 -0.64 0.44 -0.01 0.00 0.00 175.52 177.13 2dj0 h ASP 72 N 0.00 0.03 0.00 0.00 5.19 -1.91 -3.00 116.42 116.74 2dj0 h ASP 72 Ca 0.00 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2dj0 h ASP 72 Cb 0.06 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.56 2dj0 h ASP 72 CO 0.00 0.66 -0.11 0.58 -3.12 0.00 0.00 179.24 177.26 2dj0 h VAL 73 N 0.02 0.00 -0.96 -1.35 2.07 -1.35 -3.24 116.25 111.43 2dj0 h VAL 73 Ca -0.01 -0.68 0.18 0.00 0.82 0.00 0.00 66.70 67.01 2dj0 h VAL 73 Cb 1.14 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.73 2dj0 h VAL 73 CO 0.09 0.00 -0.29 0.77 0.02 0.00 0.00 177.57 178.16 2dj0 h SER 74 N -0.68 -1.06 -0.75 0.57 4.64 -1.64 1.30 113.55 115.92 2dj0 h SER 74 Ca 0.00 0.29 0.08 0.00 -0.47 0.00 0.00 61.79 61.70 2dj0 h SER 74 Cb 0.11 0.64 -0.05 0.00 -0.31 0.00 0.00 62.40 62.79 2dj0 h SER 74 CO 0.00 -0.31 0.49 0.74 -0.87 0.00 0.00 176.83 176.88 2dj0 h THR 75 N -0.01 0.97 0.00 2.95 2.02 -1.70 0.25 112.91 117.39 2dj0 h THR 75 Ca 0.42 -0.25 -0.14 0.00 0.77 0.00 0.00 66.41 67.22 2dj0 h THR 75 Cb 0.67 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2dj0 h THR 75 CO -0.99 0.13 -0.67 -0.09 0.37 0.00 0.00 175.52 174.27 2dj0 h ARG 76 N 0.71 0.00 -0.57 6.66 2.43 0.14 -3.18 114.38 120.57 2dj0 h ARG 76 Ca 0.34 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.39 2dj0 h ARG 76 Cb 0.38 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.85 2dj0 h ARG 76 CO -0.12 0.67 0.13 0.66 -1.51 0.00 0.00 179.97 179.80 2dj0 n TYR 77 N -3.37 1.95 -4.22 2.20 4.02 0.12 -4.95 117.16 112.91 2dj0 n TYR 77 Ca 0.01 -1.07 -0.29 0.00 -0.01 0.00 0.00 57.90 56.54 2dj0 n TYR 77 Cb 0.76 -0.56 -0.09 0.00 -0.02 0.00 0.00 39.34 39.43 2dj0 n TYR 77 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2dj0 n LYS 78 N -0.15 -0.94 -3.78 -0.72 4.01 0.58 -4.88 118.16 112.28 2dj0 n LYS 78 Ca 0.33 0.09 -0.36 0.00 -0.51 0.00 0.00 58.31 57.86 2dj0 n LYS 78 Cb 1.22 -3.40 -0.11 0.00 -0.51 0.00 0.00 35.03 32.23 2dj0 n LYS 78 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2dj0 s VAL 79 N -4.28 3.31 0.18 -0.18 1.01 0.45 -5.02 120.40 115.88 2dj0 s VAL 79 Ca 0.02 -2.43 -0.33 0.00 0.00 0.00 0.00 61.98 59.24 2dj0 s VAL 79 Cb -0.01 -3.24 -0.14 0.00 0.00 0.00 0.00 36.38 32.98 2dj0 s VAL 79 CO 0.94 -0.75 1.48 -1.20 0.00 0.00 0.00 175.10 175.57 2dj0 n SER 80 N 4.14 2.77 -2.70 3.32 7.64 -1.26 -4.57 113.62 122.96 2dj0 n SER 80 Ca 0.02 1.11 -0.33 0.00 1.01 0.00 0.00 58.87 60.67 2dj0 n SER 80 Cb 0.40 -1.40 0.02 0.00 -1.01 0.00 0.00 64.21 62.22 2dj0 n SER 80 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2dj0 n THR 81 N 2.69 2.98 -4.17 0.44 -2.24 -1.26 -4.58 114.28 108.13 2dj0 n THR 81 Ca 0.15 -4.62 -0.32 0.00 -2.27 0.00 0.00 64.05 56.98 2dj0 n THR 81 Cb 0.29 -1.26 -0.08 0.00 -2.10 0.00 0.00 70.33 67.19 2dj0 n THR 81 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2dj0 s SER 82 N -2.33 5.38 0.00 3.42 0.01 -1.26 -4.99 113.70 113.93 2dj0 s SER 82 Ca 0.50 0.04 0.15 0.00 1.31 0.00 0.00 55.95 57.95 2dj0 s SER 82 Cb 0.42 -1.46 0.79 0.00 0.21 0.00 0.00 66.02 65.98 2dj0 s SER 82 CO -0.30 0.25 1.39 -0.81 0.41 0.00 0.00 173.24 174.18 2dj0 n PRO 83 N 1.12 0.28 -0.12 12.44 -0.04 -1.26 -3.07 135.00 144.36 2dj0 n PRO 83 Ca -0.13 0.11 -0.21 0.00 -0.04 0.00 0.00 63.50 63.23 2dj0 n PRO 83 Cb 0.52 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 2dj0 n PRO 83 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2dj0 n LEU 84 N -1.21 2.21 -4.28 1.53 4.77 -1.26 -5.01 117.00 113.74 2dj0 n LEU 84 Ca 0.08 0.12 -0.29 0.00 -0.03 0.00 0.00 56.01 55.90 2dj0 n LEU 84 Cb 0.10 -0.73 0.21 0.00 -2.33 0.00 0.00 43.42 40.67 2dj0 n LEU 84 CO 0.11 0.65 -0.09 1.07 -1.33 0.00 0.00 177.39 177.80 2dj0 n THR 85 N -3.69 0.00 -1.93 -5.08 5.66 -1.17 -4.95 114.28 103.11 2dj0 n THR 85 Ca -0.44 -0.28 -0.16 0.00 -3.05 0.00 0.00 64.05 60.12 2dj0 n THR 85 Cb 0.87 -0.74 0.07 0.00 -1.55 0.00 0.00 70.33 68.98 2dj0 n THR 85 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2dj0 n LYS 86 N -3.28 3.05 -0.99 1.09 4.01 -1.26 -4.71 118.16 116.06 2dj0 n LYS 86 Ca 0.03 -3.93 -0.05 0.00 -0.51 0.00 0.00 58.31 53.86 2dj0 n LYS 86 Cb 0.56 -2.09 0.30 0.00 -0.51 0.00 0.00 35.03 33.30 2dj0 n LYS 86 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2dj0 n GLN 87 N -0.80 3.62 -3.67 1.97 6.02 -1.26 -4.70 117.38 118.56 2dj0 n GLN 87 Ca 0.37 -3.09 -0.08 0.00 -0.01 0.00 0.00 57.00 54.18 2dj0 n GLN 87 Cb 0.90 -2.19 -0.09 0.00 1.02 0.00 0.00 30.24 29.88 2dj0 n GLN 87 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2dj0 s LEU 88 N -3.00 -0.56 1.22 1.08 1.43 -1.26 -4.11 118.68 113.47 2dj0 s LEU 88 Ca 0.54 1.08 -0.20 0.00 -1.03 0.00 0.00 54.13 54.52 2dj0 s LEU 88 Cb 0.44 1.55 0.29 0.00 0.03 0.00 0.00 46.19 48.50 2dj0 s LEU 88 CO 0.13 -0.22 1.11 -2.16 0.23 0.00 0.00 176.35 175.44 2dj0 s PRO 89 N 2.17 -1.33 -0.09 1.29 0.04 -1.26 -4.88 135.00 130.94 2dj0 s PRO 89 Ca -0.05 -0.11 -0.11 0.00 0.04 0.00 0.00 61.00 60.77 2dj0 s PRO 89 Cb -0.10 -1.59 0.03 0.00 0.04 0.00 0.00 34.50 32.88 2dj0 s PRO 89 CO -0.14 -3.78 0.30 0.99 0.04 0.00 0.00 177.00 174.41 2dj0 s THR 90 N -3.01 0.02 -0.02 1.26 2.01 -0.43 -4.74 115.64 110.72 2dj0 s THR 90 Ca 0.71 -0.13 0.05 0.00 0.31 0.00 0.00 61.69 62.64 2dj0 s THR 90 Cb -0.09 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 71.94 2dj0 s THR 90 CO 0.56 -0.07 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.48 2dj0 s LEU 91 N -0.21 2.00 -0.03 4.42 1.43 -1.00 -0.27 118.68 125.02 2dj0 s LEU 91 Ca -0.03 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2dj0 s LEU 91 Cb -0.03 -0.96 0.02 0.00 0.03 0.00 0.00 46.19 45.24 2dj0 s LEU 91 CO 0.01 0.20 -0.04 -0.63 0.23 0.00 0.00 176.35 176.13 2dj0 s ILE 92 N -0.28 0.41 -0.24 -0.59 1.01 -1.18 -1.77 121.20 118.56 2dj0 s ILE 92 Ca 0.03 -0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.49 2dj0 s ILE 92 Cb -0.09 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.91 2dj0 s ILE 92 CO 0.00 0.17 0.14 -0.22 0.00 0.00 0.00 174.94 175.03 2dj0 s LEU 93 N 0.63 3.93 -0.22 2.97 2.96 0.04 -3.31 118.68 125.68 2dj0 s LEU 93 Ca -0.08 0.02 -0.03 0.00 -0.22 0.00 0.00 54.13 53.82 2dj0 s LEU 93 Cb -0.11 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.52 2dj0 s LEU 93 CO -0.00 0.04 -0.05 -0.36 -1.32 0.00 0.00 176.35 174.65 2dj0 s PHE 94 N 1.23 2.95 -0.25 5.38 0.08 -0.91 -0.23 117.98 126.21 2dj0 s PHE 94 Ca 0.06 -1.00 0.02 0.00 0.12 0.00 0.00 56.93 56.14 2dj0 s PHE 94 Cb -0.14 -2.09 0.06 0.00 -0.57 0.00 0.00 43.02 40.28 2dj0 s PHE 94 CO 0.05 -0.57 -0.08 -0.65 -0.10 0.00 0.00 175.22 173.87 2dj0 s GLN 95 N 1.46 1.96 -0.88 0.44 -0.21 -0.40 -2.08 119.66 119.96 2dj0 s GLN 95 Ca 0.06 -1.24 0.00 0.00 0.02 0.00 0.00 55.36 54.20 2dj0 s GLN 95 Cb -0.14 -2.78 0.00 0.00 1.00 0.00 0.00 33.01 31.08 2dj0 s GLN 95 CO -0.04 -0.60 0.00 0.41 -2.12 0.00 0.00 175.29 172.94 2dj0 n GLY 96 N 4.51 0.19 2.03 3.09 0.00 -0.52 -2.91 105.19 111.59 2dj0 n GLY 96 Ca -0.12 -0.50 -0.01 0.00 0.00 0.00 0.00 46.02 45.39 2dj0 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dj0 n GLY 97 N -1.16 0.34 2.83 -0.02 0.00 -1.24 -4.68 105.19 101.26 2dj0 n GLY 97 Ca -0.11 -0.87 -0.16 0.00 0.00 0.00 0.00 46.02 44.88 2dj0 n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dj0 s LYS 98 N -3.73 0.20 -0.84 1.61 1.02 -1.15 -5.07 119.74 111.78 2dj0 s LYS 98 Ca 0.00 0.06 -0.25 0.00 0.02 0.00 0.00 55.97 55.79 2dj0 s LYS 98 Cb 0.00 -0.35 -0.10 0.00 -0.52 0.00 0.00 37.83 36.86 2dj0 s LYS 98 CO 0.00 -0.09 2.22 -2.00 -0.92 0.00 0.00 175.35 174.55 2dj0 s GLU 99 N 0.75 1.99 0.11 1.68 2.12 -1.26 -1.27 118.70 122.82 2dj0 s GLU 99 Ca -0.07 0.15 -0.23 0.00 0.36 0.00 0.00 54.97 55.18 2dj0 s GLU 99 Cb -0.10 -4.90 -0.08 0.00 0.26 0.00 0.00 34.13 29.31 2dj0 s GLU 99 CO -0.02 -4.03 1.69 0.00 -0.54 0.00 0.00 175.26 172.37 2dj0 h ALA 100 N 12.08 -0.08 -2.41 6.30 0.00 -0.94 -3.47 119.26 130.74 2dj0 h ALA 100 Ca 0.04 0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.10 2dj0 h ALA 100 Cb 1.00 0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.87 2dj0 h ALA 100 CO 1.09 -0.58 0.45 0.00 0.00 0.00 0.00 179.25 180.21 2dj0 s MET 101 N -6.16 1.11 0.09 0.00 0.00 -1.20 -5.02 119.30 108.12 2dj0 s MET 101 Ca -0.14 -0.54 -0.14 0.00 0.00 0.00 0.00 55.69 54.87 2dj0 s MET 101 Cb 0.08 0.42 0.02 0.00 0.00 0.00 0.00 34.83 35.36 2dj0 s MET 101 CO 0.67 -0.50 0.33 -0.98 0.00 0.00 0.00 175.02 174.53 2dj0 s ARG 102 N -3.30 0.93 -0.06 3.16 1.70 -1.26 -0.78 118.95 119.34 2dj0 s ARG 102 Ca 0.09 -0.68 -0.10 0.00 -0.47 0.00 0.00 55.73 54.57 2dj0 s ARG 102 Cb -0.02 0.40 0.02 0.00 -0.57 0.00 0.00 34.95 34.79 2dj0 s ARG 102 CO -0.02 -0.33 0.25 1.03 -1.08 0.00 0.00 175.30 175.14 2dj0 s ARG 103 N -3.36 0.44 0.71 3.89 1.81 -0.73 -3.95 118.95 117.76 2dj0 s ARG 103 Ca 0.01 0.06 -0.13 0.00 -1.72 0.00 0.00 55.73 53.94 2dj0 s ARG 103 Cb 0.02 0.20 0.03 0.00 -0.45 0.00 0.00 34.95 34.74 2dj0 s ARG 103 CO -0.09 -0.09 1.10 -1.25 -0.68 0.00 0.00 175.30 174.29 2dj0 s PRO 104 N -0.57 2.55 0.44 3.54 0.04 -1.26 -2.38 135.00 137.37 2dj0 s PRO 104 Ca -0.07 1.29 -0.23 0.00 0.04 0.00 0.00 61.00 62.04 2dj0 s PRO 104 Cb -0.04 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.49 2dj0 s PRO 104 CO 0.02 -1.43 1.08 -0.65 0.04 0.00 0.00 177.00 176.05 2dj0 s GLN 105 N -4.46 3.93 -0.15 4.56 -0.21 -1.25 -4.74 119.66 117.33 2dj0 s GLN 105 Ca 0.64 1.55 -0.15 0.00 0.02 0.00 0.00 55.36 57.42 2dj0 s GLN 105 Cb -0.19 -2.37 -0.04 0.00 1.00 0.00 0.00 33.01 31.40 2dj0 s GLN 105 CO 0.48 -0.35 0.36 0.42 -2.12 0.00 0.00 175.29 174.08 2dj0 s ILE 106 N -1.71 5.26 0.84 1.08 -1.09 -1.26 -0.77 121.20 123.55 2dj0 s ILE 106 Ca 0.62 0.68 -0.12 0.00 -2.23 0.00 0.00 60.65 59.61 2dj0 s ILE 106 Cb -0.22 -3.70 0.10 0.00 -1.58 0.00 0.00 42.46 37.06 2dj0 s ILE 106 CO 0.27 0.35 1.10 -0.62 -1.23 0.00 0.00 174.94 174.82 2dj0 s ASP 107 N 0.60 4.03 0.15 3.58 2.15 0.10 -4.87 116.67 122.41 2dj0 s ASP 107 Ca 0.19 1.31 -0.26 0.00 0.43 0.00 0.00 52.55 54.23 2dj0 s ASP 107 Cb -0.14 -2.01 -0.00 0.00 -0.30 0.00 0.00 42.92 40.48 2dj0 s ASP 107 CO 0.06 -2.26 1.60 0.50 -0.17 0.00 0.00 175.17 174.90 2dj0 h LYS 108 N -1.29 -0.35 -0.63 4.34 3.64 -1.98 -1.31 116.57 118.99 2dj0 h LYS 108 Ca -0.48 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.04 2dj0 h LYS 108 Cb 1.28 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 33.09 2dj0 h LYS 108 CO 0.58 -0.23 0.17 0.87 -2.27 0.00 0.00 179.45 178.57 2dj0 h LYS 109 N -0.36 0.29 0.00 1.90 6.56 -2.05 -3.45 116.57 119.46 2dj0 h LYS 109 Ca 0.12 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.69 2dj0 h LYS 109 Cb 0.56 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.16 2dj0 h LYS 109 CO -0.45 0.19 0.00 0.41 -2.06 0.00 0.00 179.45 177.55 2dj0 n GLY 110 N -1.32 0.65 3.09 3.86 0.00 -0.49 -5.16 105.19 105.82 2dj0 n GLY 110 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 2dj0 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dj0 s ARG 111 N 0.00 1.12 -0.07 1.61 1.81 -1.25 -4.88 118.95 117.29 2dj0 s ARG 111 Ca 0.00 -0.48 -0.30 0.00 -1.72 0.00 0.00 55.73 53.24 2dj0 s ARG 111 Cb 0.00 -1.07 -0.04 0.00 -0.45 0.00 0.00 34.95 33.39 2dj0 s ARG 111 CO 0.00 0.27 1.45 0.00 -0.68 0.00 0.00 175.30 176.35 2dj0 s ALA 112 N -0.26 3.62 0.23 2.13 0.00 -1.26 -0.72 121.76 125.50 2dj0 s ALA 112 Ca 0.04 0.78 -0.30 0.00 0.00 0.00 0.00 51.96 52.48 2dj0 s ALA 112 Cb -0.06 -3.66 -0.10 0.00 0.00 0.00 0.00 23.12 19.31 2dj0 s ALA 112 CO -0.00 -1.16 1.43 0.08 0.00 0.00 0.00 175.76 176.10 2dj0 s VAL 113 N 3.30 2.75 -0.72 0.00 1.01 0.05 -4.87 120.40 121.92 2dj0 s VAL 113 Ca 0.65 0.62 -0.26 0.00 0.00 0.00 0.00 61.98 62.99 2dj0 s VAL 113 Cb -0.29 -3.39 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 2dj0 s VAL 113 CO 0.24 0.09 2.25 -0.55 0.00 0.00 0.00 175.10 177.13 2dj0 s SER 114 N 0.43 4.45 -0.02 3.32 0.15 -1.26 -4.59 113.70 116.17 2dj0 s SER 114 Ca 0.60 0.20 0.04 0.00 0.70 0.00 0.00 55.95 57.48 2dj0 s SER 114 Cb -0.41 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.33 2dj0 s SER 114 CO 0.41 -3.22 -0.12 0.86 1.20 0.00 0.00 173.24 172.38 2dj0 s TRP 115 N 12.49 2.76 0.38 3.44 -0.00 -1.26 -5.11 118.94 131.65 2dj0 s TRP 115 Ca 0.86 -0.11 -0.25 0.00 -0.00 0.00 0.00 56.10 56.59 2dj0 s TRP 115 Cb -0.13 -1.61 -0.09 0.00 -0.00 0.00 0.00 33.47 31.65 2dj0 s TRP 115 CO 0.12 0.27 1.14 0.99 -0.00 0.00 0.00 176.95 179.47 2dj0 s THR 116 N -0.84 3.30 -0.50 5.86 2.01 -1.26 -5.00 115.64 119.21 2dj0 s THR 116 Ca 0.14 1.10 -0.07 0.00 0.31 0.00 0.00 61.69 63.16 2dj0 s THR 116 Cb -0.11 -3.62 0.13 0.00 0.01 0.00 0.00 72.50 68.91 2dj0 s THR 116 CO 0.03 0.11 0.35 -0.36 -0.69 0.00 0.00 174.62 174.05 2dj0 s PHE 117 N -1.43 3.48 0.12 4.92 0.08 -1.26 -4.89 117.98 119.01 2dj0 s PHE 117 Ca 0.56 -2.12 -0.08 0.00 0.12 0.00 0.00 56.93 55.40 2dj0 s PHE 117 Cb -0.29 -3.42 -0.01 0.00 -0.57 0.00 0.00 43.02 38.74 2dj0 s PHE 117 CO 0.37 -0.97 0.22 -1.54 -0.10 0.00 0.00 175.22 173.19 2dj0 s SER 118 N 2.19 0.11 0.15 1.36 1.04 -1.26 -5.05 113.70 112.24 2dj0 s SER 118 Ca 0.08 -0.79 -0.11 0.00 0.48 0.00 0.00 55.95 55.61 2dj0 s SER 118 Cb -0.24 0.38 0.02 0.00 0.10 0.00 0.00 66.02 66.27 2dj0 s SER 118 CO -0.02 -0.80 1.58 -0.08 0.98 0.00 0.00 173.24 174.90 2dj0 h GLU 119 N 2.68 0.93 -0.75 4.02 4.81 -1.97 0.31 114.58 124.61 2dj0 h GLU 119 Ca -0.33 -0.34 -0.04 0.00 -0.13 0.00 0.00 59.36 58.52 2dj0 h GLU 119 Cb 1.21 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.49 2dj0 h GLU 119 CO 0.53 1.00 0.31 1.05 -0.73 0.00 0.00 179.01 181.17 2dj0 h GLU 120 N 0.79 1.10 -0.06 1.92 4.11 -1.99 0.61 114.58 121.06 2dj0 h GLU 120 Ca 0.13 -0.18 -0.25 0.00 0.07 0.00 0.00 59.36 59.13 2dj0 h GLU 120 Cb 0.63 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 29.71 2dj0 h GLU 120 CO 0.04 0.88 -0.94 -0.91 0.07 0.00 0.00 179.01 178.15 2dj0 h ASN 121 N 1.08 0.93 0.48 3.06 2.35 -1.90 -2.77 115.58 118.81 2dj0 h ASN 121 Ca 0.25 -0.70 -0.02 0.00 -0.55 0.00 0.00 56.30 55.28 2dj0 h ASN 121 Cb 0.18 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.28 2dj0 h ASN 121 CO -0.02 1.49 -0.23 0.58 -1.65 0.00 0.00 177.43 177.60 2dj0 h VAL 122 N 0.45 0.45 -0.84 2.81 2.07 -0.72 0.21 116.25 120.68 2dj0 h VAL 122 Ca -0.10 -0.38 0.12 0.00 0.82 0.00 0.00 66.70 67.17 2dj0 h VAL 122 Cb 1.59 0.60 -0.08 0.00 -1.52 0.00 0.00 31.29 31.87 2dj0 h VAL 122 CO 0.19 0.06 0.45 0.40 0.02 0.00 0.00 177.57 178.69 2dj0 h ILE 123 N -0.89 0.81 0.42 4.57 2.04 -1.00 0.15 117.51 123.60 2dj0 h ILE 123 Ca -0.07 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2dj0 h ILE 123 Cb 0.59 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2dj0 h ILE 123 CO 0.11 0.13 -0.20 -0.09 0.00 0.00 0.00 178.15 178.09 2dj0 h ARG 124 N 0.70 -0.55 -0.40 2.37 2.43 -1.44 0.89 114.38 118.38 2dj0 h ARG 124 Ca 0.44 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.71 2dj0 h ARG 124 Cb 0.53 0.12 -0.09 0.00 -0.42 0.00 0.00 29.97 30.12 2dj0 h ARG 124 CO -0.31 -0.36 -0.42 0.93 -1.51 0.00 0.00 179.97 178.30 2dj0 h GLU 125 N -0.94 -0.31 0.00 0.20 4.39 -0.42 0.16 114.58 117.66 2dj0 h GLU 125 Ca -0.06 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2dj0 h GLU 125 Cb 0.43 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2dj0 h GLU 125 CO 0.10 -0.21 0.00 0.74 -1.16 0.00 0.00 179.01 178.48 2dj0 h PHE 126 N -0.32 0.00 -4.53 4.33 -1.00 -0.82 -3.47 116.94 111.13 2dj0 h PHE 126 Ca 0.14 0.00 -0.37 0.00 2.81 0.00 0.00 57.97 60.55 2dj0 h PHE 126 Cb 0.58 0.00 0.08 0.00 3.61 0.00 0.00 35.95 40.22 2dj0 h PHE 126 CO -0.61 0.00 -0.57 0.09 -1.61 0.00 0.00 178.31 175.61 2dj0 n ASN 127 N -3.03 -5.82 -0.07 2.17 4.13 0.29 -4.80 115.26 108.13 2dj0 n ASN 127 Ca 0.02 -0.34 -0.12 0.00 1.68 0.00 0.00 54.58 55.83 2dj0 n ASN 127 Cb 0.40 -4.57 -0.06 0.00 -1.54 0.00 0.00 39.78 34.00 2dj0 n ASN 127 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2dj0 h LEU 128 N -1.68 -1.48 -1.70 3.41 3.38 -1.30 0.28 115.31 116.22 2dj0 h LEU 128 Ca -0.49 0.21 0.47 0.00 0.09 0.00 0.00 57.88 58.15 2dj0 h LEU 128 Cb 1.33 0.62 -0.10 0.00 0.09 0.00 0.00 40.66 42.60 2dj0 h LEU 128 CO 0.51 -0.41 1.06 0.78 0.09 0.00 0.00 178.44 180.47 2dj0 h ASN 129 N -0.42 0.12 0.08 -0.43 2.35 -1.82 0.39 115.58 115.85 2dj0 h ASN 129 Ca 0.10 0.07 -0.18 0.00 -0.55 0.00 0.00 56.30 55.74 2dj0 h ASN 129 Cb 0.61 0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.04 2dj0 h ASN 129 CO -0.50 -0.09 -0.87 -0.33 -1.65 0.00 0.00 177.43 173.99 2dj0 h GLU 130 N 0.05 0.17 0.00 0.81 4.39 -0.77 -2.32 114.58 116.90 2dj0 h GLU 130 Ca 0.83 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 60.24 2dj0 h GLU 130 Cb 2.95 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 31.71 2dj0 h GLU 130 CO -0.21 1.14 0.00 1.28 -1.16 0.00 0.00 179.01 180.05 2dj0 n LEU 131 N -4.22 0.00 -1.85 1.33 4.77 0.13 -2.19 117.00 114.96 2dj0 n LEU 131 Ca -0.19 0.84 -0.10 0.00 -0.03 0.00 0.00 56.01 56.53 2dj0 n LEU 131 Cb 0.74 -0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 41.44 2dj0 n LEU 131 CO 0.38 -0.34 1.31 -0.24 -1.33 0.00 0.00 177.39 177.17 2dj0 n SER 132 N -1.92 5.66 -1.21 -1.43 2.88 -0.76 -4.96 113.62 111.88 2dj0 n SER 132 Ca 0.00 -2.65 0.14 0.00 -1.33 0.00 0.00 58.87 55.03 2dj0 n SER 132 Cb 0.00 -1.22 -0.05 0.00 -0.75 0.00 0.00 64.21 62.19 2dj0 n SER 132 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dj0 n GLY 133 N 1.53 -2.01 3.77 0.46 0.00 -0.93 -4.83 105.19 103.18 2dj0 n GLY 133 Ca 0.25 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 2dj0 n GLY 133 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dj0 s PRO 134 N -3.34 2.60 0.04 1.61 0.04 -0.88 -4.37 135.00 130.71 2dj0 s PRO 134 Ca 0.00 1.31 -0.26 0.00 0.04 0.00 0.00 61.00 62.09 2dj0 s PRO 134 Cb 0.00 -1.93 -0.17 0.00 0.04 0.00 0.00 34.50 32.44 2dj0 s PRO 134 CO 0.00 -1.39 1.46 0.77 0.04 0.00 0.00 177.00 177.88 2dj0 h SER 135 N -0.39 -0.29 -0.80 6.66 0.02 -1.88 -3.44 113.55 113.44 2dj0 h SER 135 Ca -0.46 -0.12 -0.67 0.00 -0.84 0.00 0.00 61.79 59.70 2dj0 h SER 135 Cb 1.24 0.07 0.02 0.00 0.14 0.00 0.00 62.40 63.88 2dj0 h SER 135 CO 0.53 -0.04 0.29 -1.54 -1.14 0.00 0.00 176.83 174.92 2dj0 n SER 136 N -5.15 0.45 0.00 3.07 3.41 -1.26 -5.24 113.62 108.90 2dj0 n SER 136 Ca -0.09 0.94 0.00 0.00 -0.26 0.00 0.00 58.87 59.45 2dj0 n SER 136 Cb 0.22 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 2dj0 n SER 136 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49