#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oj2 s PRO 2 N 0.00 4.21 -0.13 1.61 0.04 -1.26 -5.05 135.00 134.42 2oj2 s PRO 2 Ca 0.00 1.55 0.02 0.00 0.04 0.00 0.00 61.00 62.61 2oj2 s PRO 2 Cb 0.00 -2.61 0.01 0.00 0.04 0.00 0.00 34.50 31.94 2oj2 s PRO 2 CO 0.00 -0.11 -0.19 -0.51 0.04 0.00 0.00 177.00 176.23 2oj2 s LEU 3 N -2.51 1.93 0.08 -3.56 1.43 -1.26 -5.12 118.68 109.66 2oj2 s LEU 3 Ca 0.56 -0.53 0.09 0.00 -1.03 0.00 0.00 54.13 53.22 2oj2 s LEU 3 Cb -0.23 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.67 2oj2 s LEU 3 CO 0.29 0.04 -0.20 -0.83 0.23 0.00 0.00 176.35 175.88 2oj2 s GLY 4 N 0.94 1.59 -0.18 -3.19 0.00 -1.26 -5.13 107.32 100.09 2oj2 s GLY 4 Ca -0.06 -1.29 -0.28 0.00 0.00 0.00 0.00 44.72 43.08 2oj2 s GLY 4 CO -0.03 -1.22 0.89 -0.56 0.00 0.00 0.00 173.10 172.18 2oj2 s SER 5 N -1.72 -0.51 1.09 1.64 0.01 -1.26 -5.18 113.70 107.78 2oj2 s SER 5 Ca 0.15 0.73 -0.14 0.00 1.31 0.00 0.00 55.95 58.00 2oj2 s SER 5 Cb -0.10 0.65 0.20 0.00 0.21 0.00 0.00 66.02 66.98 2oj2 s SER 5 CO 0.06 -0.35 0.91 -0.81 0.41 0.00 0.00 173.24 173.47 2oj2 n PRO 6 N 1.39 -1.79 0.00 12.44 -0.04 -1.26 -5.09 135.00 140.65 2oj2 n PRO 6 Ca -0.13 -1.43 0.00 0.00 -0.04 0.00 0.00 63.50 61.90 2oj2 n PRO 6 Cb 0.57 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 2oj2 n PRO 6 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2oj2 n GLY 7 N -2.23 0.68 3.76 0.55 0.00 -1.26 -5.04 105.19 101.65 2oj2 n GLY 7 Ca 0.12 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2oj2 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2oj2 s PRO 8 N 0.00 -0.41 -0.41 1.61 0.04 -1.26 -5.05 135.00 129.52 2oj2 s PRO 8 Ca 0.00 -0.29 0.02 0.00 0.04 0.00 0.00 61.00 60.77 2oj2 s PRO 8 Cb 0.00 -1.71 0.12 0.00 0.04 0.00 0.00 34.50 32.95 2oj2 s PRO 8 CO 0.00 -3.14 0.18 1.21 0.04 0.00 0.00 177.00 175.30 2oj2 s ASN 9 N -4.44 4.00 -0.24 6.66 2.47 -1.26 -5.07 114.94 117.06 2oj2 s ASN 9 Ca 0.73 -2.39 -0.29 0.00 0.42 0.00 0.00 52.86 51.33 2oj2 s ASN 9 Cb -0.06 -1.17 0.17 0.00 -1.45 0.00 0.00 41.25 38.74 2oj2 s ASN 9 CO 0.55 -0.31 1.22 -0.94 -3.72 0.00 0.00 177.10 173.89 2oj2 s SER 10 N 0.63 -0.17 -0.34 -4.21 1.04 -1.26 -5.13 113.70 104.26 2oj2 s SER 10 Ca 0.15 0.20 -0.07 0.00 0.48 0.00 0.00 55.95 56.71 2oj2 s SER 10 Cb -0.22 0.16 0.20 0.00 0.10 0.00 0.00 66.02 66.25 2oj2 s SER 10 CO -0.07 -0.15 1.04 -2.28 0.98 0.00 0.00 173.24 172.76 2oj2 s HIS 11 N -0.97 -0.45 0.06 5.02 5.04 -1.26 -5.17 115.29 117.57 2oj2 s HIS 11 Ca 0.05 -0.02 -0.05 0.00 -1.54 0.00 0.00 55.06 53.50 2oj2 s HIS 11 Cb -0.01 0.09 -0.02 0.00 0.04 0.00 0.00 32.58 32.67 2oj2 s HIS 11 CO -0.05 -0.33 0.07 -0.80 -2.34 0.00 0.00 174.74 171.30 2oj2 s ASN 12 N 1.56 0.31 0.18 9.88 -0.87 -1.26 -5.18 114.94 119.56 2oj2 s ASN 12 Ca 0.18 -0.81 -0.04 0.00 -1.57 0.00 0.00 52.86 50.62 2oj2 s ASN 12 Cb 0.06 0.26 -0.03 0.00 -0.02 0.00 0.00 41.25 41.52 2oj2 s ASN 12 CO -0.13 -0.64 0.19 -0.44 -2.57 0.00 0.00 177.10 173.51 2oj2 s SER 13 N -2.82 0.14 -0.07 -1.22 0.01 -1.26 -5.18 113.70 103.31 2oj2 s SER 13 Ca 0.05 -1.16 -0.31 0.00 1.31 0.00 0.00 55.95 55.84 2oj2 s SER 13 Cb 0.06 0.40 0.11 0.00 0.21 0.00 0.00 66.02 66.80 2oj2 s SER 13 CO -0.10 -0.86 1.04 0.21 0.41 0.00 0.00 173.24 173.94 2oj2 s ASN 14 N -3.06 -0.25 0.52 2.44 3.84 -1.26 -5.16 114.94 112.01 2oj2 s ASN 14 Ca 0.27 -0.04 -0.20 0.00 0.21 0.00 0.00 52.86 53.10 2oj2 s ASN 14 Cb 0.05 0.29 -0.06 0.00 -0.55 0.00 0.00 41.25 40.98 2oj2 s ASN 14 CO 0.06 -0.47 1.14 0.42 -2.79 0.00 0.00 177.10 175.46 2oj2 s THR 15 N -2.82 3.13 0.00 -5.21 -4.23 -1.26 -5.04 115.64 100.20 2oj2 s THR 15 Ca 0.08 0.74 0.00 0.00 -1.18 0.00 0.00 61.69 61.33 2oj2 s THR 15 Cb -0.01 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.51 2oj2 s THR 15 CO -0.06 -0.11 0.00 -0.81 -0.54 0.00 0.00 174.62 173.10 2oj2 n PRO 16 N -1.07 0.68 0.14 3.99 -0.04 -1.26 -4.96 135.00 132.48 2oj2 n PRO 16 Ca 0.10 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.45 2oj2 n PRO 16 Cb 0.50 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.90 2oj2 n PRO 16 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2oj2 h GLY 17 N -0.05 -1.13 -3.73 0.55 0.00 -2.09 -3.48 103.07 93.14 2oj2 h GLY 17 Ca 0.00 0.54 0.11 0.00 0.00 0.00 0.00 47.33 47.98 2oj2 h GLY 17 CO 0.00 -0.34 -1.07 1.39 0.00 0.00 0.00 176.54 176.52 2oj2 n ILE 18 N -4.40 -2.33 -1.32 2.60 5.41 -1.26 -4.74 119.36 113.33 2oj2 n ILE 18 Ca -0.07 1.31 -0.46 0.00 1.00 0.00 0.00 62.75 64.54 2oj2 n ILE 18 Cb 0.29 -2.14 -0.03 0.00 -0.71 0.00 0.00 39.64 37.05 2oj2 n ILE 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2oj2 n ARG 19 N -3.17 0.00 -4.40 0.38 3.00 -1.26 -4.96 116.66 106.25 2oj2 n ARG 19 Ca -0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 57.85 57.59 2oj2 n ARG 19 Cb 0.55 -0.96 -0.10 0.00 0.00 0.00 0.00 32.46 31.94 2oj2 n ARG 19 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2oj2 s GLU 20 N -0.88 1.49 -0.30 5.56 2.02 -1.26 -5.14 118.70 120.20 2oj2 s GLU 20 Ca 0.61 -1.65 -0.17 0.00 0.02 0.00 0.00 54.97 53.79 2oj2 s GLU 20 Cb -0.89 -1.47 0.19 0.00 0.10 0.00 0.00 34.13 32.06 2oj2 s GLU 20 CO 0.52 0.27 1.18 0.00 0.02 0.00 0.00 175.26 177.26 2oj2 s ALA 21 N -2.61 -2.77 0.16 5.21 0.00 -1.26 -5.05 121.76 115.43 2oj2 s ALA 21 Ca 0.25 1.98 -0.18 0.00 0.00 0.00 0.00 51.96 54.01 2oj2 s ALA 21 Cb -0.03 -2.03 0.06 0.00 0.00 0.00 0.00 23.12 21.12 2oj2 s ALA 21 CO 0.11 -0.58 1.68 0.78 0.00 0.00 0.00 175.76 177.75 2oj2 h GLY 22 N 6.11 0.25 0.00 0.00 0.00 -2.00 -3.44 103.07 103.98 2oj2 h GLY 22 Ca -0.22 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2oj2 h GLY 22 CO 0.16 -0.13 0.00 1.44 0.00 0.00 0.00 176.54 178.01 2oj2 n SER 23 N -5.28 0.00 -2.95 0.19 7.64 -1.26 -3.93 113.62 108.03 2oj2 n SER 23 Ca 0.01 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.92 2oj2 n SER 23 Cb 0.20 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 2oj2 n SER 23 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2oj2 s GLU 24 N 0.00 0.17 -0.29 1.43 -1.05 -1.26 -5.12 118.70 112.58 2oj2 s GLU 24 Ca 0.00 0.03 0.04 0.00 -0.15 0.00 0.00 54.97 54.89 2oj2 s GLU 24 Cb 0.00 0.04 0.18 0.00 -0.44 0.00 0.00 34.13 33.92 2oj2 s GLU 24 CO 0.00 -0.28 0.52 -0.51 0.95 0.00 0.00 175.26 175.94 2oj2 s ASP 25 N 2.41 -0.89 -0.76 0.83 1.11 -1.25 -5.05 116.67 113.06 2oj2 s ASP 25 Ca 0.21 0.01 -0.23 0.00 0.18 0.00 0.00 52.55 52.71 2oj2 s ASP 25 Cb 0.01 1.70 0.07 0.00 1.07 0.00 0.00 42.92 45.76 2oj2 s ASP 25 CO -0.18 -0.32 1.13 -0.63 1.18 0.00 0.00 175.17 176.35 2oj2 s ILE 26 N 2.73 4.18 -0.08 0.77 -1.09 -1.23 -4.92 121.20 121.56 2oj2 s ILE 26 Ca 0.10 -0.39 -0.24 0.00 -2.23 0.00 0.00 60.65 57.89 2oj2 s ILE 26 Cb -0.11 -4.80 -0.03 0.00 -1.58 0.00 0.00 42.46 35.93 2oj2 s ILE 26 CO -0.27 -1.63 0.73 -0.63 -1.23 0.00 0.00 174.94 171.91 2oj2 s ILE 27 N 4.40 5.02 -0.04 2.92 -1.09 -1.26 -0.04 121.20 131.10 2oj2 s ILE 27 Ca 0.30 1.49 0.00 0.00 -2.23 0.00 0.00 60.65 60.21 2oj2 s ILE 27 Cb -0.11 -4.06 0.02 0.00 -1.58 0.00 0.00 42.46 36.73 2oj2 s ILE 27 CO 0.06 0.22 -0.02 0.68 -1.23 0.00 0.00 174.94 174.65 2oj2 s VAL 28 N 1.00 0.37 0.05 2.92 -7.23 -0.99 -0.52 120.40 116.00 2oj2 s VAL 28 Ca 0.38 0.00 -0.21 0.00 -1.81 0.00 0.00 61.98 60.35 2oj2 s VAL 28 Cb -0.18 -0.45 -0.06 0.00 0.56 0.00 0.00 36.38 36.25 2oj2 s VAL 28 CO 0.18 0.20 0.61 0.54 -0.31 0.00 0.00 175.10 176.32 2oj2 s VAL 29 N 1.17 4.78 -0.04 1.32 0.11 -0.70 -2.38 120.40 124.65 2oj2 s VAL 29 Ca -0.07 1.29 -0.30 0.00 -2.93 0.00 0.00 61.98 59.96 2oj2 s VAL 29 Cb -0.14 -3.94 -0.06 0.00 -1.53 0.00 0.00 36.38 30.71 2oj2 s VAL 29 CO -0.02 0.49 1.65 0.00 -3.33 0.00 0.00 175.10 173.89 2oj2 s ALA 30 N -0.67 3.62 0.19 1.54 0.00 -0.00 -0.29 121.76 126.14 2oj2 s ALA 30 Ca 0.31 0.97 0.13 0.00 0.00 0.00 0.00 51.96 53.37 2oj2 s ALA 30 Cb -0.19 -3.74 0.35 0.00 0.00 0.00 0.00 23.12 19.55 2oj2 s ALA 30 CO 0.19 -1.35 1.59 -0.07 0.00 0.00 0.00 175.76 176.12 2oj2 h LEU 31 N 9.99 0.00 -8.52 0.00 3.38 0.23 0.10 115.31 120.49 2oj2 h LEU 31 Ca -0.40 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.36 2oj2 h LEU 31 Cb 1.18 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.80 2oj2 h LEU 31 CO 0.95 0.59 -0.50 -0.31 0.09 0.00 0.00 178.44 179.25 2oj2 s TYR 32 N -3.43 1.00 0.16 1.13 2.02 -1.22 -4.84 117.35 112.16 2oj2 s TYR 32 Ca -0.00 -1.25 -0.30 0.00 -0.37 0.00 0.00 57.07 55.15 2oj2 s TYR 32 Cb 0.11 -0.39 -0.07 0.00 -0.40 0.00 0.00 41.96 41.21 2oj2 s TYR 32 CO 0.75 -0.73 1.05 0.16 -1.57 0.00 0.00 175.55 175.20 2oj2 s ASP 33 N -3.14 7.36 0.00 2.29 1.47 -1.26 -3.29 116.67 120.10 2oj2 s ASP 33 Ca 0.35 1.98 0.02 0.00 1.18 0.00 0.00 52.55 56.08 2oj2 s ASP 33 Cb 0.05 -2.60 -0.01 0.00 -0.34 0.00 0.00 42.92 40.03 2oj2 s ASP 33 CO 0.12 -0.15 -0.05 -0.47 0.68 0.00 0.00 175.17 175.29 2oj2 s TYR 34 N -0.18 0.46 -0.44 2.11 5.04 0.00 -4.90 117.35 119.45 2oj2 s TYR 34 Ca 0.48 -0.13 0.10 0.00 -2.44 0.00 0.00 57.07 55.08 2oj2 s TYR 34 Cb -0.27 -0.30 0.36 0.00 0.35 0.00 0.00 41.96 42.11 2oj2 s TYR 34 CO 0.33 -0.02 0.85 0.39 -1.34 0.00 0.00 175.55 175.77 2oj2 n GLU 35 N 2.78 1.90 -3.05 4.97 1.02 -1.26 -0.75 120.64 126.25 2oj2 n GLU 35 Ca -0.14 -3.93 -0.03 0.00 -0.02 0.00 0.00 57.16 53.05 2oj2 n GLU 35 Cb 0.58 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 2oj2 n GLU 35 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2oj2 n ALA 36 N 0.01 -1.96 -0.01 0.62 0.00 -1.24 -4.86 120.51 113.08 2oj2 n ALA 36 Ca 0.26 0.02 -0.13 0.00 0.00 0.00 0.00 53.44 53.60 2oj2 n ALA 36 Cb 0.59 -0.58 -0.09 0.00 0.00 0.00 0.00 19.45 19.38 2oj2 n ALA 36 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2oj2 h ILE 37 N 3.33 1.31 -0.78 0.00 2.04 -1.92 -3.45 117.51 118.05 2oj2 h ILE 37 Ca -0.04 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2oj2 h ILE 37 Cb 0.96 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 2oj2 h ILE 37 CO 0.01 0.25 0.00 1.41 0.00 0.00 0.00 178.15 179.82 2oj2 n HIS 38 N -4.86 0.00 -0.11 1.37 -0.00 -1.26 -5.06 115.22 105.29 2oj2 n HIS 38 Ca -0.08 0.00 -0.17 0.00 -0.00 0.00 0.00 57.72 57.47 2oj2 n HIS 38 Cb 0.22 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 30.15 2oj2 n HIS 38 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2oj2 n HIS 39 N 0.00 0.01 -2.06 4.41 -0.00 -1.26 -4.65 115.22 111.66 2oj2 n HIS 39 Ca 0.00 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.76 2oj2 n HIS 39 Cb 0.00 -0.70 0.00 0.00 -0.12 0.00 0.00 29.99 29.17 2oj2 n HIS 39 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 2oj2 n GLU 40 N -4.38 3.38 -3.68 1.57 2.13 -1.26 -4.86 120.64 113.54 2oj2 n GLU 40 Ca -0.30 -3.14 -0.11 0.00 0.66 0.00 0.00 57.16 54.26 2oj2 n GLU 40 Cb 0.67 -3.04 -0.06 0.00 0.27 0.00 0.00 31.44 29.27 2oj2 n GLU 40 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2oj2 s ASP 41 N 1.73 -0.22 0.15 4.31 1.11 -1.26 -4.13 116.67 118.36 2oj2 s ASP 41 Ca 0.44 -0.18 0.02 0.00 0.18 0.00 0.00 52.55 53.01 2oj2 s ASP 41 Cb 0.12 0.43 -0.04 0.00 1.07 0.00 0.00 42.92 44.50 2oj2 s ASP 41 CO -0.04 -0.73 0.28 -0.22 1.18 0.00 0.00 175.17 175.65 2oj2 s LEU 42 N -2.36 4.34 -0.11 1.23 2.96 0.86 -4.67 118.68 120.93 2oj2 s LEU 42 Ca -0.02 0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 54.06 2oj2 s LEU 42 Cb 0.01 -2.92 -0.03 0.00 0.50 0.00 0.00 46.19 43.74 2oj2 s LEU 42 CO -0.07 0.05 -0.04 -0.94 -1.32 0.00 0.00 176.35 174.04 2oj2 s SER 43 N -3.20 4.84 0.35 3.68 1.04 -1.26 -3.63 113.70 115.51 2oj2 s SER 43 Ca 0.35 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.74 2oj2 s SER 43 Cb -0.11 -1.52 -0.00 0.00 0.10 0.00 0.00 66.02 64.49 2oj2 s SER 43 CO 0.28 0.28 0.44 2.22 0.98 0.00 0.00 173.24 177.44 2oj2 n PHE 44 N 2.81 -1.30 -4.34 5.02 1.16 0.07 -4.92 117.46 115.96 2oj2 n PHE 44 Ca -0.18 -2.48 -0.22 0.00 -1.87 0.00 0.00 57.45 52.70 2oj2 n PHE 44 Cb 0.53 0.49 -0.11 0.00 -1.61 0.00 0.00 39.48 38.78 2oj2 n PHE 44 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 2oj2 s GLN 45 N -2.94 1.30 -0.32 3.97 -0.21 -1.26 -0.82 119.66 119.39 2oj2 s GLN 45 Ca 0.32 -1.43 -0.29 0.00 0.02 0.00 0.00 55.36 53.98 2oj2 s GLN 45 Cb -0.00 -1.36 -0.07 0.00 1.00 0.00 0.00 33.01 32.58 2oj2 s GLN 45 CO 0.23 0.27 2.27 1.17 -2.12 0.00 0.00 175.29 177.11 2oj2 n LYS 46 N 0.24 1.56 0.00 2.91 4.81 -1.21 0.17 118.16 126.63 2oj2 n LYS 46 Ca -0.13 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 2oj2 n LYS 46 Cb 0.57 -3.09 0.00 0.00 0.02 0.00 0.00 35.03 32.53 2oj2 n LYS 46 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2oj2 n GLY 47 N 6.00 0.94 3.73 3.14 0.00 0.02 -4.94 105.19 114.08 2oj2 n GLY 47 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.95 2oj2 n GLY 47 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2oj2 s ASP 48 N -0.82 7.40 -0.17 1.61 -1.08 0.13 -4.70 116.67 119.03 2oj2 s ASP 48 Ca 0.00 1.68 -0.10 0.00 -0.52 0.00 0.00 52.55 53.61 2oj2 s ASP 48 Cb 0.00 -2.56 -0.05 0.00 -1.46 0.00 0.00 42.92 38.86 2oj2 s ASP 48 CO 0.00 -0.10 0.16 -1.10 0.52 0.00 0.00 175.17 174.65 2oj2 s GLN 49 N 0.28 4.06 0.06 4.34 -1.52 -1.26 -0.82 119.66 124.79 2oj2 s GLN 49 Ca 0.46 -0.14 0.07 0.00 -1.95 0.00 0.00 55.36 53.80 2oj2 s GLN 49 Cb -0.22 -3.37 -0.03 0.00 -0.22 0.00 0.00 33.01 29.17 2oj2 s GLN 49 CO 0.28 0.39 -0.18 -1.64 -0.25 0.00 0.00 175.29 173.88 2oj2 s MET 50 N 0.09 1.14 -0.68 2.91 -1.94 -1.00 -1.61 119.30 118.21 2oj2 s MET 50 Ca 0.11 -0.94 -0.19 0.00 -1.71 0.00 0.00 55.69 52.96 2oj2 s MET 50 Cb -0.12 -1.25 0.11 0.00 2.01 0.00 0.00 34.83 35.59 2oj2 s MET 50 CO 0.00 0.31 0.81 0.08 -0.01 0.00 0.00 175.02 176.21 2oj2 s VAL 51 N -0.95 4.81 -0.05 -6.03 1.01 -0.54 -2.34 120.40 116.32 2oj2 s VAL 51 Ca 0.05 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 60.60 2oj2 s VAL 51 Cb -0.09 -4.56 -0.07 0.00 0.00 0.00 0.00 36.38 31.66 2oj2 s VAL 51 CO 0.02 -1.23 1.89 -0.69 0.00 0.00 0.00 175.10 175.10 2oj2 s VAL 52 N 2.66 3.22 -0.23 2.92 1.01 0.94 -1.94 120.40 128.98 2oj2 s VAL 52 Ca 0.17 0.26 -0.16 0.00 0.00 0.00 0.00 61.98 62.25 2oj2 s VAL 52 Cb -0.19 -3.19 -0.11 0.00 0.00 0.00 0.00 36.38 32.89 2oj2 s VAL 52 CO 0.03 -0.05 -0.24 0.18 0.00 0.00 0.00 175.10 175.02 2oj2 n LEU 53 N 8.16 1.92 -4.36 3.92 4.77 0.13 -3.52 117.00 128.02 2oj2 n LEU 53 Ca 0.21 0.38 -0.31 0.00 -0.03 0.00 0.00 56.01 56.25 2oj2 n LEU 53 Cb 0.42 -0.83 -0.15 0.00 -2.33 0.00 0.00 43.42 40.53 2oj2 n LEU 53 CO 0.66 0.21 -0.54 -1.61 -1.33 0.00 0.00 177.39 174.78 2oj2 s GLU 54 N -2.56 2.18 -0.45 3.23 2.02 -1.00 -4.96 118.70 117.16 2oj2 s GLU 54 Ca -0.32 -0.89 0.03 0.00 0.02 0.00 0.00 54.97 53.81 2oj2 s GLU 54 Cb 0.09 -2.12 0.16 0.00 0.10 0.00 0.00 34.13 32.36 2oj2 s GLU 54 CO 0.47 0.57 0.33 -2.00 0.02 0.00 0.00 175.26 174.64 2oj2 s GLU 55 N -0.73 1.13 0.04 1.61 -6.30 -1.26 0.21 118.70 113.40 2oj2 s GLU 55 Ca 0.11 -2.15 -0.26 0.00 -2.50 0.00 0.00 54.97 50.17 2oj2 s GLU 55 Cb -0.10 -1.83 -0.14 0.00 0.00 0.00 0.00 34.13 32.06 2oj2 s GLU 55 CO -0.00 -1.31 1.37 1.03 0.02 0.00 0.00 175.26 176.37 2oj2 h SER 56 N 6.00 -0.79 0.00 -1.70 0.87 -1.98 -3.47 113.55 112.47 2oj2 h SER 56 Ca 0.17 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2oj2 h SER 56 Cb 0.90 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2oj2 h SER 56 CO 0.42 -0.56 0.00 0.61 -0.53 0.00 0.00 176.83 176.77 2oj2 n GLY 57 N -1.42 -0.45 0.04 5.77 0.00 -1.26 -5.06 105.19 102.81 2oj2 n GLY 57 Ca -0.12 0.13 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 2oj2 n GLY 57 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2oj2 n GLU 58 N -0.92 0.24 -2.36 1.61 -0.58 -1.26 -4.92 120.64 112.45 2oj2 n GLU 58 Ca 0.00 0.18 -0.42 0.00 -0.42 0.00 0.00 57.16 56.51 2oj2 n GLU 58 Cb 0.00 -1.02 -0.03 0.00 -0.57 0.00 0.00 31.44 29.82 2oj2 n GLU 58 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2oj2 s TRP 59 N -1.81 3.40 0.14 -0.32 0.52 -1.26 -2.96 118.94 116.64 2oj2 s TRP 59 Ca -0.12 1.27 0.11 0.00 0.02 0.00 0.00 56.10 57.38 2oj2 s TRP 59 Cb 0.02 -3.47 -0.04 0.00 -1.15 0.00 0.00 33.47 28.82 2oj2 s TRP 59 CO 0.17 -1.47 -0.25 -1.58 0.02 0.00 0.00 176.95 173.84 2oj2 s TRP 60 N 0.76 2.34 -0.67 -1.98 0.51 0.16 -3.97 118.94 116.10 2oj2 s TRP 60 Ca 0.58 -0.36 -0.19 0.00 -2.12 0.00 0.00 56.10 54.01 2oj2 s TRP 60 Cb -0.32 -1.25 0.12 0.00 -0.81 0.00 0.00 33.47 31.21 2oj2 s TRP 60 CO 0.31 0.37 0.80 0.21 -0.51 0.00 0.00 176.95 178.14 2oj2 s LYS 61 N -2.17 3.19 0.35 4.98 2.20 0.13 0.18 119.74 128.60 2oj2 s LYS 61 Ca 0.16 -1.45 0.09 0.00 -0.36 0.00 0.00 55.97 54.40 2oj2 s LYS 61 Cb -0.10 -4.38 -0.05 0.00 -1.51 0.00 0.00 37.83 31.79 2oj2 s LYS 61 CO 0.07 -1.58 0.04 0.00 -0.36 0.00 0.00 175.35 173.52 2oj2 s ALA 62 N 2.58 3.27 -0.13 3.13 0.00 -0.97 0.20 121.76 129.84 2oj2 s ALA 62 Ca 0.16 -1.99 -0.00 0.00 0.00 0.00 0.00 51.96 50.13 2oj2 s ALA 62 Cb -0.19 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 2oj2 s ALA 62 CO 0.03 0.02 -0.12 0.50 0.00 0.00 0.00 175.76 176.19 2oj2 s ARG 63 N -3.75 3.35 0.17 0.00 3.00 -0.82 -2.29 118.95 118.60 2oj2 s ARG 63 Ca 0.36 -0.67 -0.32 0.00 -1.00 0.00 0.00 55.73 54.10 2oj2 s ARG 63 Cb 0.01 -2.64 -0.10 0.00 0.00 0.00 0.00 34.95 32.21 2oj2 s ARG 63 CO 0.20 0.25 1.63 0.45 0.00 0.00 0.00 175.30 177.83 2oj2 s SER 64 N 0.26 6.52 0.00 -2.12 0.15 -0.97 -1.46 113.70 116.08 2oj2 s SER 64 Ca -0.09 2.68 0.10 0.00 0.70 0.00 0.00 55.95 59.35 2oj2 s SER 64 Cb -0.15 -2.59 0.41 0.00 -1.71 0.00 0.00 66.02 61.97 2oj2 s SER 64 CO 0.05 -0.88 1.30 0.18 1.20 0.00 0.00 173.24 175.09 2oj2 n LEU 65 N 4.21 1.00 -0.00 3.45 4.32 -0.63 0.20 117.00 129.55 2oj2 n LEU 65 Ca 0.15 -0.48 0.02 0.00 -0.02 0.00 0.00 56.01 55.68 2oj2 n LEU 65 Cb 0.38 -0.11 -0.03 0.00 -1.62 0.00 0.00 43.42 42.04 2oj2 n LEU 65 CO 0.62 0.24 -0.25 0.00 -1.22 0.00 0.00 177.39 176.78 2oj2 n ALA 66 N -0.01 2.38 -1.74 -1.18 0.00 -1.26 -4.68 120.51 114.02 2oj2 n ALA 66 Ca 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2oj2 n ALA 66 Cb 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2oj2 n ALA 66 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2oj2 n THR 67 N -1.35 0.00 -2.49 0.00 -2.24 -1.15 -4.99 114.28 102.06 2oj2 n THR 67 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.70 2oj2 n THR 67 Cb 0.09 0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 2oj2 n THR 67 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2oj2 n ARG 68 N 0.00 -2.07 -1.35 -0.78 1.85 0.53 -4.83 116.66 110.02 2oj2 n ARG 68 Ca 0.00 0.03 -0.25 0.00 -1.00 0.00 0.00 57.85 56.63 2oj2 n ARG 68 Cb 0.59 -3.47 0.19 0.00 -1.05 0.00 0.00 32.46 28.71 2oj2 n ARG 68 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2oj2 n LYS 69 N -2.24 -1.73 -3.67 2.89 5.02 -1.16 -4.72 118.16 112.54 2oj2 n LYS 69 Ca 0.02 -1.65 -0.09 0.00 -2.02 0.00 0.00 58.31 54.57 2oj2 n LYS 69 Cb 0.37 -1.25 -0.10 0.00 -0.02 0.00 0.00 35.03 34.03 2oj2 n LYS 69 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2oj2 s GLU 70 N -5.34 0.36 -0.25 1.97 2.02 -1.26 -2.29 118.70 113.92 2oj2 s GLU 70 Ca 0.63 0.94 -0.37 0.00 0.02 0.00 0.00 54.97 56.19 2oj2 s GLU 70 Cb -0.03 0.18 0.15 0.00 0.10 0.00 0.00 34.13 34.53 2oj2 s GLU 70 CO 0.45 -0.21 1.38 0.20 0.02 0.00 0.00 175.26 177.10 2oj2 s GLY 71 N 2.08 -0.26 0.14 -1.39 0.00 -0.97 -4.88 107.32 102.04 2oj2 s GLY 71 Ca -0.05 1.71 -0.31 0.00 0.00 0.00 0.00 44.72 46.07 2oj2 s GLY 71 CO -0.13 0.54 1.31 -0.19 0.00 0.00 0.00 173.10 174.64 2oj2 s TYR 72 N -2.07 3.30 0.11 1.90 2.02 -1.26 -2.29 117.35 119.06 2oj2 s TYR 72 Ca 0.12 1.14 0.08 0.00 -0.37 0.00 0.00 57.07 58.04 2oj2 s TYR 72 Cb 0.01 -3.59 -0.04 0.00 -0.40 0.00 0.00 41.96 37.94 2oj2 s TYR 72 CO -0.03 -1.92 -0.18 0.96 -1.57 0.00 0.00 175.55 172.80 2oj2 s ILE 73 N 0.68 1.60 0.23 2.71 -4.36 0.47 -0.10 121.20 122.43 2oj2 s ILE 73 Ca 0.60 -1.61 -0.30 0.00 -0.26 0.00 0.00 60.65 59.09 2oj2 s ILE 73 Cb -0.35 -1.54 -0.09 0.00 1.25 0.00 0.00 42.46 41.74 2oj2 s ILE 73 CO 0.33 -0.18 1.10 -2.16 0.24 0.00 0.00 174.94 174.27 2oj2 s PRO 74 N -2.16 4.62 0.13 0.37 0.04 -1.26 0.39 135.00 137.13 2oj2 s PRO 74 Ca 0.07 1.76 0.09 0.00 0.04 0.00 0.00 61.00 62.96 2oj2 s PRO 74 Cb -0.08 -3.23 -0.17 0.00 0.04 0.00 0.00 34.50 31.05 2oj2 s PRO 74 CO 0.04 0.15 1.26 1.03 0.04 0.00 0.00 177.00 179.52 2oj2 h SER 75 N 4.47 0.00 0.36 6.66 0.87 -1.89 -3.04 113.55 120.99 2oj2 h SER 75 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2oj2 h SER 75 Cb 1.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 2oj2 h SER 75 CO 0.70 0.91 0.00 -0.46 -0.53 0.00 0.00 176.83 177.45 2oj2 n ASN 76 N -3.30 0.00 -0.41 6.23 6.94 -1.26 -1.41 115.26 122.04 2oj2 n ASN 76 Ca -0.01 0.17 0.04 0.00 -0.02 0.00 0.00 54.58 54.76 2oj2 n ASN 76 Cb 0.91 -0.34 0.09 0.00 -2.36 0.00 0.00 39.78 38.08 2oj2 n ASN 76 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2oj2 n TYR 77 N -1.34 0.25 -4.37 -2.53 4.02 -1.15 -4.92 117.16 107.12 2oj2 n TYR 77 Ca 0.07 -0.38 -0.18 0.00 -0.01 0.00 0.00 57.90 57.39 2oj2 n TYR 77 Cb 0.14 -0.03 -0.10 0.00 -0.02 0.00 0.00 39.34 39.33 2oj2 n TYR 77 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2oj2 s VAL 78 N -0.92 0.93 -0.26 -0.72 -7.23 -0.50 0.22 120.40 111.91 2oj2 s VAL 78 Ca 0.14 -2.01 -0.02 0.00 -1.81 0.00 0.00 61.98 58.28 2oj2 s VAL 78 Cb 0.08 -2.59 0.15 0.00 0.56 0.00 0.00 36.38 34.58 2oj2 s VAL 78 CO 0.11 -0.11 0.46 0.00 -0.31 0.00 0.00 175.10 175.25 2oj2 s ALA 79 N -3.49 -1.52 0.18 1.32 0.00 0.60 -4.72 121.76 114.13 2oj2 s ALA 79 Ca 0.34 1.24 -0.23 0.00 0.00 0.00 0.00 51.96 53.31 2oj2 s ALA 79 Cb 0.07 -1.86 -0.14 0.00 0.00 0.00 0.00 23.12 21.19 2oj2 s ALA 79 CO 0.13 -1.30 0.42 0.54 0.00 0.00 0.00 175.76 175.55 2oj2 n ARG 80 N 5.39 0.00 0.05 0.00 1.74 -1.26 -1.73 116.66 120.85 2oj2 n ARG 80 Ca -0.03 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.08 2oj2 n ARG 80 Cb 0.50 -0.85 0.38 0.00 -1.02 0.00 0.00 32.46 31.48 2oj2 n ARG 80 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2oj2 h VAL 81 N 0.82 1.15 -0.24 1.55 3.04 -1.16 0.16 116.25 121.57 2oj2 h VAL 81 Ca -0.24 -0.56 0.00 0.00 -1.01 0.00 0.00 66.70 64.89 2oj2 h VAL 81 Cb 1.22 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.39 2oj2 h VAL 81 CO 0.48 0.20 0.00 -0.67 -1.01 0.00 0.00 177.57 176.57 2oj2 n ASP 82 N -4.35 1.64 -0.63 3.17 2.03 -1.26 -3.40 116.55 113.75 2oj2 n ASP 82 Ca 0.01 -2.07 0.05 0.00 0.52 0.00 0.00 54.79 53.30 2oj2 n ASP 82 Cb 0.19 -0.26 0.20 0.00 -0.72 0.00 0.00 41.12 40.53 2oj2 n ASP 82 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2oj2 n SER 83 N 0.23 1.92 -4.70 1.67 2.88 0.56 -5.00 113.62 111.18 2oj2 n SER 83 Ca 0.09 -3.79 -0.35 0.00 -1.33 0.00 0.00 58.87 53.49 2oj2 n SER 83 Cb 0.30 -0.53 -0.09 0.00 -0.75 0.00 0.00 64.21 63.13 2oj2 n SER 83 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2oj2 s LEU 84 N -3.19 4.01 -0.41 2.46 1.43 -1.22 -4.79 118.68 116.96 2oj2 s LEU 84 Ca 0.38 0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 2oj2 s LEU 84 Cb 0.36 -2.01 0.14 0.00 0.03 0.00 0.00 46.19 44.71 2oj2 s LEU 84 CO -0.05 0.22 0.24 -1.61 0.23 0.00 0.00 176.35 175.38 2oj2 s GLU 85 N 0.12 0.99 0.00 1.70 0.41 -1.26 -5.13 118.70 115.53 2oj2 s GLU 85 Ca 0.07 -1.78 0.00 0.00 -0.41 0.00 0.00 54.97 52.85 2oj2 s GLU 85 Cb -0.12 -1.87 0.00 0.00 -1.78 0.00 0.00 34.13 30.36 2oj2 s GLU 85 CO -0.00 -1.20 0.00 2.41 -0.49 0.00 0.00 175.26 175.98