#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bx5 s ILE 2 N 0.00 2.92 -0.16 5.18 -1.09 -1.26 -5.06 121.20 121.72 2bx5 s ILE 2 Ca 0.00 -0.68 -0.00 0.00 -2.23 0.00 0.00 60.65 57.74 2bx5 s ILE 2 Cb 0.00 -2.25 -0.00 0.00 -1.58 0.00 0.00 42.46 38.63 2bx5 s ILE 2 CO 0.00 0.50 -0.14 -1.10 -1.23 0.00 0.00 174.94 172.97 2bx5 s GLN 3 N 0.82 3.22 0.32 2.79 -0.21 -1.26 -4.82 119.66 120.52 2bx5 s GLN 3 Ca -0.04 -0.74 0.01 0.00 0.02 0.00 0.00 55.36 54.61 2bx5 s GLN 3 Cb -0.15 -2.67 -0.03 0.00 1.00 0.00 0.00 33.01 31.16 2bx5 s GLN 3 CO 0.00 -0.02 0.51 -1.64 -2.12 0.00 0.00 175.29 172.02 2bx5 s MET 4 N 0.92 3.48 -0.18 2.91 -1.94 -1.26 -2.05 119.30 121.18 2bx5 s MET 4 Ca -0.03 -0.39 -0.04 0.00 -1.71 0.00 0.00 55.69 53.51 2bx5 s MET 4 Cb -0.15 -2.70 0.09 0.00 2.01 0.00 0.00 34.83 34.08 2bx5 s MET 4 CO -0.02 0.20 0.27 0.99 -0.01 0.00 0.00 175.02 176.46 2bx5 s THR 5 N -2.24 -0.42 -0.24 2.05 2.01 -0.15 -4.74 115.64 111.92 2bx5 s THR 5 Ca 0.39 0.04 -0.03 0.00 0.31 0.00 0.00 61.69 62.41 2bx5 s THR 5 Cb -0.10 -0.62 0.01 0.00 0.01 0.00 0.00 72.50 71.81 2bx5 s THR 5 CO 0.34 -0.06 -0.05 -1.58 -0.69 0.00 0.00 174.62 172.58 2bx5 s GLN 6 N 2.41 3.05 -0.06 4.92 0.74 -1.26 -2.00 119.66 127.45 2bx5 s GLN 6 Ca 0.06 -0.84 0.06 0.00 0.05 0.00 0.00 55.36 54.68 2bx5 s GLN 6 Cb -0.14 -2.99 -0.01 0.00 1.10 0.00 0.00 33.01 30.96 2bx5 s GLN 6 CO -0.12 -0.32 -0.24 -1.54 -0.55 0.00 0.00 175.29 172.52 2bx5 s SER 7 N 1.39 3.16 0.00 6.67 1.04 0.19 -4.48 113.70 121.67 2bx5 s SER 7 Ca 0.03 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.97 2bx5 s SER 7 Cb -0.16 -0.92 0.00 0.00 0.10 0.00 0.00 66.02 65.04 2bx5 s SER 7 CO -0.04 0.24 0.00 -0.81 0.98 0.00 0.00 173.24 173.61 2bx5 n PRO 8 N 2.99 3.52 0.00 4.02 -0.04 -1.26 -1.12 135.00 143.10 2bx5 n PRO 8 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2bx5 n PRO 8 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 2bx5 n PRO 8 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2bx5 n SER 9 N 0.00 0.00 -4.71 3.54 7.64 -1.26 -4.51 113.62 114.31 2bx5 n SER 9 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 2bx5 n SER 9 Cb 0.00 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2bx5 n SER 9 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2bx5 s SER 10 N -1.01 7.17 0.04 6.43 1.04 -1.26 -2.54 113.70 123.57 2bx5 s SER 10 Ca 0.00 1.92 0.02 0.00 0.48 0.00 0.00 55.95 58.37 2bx5 s SER 10 Cb 0.00 -2.58 -0.02 0.00 0.10 0.00 0.00 66.02 63.52 2bx5 s SER 10 CO 0.00 -0.40 -0.08 -0.22 0.98 0.00 0.00 173.24 173.52 2bx5 s LEU 11 N 0.98 2.24 -0.17 2.42 2.96 -0.90 -4.99 118.68 121.21 2bx5 s LEU 11 Ca 0.56 -0.52 -0.15 0.00 -0.22 0.00 0.00 54.13 53.80 2bx5 s LEU 11 Cb -0.27 -0.20 0.05 0.00 0.50 0.00 0.00 46.19 46.27 2bx5 s LEU 11 CO 0.29 -0.17 0.46 -0.94 -1.32 0.00 0.00 176.35 174.67 2bx5 s SER 12 N -1.47 -0.49 0.01 3.68 1.04 -1.26 -0.83 113.70 114.38 2bx5 s SER 12 Ca -0.08 0.93 -0.00 0.00 0.48 0.00 0.00 55.95 57.27 2bx5 s SER 12 Cb -0.09 0.93 0.00 0.00 0.10 0.00 0.00 66.02 66.96 2bx5 s SER 12 CO 0.00 -0.16 0.02 0.00 0.98 0.00 0.00 173.24 174.08 2bx5 n ALA 13 N 2.98 -0.03 -4.54 5.32 0.00 -1.17 -4.90 120.51 118.17 2bx5 n ALA 13 Ca -0.14 -0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.01 2bx5 n ALA 13 Cb 0.57 0.03 -0.06 0.00 0.00 0.00 0.00 19.45 19.99 2bx5 n ALA 13 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2bx5 n SER 14 N -1.42 2.70 -4.60 0.00 2.88 -1.26 -3.72 113.62 108.20 2bx5 n SER 14 Ca -0.00 -2.79 -0.43 0.00 -1.33 0.00 0.00 58.87 54.32 2bx5 n SER 14 Cb 0.02 0.41 -0.03 0.00 -0.75 0.00 0.00 64.21 63.86 2bx5 n SER 14 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2bx5 s VAL 15 N -2.55 3.35 0.00 2.46 1.01 -1.26 -2.65 120.40 120.76 2bx5 s VAL 15 Ca 0.04 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.36 2bx5 s VAL 15 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.90 2bx5 s VAL 15 CO 0.03 -0.32 0.00 0.61 0.00 0.00 0.00 175.10 175.42 2bx5 n GLY 16 N 5.53 2.68 3.69 4.51 0.00 0.13 -4.89 105.19 116.83 2bx5 n GLY 16 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 2bx5 n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bx5 n ASP 17 N 0.00 1.49 -4.78 1.61 9.92 -1.08 -4.30 116.55 119.40 2bx5 n ASP 17 Ca 0.00 0.78 -0.38 0.00 -0.53 0.00 0.00 54.79 54.66 2bx5 n ASP 17 Cb 0.00 -1.50 -0.06 0.00 -0.64 0.00 0.00 41.12 38.92 2bx5 n ASP 17 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 2bx5 s ARG 18 N -3.30 4.11 -0.20 -1.24 3.52 -1.26 -3.33 118.95 117.25 2bx5 s ARG 18 Ca 0.80 0.39 0.01 0.00 -0.13 0.00 0.00 55.73 56.80 2bx5 s ARG 18 Cb -0.37 -3.32 0.03 0.00 -1.56 0.00 0.00 34.95 29.72 2bx5 s ARG 18 CO 0.44 0.45 -0.17 0.08 -0.81 0.00 0.00 175.30 175.29 2bx5 s VAL 19 N -0.30 2.22 -0.29 7.11 1.01 -0.84 -5.01 120.40 124.29 2bx5 s VAL 19 Ca 0.24 -1.03 -0.06 0.00 0.00 0.00 0.00 61.98 61.13 2bx5 s VAL 19 Cb -0.16 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.22 2bx5 s VAL 19 CO 0.11 0.41 0.06 -0.89 0.00 0.00 0.00 175.10 174.79 2bx5 s THR 20 N 1.27 3.73 -0.09 3.92 2.01 -1.26 0.54 115.64 125.76 2bx5 s THR 20 Ca 0.02 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.23 2bx5 s THR 20 Cb -0.14 -2.94 -0.02 0.00 0.01 0.00 0.00 72.50 69.40 2bx5 s THR 20 CO -0.10 0.07 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.15 2bx5 s ILE 21 N 1.45 3.25 -0.16 1.82 1.01 -0.22 -4.82 121.20 123.54 2bx5 s ILE 21 Ca 0.02 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.03 2bx5 s ILE 21 Cb -0.17 -2.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.96 2bx5 s ILE 21 CO 0.01 0.56 -0.10 -0.89 0.00 0.00 0.00 174.94 174.52 2bx5 s THR 22 N -0.30 3.17 0.26 2.92 2.01 -0.28 -0.42 115.64 123.01 2bx5 s THR 22 Ca 0.03 -0.60 0.12 0.00 0.31 0.00 0.00 61.69 61.54 2bx5 s THR 22 Cb -0.13 -2.36 -0.05 0.00 0.01 0.00 0.00 72.50 69.97 2bx5 s THR 22 CO 0.03 0.50 -0.21 0.00 -0.69 0.00 0.00 174.62 174.25 2bx5 s ARG 24 N -3.31 0.52 0.38 0.00 0.52 -0.85 -0.81 118.95 115.40 2bx5 s ARG 24 Ca 0.28 1.27 -0.03 0.00 -0.52 0.00 0.00 55.73 56.72 2bx5 s ARG 24 Cb -0.06 0.71 -0.04 0.00 0.52 0.00 0.00 34.95 36.08 2bx5 s ARG 24 CO 0.14 -0.17 0.64 0.00 0.02 0.00 0.00 175.30 175.92 2bx5 s ALA 25 N 2.67 3.56 -1.49 2.13 0.00 -0.97 -0.98 121.76 126.69 2bx5 s ALA 25 Ca -0.06 -0.64 0.29 0.00 0.00 0.00 0.00 51.96 51.55 2bx5 s ALA 25 Cb -0.10 -2.35 1.28 0.00 0.00 0.00 0.00 23.12 21.95 2bx5 s ALA 25 CO -0.19 -0.05 1.90 -1.13 0.00 0.00 0.00 175.76 176.30 2bx5 n SER 26 N -1.66 0.29 -3.55 0.00 3.41 -0.87 -4.85 113.62 106.38 2bx5 n SER 26 Ca -0.02 -0.34 -0.17 0.00 -0.26 0.00 0.00 58.87 58.08 2bx5 n SER 26 Cb 0.55 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.28 2bx5 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bx5 s GLN 27 N -2.57 1.00 -0.46 4.33 -2.07 -1.26 -4.98 119.66 113.65 2bx5 s GLN 27 Ca 0.27 0.29 -0.44 0.00 -1.82 0.00 0.00 55.36 53.65 2bx5 s GLN 27 Cb 0.20 0.47 -0.19 0.00 -1.09 0.00 0.00 33.01 32.41 2bx5 s GLN 27 CO 0.49 -0.30 1.82 0.45 -1.32 0.00 0.00 175.29 176.43 2bx5 n SER 28 N 1.11 1.31 -2.61 12.60 2.88 -1.26 -4.79 113.62 122.85 2bx5 n SER 28 Ca -0.19 0.97 -0.34 0.00 -1.33 0.00 0.00 58.87 57.98 2bx5 n SER 28 Cb 0.57 -0.95 0.04 0.00 -0.75 0.00 0.00 64.21 63.12 2bx5 n SER 28 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2bx5 n ILE 29 N 5.05 3.22 0.00 2.46 -5.35 -0.48 -4.97 119.36 119.28 2bx5 n ILE 29 Ca 0.38 -4.17 0.00 0.00 -0.27 0.00 0.00 62.75 58.70 2bx5 n ILE 29 Cb -0.01 -1.22 0.00 0.00 -1.74 0.00 0.00 39.64 36.67 2bx5 n ILE 29 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2bx5 n SER 30 N -0.62 0.00 -2.31 7.28 2.88 -1.26 -1.34 113.62 118.25 2bx5 n SER 30 Ca 0.51 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 58.03 2bx5 n SER 30 Cb 0.49 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.03 2bx5 n SER 30 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2bx5 n SER 31 N 2.15 -1.03 -3.95 -3.46 2.88 -1.26 0.21 113.62 109.16 2bx5 n SER 31 Ca 0.00 -1.83 -0.42 0.00 -1.33 0.00 0.00 58.87 55.29 2bx5 n SER 31 Cb 0.00 0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2bx5 n SER 31 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2bx5 n TYR 32 N -0.95 2.33 -4.50 0.66 4.02 -0.45 -4.28 117.16 114.00 2bx5 n TYR 32 Ca -0.12 -2.69 -0.22 0.00 -0.01 0.00 0.00 57.90 54.86 2bx5 n TYR 32 Cb 0.75 -1.19 -0.16 0.00 -0.02 0.00 0.00 39.34 38.71 2bx5 n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2bx5 s LEU 33 N -2.81 1.72 0.25 7.72 0.20 -1.26 -2.12 118.68 122.38 2bx5 s LEU 33 Ca 0.32 -0.24 0.08 0.00 0.69 0.00 0.00 54.13 54.98 2bx5 s LEU 33 Cb 0.06 -0.69 -0.04 0.00 -0.43 0.00 0.00 46.19 45.09 2bx5 s LEU 33 CO 0.10 0.06 0.06 0.20 -0.29 0.00 0.00 176.35 176.48 2bx5 s ASN 34 N 0.38 4.89 -0.11 3.68 0.01 -1.05 -2.34 114.94 120.40 2bx5 s ASN 34 Ca -0.07 -0.49 0.00 0.00 -0.71 0.00 0.00 52.86 51.59 2bx5 s ASN 34 Cb -0.12 -1.05 0.02 0.00 0.41 0.00 0.00 41.25 40.52 2bx5 s ASN 34 CO 0.02 -0.00 -0.11 0.26 -1.51 0.00 0.00 177.10 175.76 2bx5 s TRP 35 N -2.20 1.68 -0.03 2.20 0.52 -1.21 -2.51 118.94 117.39 2bx5 s TRP 35 Ca 0.31 -0.82 0.04 0.00 0.02 0.00 0.00 56.10 55.65 2bx5 s TRP 35 Cb -0.07 -1.30 -0.03 0.00 -1.15 0.00 0.00 33.47 30.92 2bx5 s TRP 35 CO 0.21 -0.50 -0.14 0.71 0.02 0.00 0.00 176.95 177.26 2bx5 s TYR 36 N 1.38 2.71 -0.03 -1.98 1.51 0.28 -0.31 117.35 120.90 2bx5 s TYR 36 Ca -0.00 -0.15 0.03 0.00 -1.01 0.00 0.00 57.07 55.93 2bx5 s TYR 36 Cb -0.13 -1.61 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 2bx5 s TYR 36 CO -0.06 0.22 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.38 2bx5 s GLN 37 N -0.90 2.59 -0.07 -0.62 0.74 -0.24 0.19 119.66 121.35 2bx5 s GLN 37 Ca 0.12 -0.66 -0.03 0.00 0.05 0.00 0.00 55.36 54.84 2bx5 s GLN 37 Cb -0.11 -2.50 0.04 0.00 1.10 0.00 0.00 33.01 31.55 2bx5 s GLN 37 CO 0.02 0.63 0.13 1.14 -0.55 0.00 0.00 175.29 176.65 2bx5 s GLN 38 N -1.05 -0.00 0.30 1.67 -2.07 0.13 0.10 119.66 118.74 2bx5 s GLN 38 Ca 0.14 0.50 -0.29 0.00 -1.82 0.00 0.00 55.36 53.89 2bx5 s GLN 38 Cb -0.11 -0.35 -0.09 0.00 -1.09 0.00 0.00 33.01 31.37 2bx5 s GLN 38 CO 0.04 -0.31 1.11 0.15 -1.32 0.00 0.00 175.29 174.96 2bx5 s LYS 39 N 2.22 4.54 -0.24 9.60 1.02 -1.26 -2.59 119.74 133.02 2bx5 s LYS 39 Ca 0.03 1.81 -0.36 0.00 0.02 0.00 0.00 55.97 57.47 2bx5 s LYS 39 Cb -0.12 -3.08 -0.13 0.00 -0.52 0.00 0.00 37.83 33.98 2bx5 s LYS 39 CO -0.05 0.11 1.96 -2.30 -0.92 0.00 0.00 175.35 174.15 2bx5 n PRO 40 N 0.97 1.49 0.00 -1.68 -0.02 -1.26 0.08 135.00 134.57 2bx5 n PRO 40 Ca -0.00 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2bx5 n PRO 40 Cb 0.45 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2bx5 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bx5 n GLY 41 N 5.12 0.56 0.00 -1.23 0.00 -1.26 -5.09 105.19 103.29 2bx5 n GLY 41 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2bx5 n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bx5 n LYS 42 N -1.27 3.38 -4.52 1.61 4.76 0.11 -5.15 118.16 117.08 2bx5 n LYS 42 Ca 0.00 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.23 2bx5 n LYS 42 Cb 0.00 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.05 2bx5 n LYS 42 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bx5 s ALA 43 N -2.25 1.18 -0.32 7.82 0.00 -1.26 -4.85 121.76 122.08 2bx5 s ALA 43 Ca 0.00 -0.70 -0.35 0.00 0.00 0.00 0.00 51.96 50.90 2bx5 s ALA 43 Cb 0.00 -0.25 -0.11 0.00 0.00 0.00 0.00 23.12 22.76 2bx5 s ALA 43 CO 0.00 0.26 2.14 -2.30 0.00 0.00 0.00 175.76 175.86 2bx5 n PRO 44 N 2.37 1.20 -3.11 0.00 -0.02 -1.26 -4.77 135.00 129.40 2bx5 n PRO 44 Ca -0.16 0.35 -0.39 0.00 -2.02 0.00 0.00 63.50 61.28 2bx5 n PRO 44 Cb 0.55 -2.48 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 2bx5 n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2bx5 s LYS 45 N 5.87 4.39 -0.15 -0.52 1.02 0.29 -4.82 119.74 125.82 2bx5 s LYS 45 Ca 1.07 0.89 -0.29 0.00 0.02 0.00 0.00 55.97 57.66 2bx5 s LYS 45 Cb -0.84 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 33.09 2bx5 s LYS 45 CO 0.50 0.36 1.70 -1.17 -0.92 0.00 0.00 175.35 175.82 2bx5 s LEU 46 N -0.25 4.04 -0.05 3.17 2.96 -1.26 -1.08 118.68 126.20 2bx5 s LEU 46 Ca 0.34 1.92 -0.15 0.00 -0.22 0.00 0.00 54.13 56.02 2bx5 s LEU 46 Cb -0.19 -3.53 -0.31 0.00 0.50 0.00 0.00 46.19 42.66 2bx5 s LEU 46 CO 0.20 -1.19 0.72 -0.07 -1.32 0.00 0.00 176.35 174.69 2bx5 h LEU 47 N 11.41 0.57 -7.99 -0.68 3.38 -1.02 -3.48 115.31 117.49 2bx5 h LEU 47 Ca -0.37 -0.91 -0.04 0.00 0.09 0.00 0.00 57.88 56.65 2bx5 h LEU 47 Cb 1.17 -0.18 -0.10 0.00 0.09 0.00 0.00 40.66 41.64 2bx5 h LEU 47 CO 0.98 1.67 -0.06 -0.63 0.09 0.00 0.00 178.44 180.49 2bx5 s ILE 48 N -2.53 0.02 -0.16 1.22 1.01 -1.16 -3.52 121.20 116.09 2bx5 s ILE 48 Ca -0.16 -1.14 -0.07 0.00 0.00 0.00 0.00 60.65 59.28 2bx5 s ILE 48 Cb 0.04 -1.91 0.07 0.00 0.01 0.00 0.00 42.46 40.67 2bx5 s ILE 48 CO 0.84 -0.09 0.35 -0.31 0.00 0.00 0.00 174.94 175.73 2bx5 s TYR 49 N -3.95 -0.56 -0.78 3.97 4.12 -0.36 -3.30 117.35 116.49 2bx5 s TYR 49 Ca 0.16 1.18 0.00 0.00 0.02 0.00 0.00 57.07 58.43 2bx5 s TYR 49 Cb -0.01 0.16 0.00 0.00 -1.52 0.00 0.00 41.96 40.60 2bx5 s TYR 49 CO 0.03 -0.36 0.00 0.00 0.02 0.00 0.00 175.55 175.24 2bx5 n ALA 50 N 4.83 -0.11 -0.05 3.71 0.00 -1.22 -2.12 120.51 125.56 2bx5 n ALA 50 Ca -0.15 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2bx5 n ALA 50 Cb 0.52 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.00 2bx5 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bx5 n ALA 51 N 0.11 0.00 0.00 0.00 0.00 -0.99 -4.69 120.51 114.94 2bx5 n ALA 51 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2bx5 n ALA 51 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.71 2bx5 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bx5 n SER 52 N 0.08 0.00 -2.66 0.00 3.41 -1.08 -2.58 113.62 110.79 2bx5 n SER 52 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 2bx5 n SER 52 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 2bx5 n SER 52 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2bx5 n SER 53 N 0.00 0.27 -3.15 4.04 2.88 -0.90 -4.65 113.62 112.11 2bx5 n SER 53 Ca 0.00 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 2bx5 n SER 53 Cb 0.00 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 2bx5 n SER 53 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2bx5 n LEU 54 N 5.71 0.00 -3.88 2.46 4.77 -1.26 -1.22 117.00 123.58 2bx5 n LEU 54 Ca 0.38 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.24 2bx5 n LEU 54 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 2bx5 n LEU 54 CO 0.55 -1.29 -0.28 -1.58 -1.33 0.00 0.00 177.39 173.47 2bx5 s GLN 55 N -2.26 0.20 0.32 3.23 2.00 -1.23 -4.50 119.66 117.42 2bx5 s GLN 55 Ca 0.00 -0.15 -0.28 0.00 -2.00 0.00 0.00 55.36 52.93 2bx5 s GLN 55 Cb 0.00 0.08 -0.13 0.00 0.80 0.00 0.00 33.01 33.76 2bx5 s GLN 55 CO 0.00 -0.04 1.15 0.43 -0.50 0.00 0.00 175.29 176.33 2bx5 n SER 56 N 2.45 2.02 0.00 6.67 7.64 -1.26 -1.27 113.62 129.87 2bx5 n SER 56 Ca -0.17 1.19 0.00 0.00 1.01 0.00 0.00 58.87 60.90 2bx5 n SER 56 Cb 0.58 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 2bx5 n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bx5 n GLY 57 N 0.99 1.99 3.67 0.23 0.00 -1.26 -4.99 105.19 105.83 2bx5 n GLY 57 Ca 0.07 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 2bx5 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bx5 s VAL 58 N -0.17 3.96 0.98 1.61 0.11 -0.39 -4.99 120.40 121.50 2bx5 s VAL 58 Ca 0.00 1.22 -0.17 0.00 -2.93 0.00 0.00 61.98 60.10 2bx5 s VAL 58 Cb 0.00 -3.79 -0.13 0.00 -1.53 0.00 0.00 36.38 30.93 2bx5 s VAL 58 CO 0.00 -0.08 -0.67 -2.65 -3.33 0.00 0.00 175.10 168.37 2bx5 n PRO 59 N 6.35 -0.03 0.02 1.54 -0.02 -1.26 -4.62 135.00 136.99 2bx5 n PRO 59 Ca 0.14 -0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.76 2bx5 n PRO 59 Cb 0.44 -1.09 0.56 0.00 -0.02 0.00 0.00 33.50 33.39 2bx5 n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bx5 n SER 60 N 2.99 0.18 0.00 2.55 3.41 -1.26 -4.23 113.62 117.26 2bx5 n SER 60 Ca -0.01 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 2bx5 n SER 60 Cb 0.56 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2bx5 n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2bx5 n ARG 61 N -1.64 0.00 0.00 4.33 0.00 -1.26 -4.66 116.66 113.43 2bx5 n ARG 61 Ca 0.07 0.07 0.00 0.00 -0.00 0.00 0.00 57.85 57.99 2bx5 n ARG 61 Cb 0.36 -0.79 0.00 0.00 -0.00 0.00 0.00 32.46 32.02 2bx5 n ARG 61 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2bx5 n PHE 62 N -0.71 0.00 -5.21 2.89 3.01 -1.26 -4.47 117.46 111.72 2bx5 n PHE 62 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 2bx5 n PHE 62 Cb 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.31 2bx5 n PHE 62 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2bx5 s SER 63 N 0.00 3.19 0.04 4.37 1.04 -0.34 -4.97 113.70 117.04 2bx5 s SER 63 Ca 0.00 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 55.97 2bx5 s SER 63 Cb 0.00 -0.98 -0.02 0.00 0.10 0.00 0.00 66.02 65.12 2bx5 s SER 63 CO 0.00 0.23 -0.09 -0.83 0.98 0.00 0.00 173.24 173.53 2bx5 s GLY 64 N -0.09 0.56 0.19 7.32 0.00 -1.26 0.23 107.32 114.28 2bx5 s GLY 64 Ca -0.05 -0.75 -0.18 0.00 0.00 0.00 0.00 44.72 43.73 2bx5 s GLY 64 CO 0.04 -0.79 0.52 -1.35 0.00 0.00 0.00 173.10 171.53 2bx5 s SER 65 N -1.43 -0.27 0.00 1.64 1.04 -0.47 -3.41 113.70 110.80 2bx5 s SER 65 Ca -0.07 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.91 2bx5 s SER 65 Cb -0.09 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2bx5 s SER 65 CO 0.01 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.79 2bx5 n GLY 66 N -0.34 4.35 3.26 7.32 0.00 -1.26 -1.85 105.19 116.68 2bx5 n GLY 66 Ca -0.11 -1.35 -0.03 0.00 0.00 0.00 0.00 46.02 44.53 2bx5 n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2bx5 s SER 67 N 0.00 -0.75 0.00 1.61 0.15 -1.23 -4.92 113.70 108.56 2bx5 s SER 67 Ca 0.00 0.96 0.00 0.00 0.70 0.00 0.00 55.95 57.61 2bx5 s SER 67 Cb 0.00 1.82 0.00 0.00 -1.71 0.00 0.00 66.02 66.13 2bx5 s SER 67 CO 0.00 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.80 2bx5 n GLY 68 N 5.41 0.91 0.07 9.45 0.00 0.13 -4.45 105.19 116.72 2bx5 n GLY 68 Ca -0.06 -0.76 0.11 0.00 0.00 0.00 0.00 46.02 45.31 2bx5 n GLY 68 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2bx5 n THR 69 N 0.00 0.33 -3.96 2.61 5.66 -1.26 -1.38 114.28 116.29 2bx5 n THR 69 Ca 0.00 -0.50 -0.17 0.00 -3.05 0.00 0.00 64.05 60.33 2bx5 n THR 69 Cb 0.00 -0.15 -0.16 0.00 -1.55 0.00 0.00 70.33 68.47 2bx5 n THR 69 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2bx5 s ASP 70 N -4.88 0.48 0.01 1.09 -1.08 -1.26 -2.29 116.67 108.74 2bx5 s ASP 70 Ca -0.03 -0.04 0.01 0.00 -0.52 0.00 0.00 52.55 51.97 2bx5 s ASP 70 Cb 0.12 -0.25 -0.01 0.00 -1.46 0.00 0.00 42.92 41.32 2bx5 s ASP 70 CO 0.84 -0.09 -0.04 -0.36 0.52 0.00 0.00 175.17 176.03 2bx5 s PHE 71 N 1.00 0.36 -0.01 -5.34 0.40 0.01 -3.53 117.98 110.87 2bx5 s PHE 71 Ca -0.10 -0.27 0.00 0.00 -0.60 0.00 0.00 56.93 55.96 2bx5 s PHE 71 Cb -0.14 -0.23 0.01 0.00 0.51 0.00 0.00 43.02 43.18 2bx5 s PHE 71 CO -0.01 -0.06 0.01 0.95 0.70 0.00 0.00 175.22 176.80 2bx5 s THR 72 N -0.70 0.03 -0.27 0.64 -4.23 -0.77 0.60 115.64 110.93 2bx5 s THR 72 Ca -0.05 0.06 -0.08 0.00 -1.18 0.00 0.00 61.69 60.44 2bx5 s THR 72 Cb -0.05 -0.08 -0.02 0.00 1.34 0.00 0.00 72.50 73.69 2bx5 s THR 72 CO -0.00 0.05 0.08 -0.22 -0.54 0.00 0.00 174.62 173.99 2bx5 s LEU 73 N 0.42 3.64 -0.20 4.79 2.96 0.44 -1.36 118.68 129.37 2bx5 s LEU 73 Ca -0.04 -0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 53.39 2bx5 s LEU 73 Cb -0.05 -1.92 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 2bx5 s LEU 73 CO -0.01 -0.10 0.17 -0.89 -1.32 0.00 0.00 176.35 174.20 2bx5 s THR 74 N 1.59 5.37 -0.55 3.68 2.01 0.64 -1.06 115.64 127.32 2bx5 s THR 74 Ca 0.05 0.26 -0.17 0.00 0.31 0.00 0.00 61.69 62.14 2bx5 s THR 74 Cb -0.16 -3.51 0.12 0.00 0.01 0.00 0.00 72.50 68.96 2bx5 s THR 74 CO 0.04 0.40 0.55 -0.63 -0.69 0.00 0.00 174.62 174.29 2bx5 s ILE 75 N 0.58 5.10 0.27 1.82 1.01 0.19 -1.20 121.20 128.97 2bx5 s ILE 75 Ca 0.10 -1.34 -0.01 0.00 0.00 0.00 0.00 60.65 59.40 2bx5 s ILE 75 Cb -0.12 -4.37 0.25 0.00 0.01 0.00 0.00 42.46 38.22 2bx5 s ILE 75 CO 0.01 -0.93 1.77 0.77 0.00 0.00 0.00 174.94 176.55 2bx5 h SER 76 N 8.97 0.56 -3.35 3.58 4.64 -1.82 -2.23 113.55 123.89 2bx5 h SER 76 Ca -0.30 0.09 -0.36 0.00 -0.47 0.00 0.00 61.79 60.75 2bx5 h SER 76 Cb 1.10 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.81 2bx5 h SER 76 CO 1.05 0.23 -0.74 -0.55 -0.87 0.00 0.00 176.83 175.95 2bx5 s SER 77 N -5.43 0.98 -0.61 4.97 0.15 -1.26 -4.49 113.70 108.01 2bx5 s SER 77 Ca -0.12 0.06 -0.22 0.00 0.70 0.00 0.00 55.95 56.37 2bx5 s SER 77 Cb 0.22 -0.16 0.07 0.00 -1.71 0.00 0.00 66.02 64.44 2bx5 s SER 77 CO 0.78 -0.22 0.87 -0.22 1.20 0.00 0.00 173.24 175.65 2bx5 s LEU 78 N 1.93 4.60 0.53 3.45 2.96 -1.21 -4.86 118.68 126.08 2bx5 s LEU 78 Ca 0.02 -0.95 -0.02 0.00 -0.22 0.00 0.00 54.13 52.96 2bx5 s LEU 78 Cb -0.12 -2.47 0.01 0.00 0.50 0.00 0.00 46.19 44.11 2bx5 s LEU 78 CO -0.03 -1.27 0.78 -1.10 -1.32 0.00 0.00 176.35 173.40 2bx5 s GLN 79 N 3.60 2.86 0.00 1.98 -1.52 -1.26 -0.69 119.66 124.62 2bx5 s GLN 79 Ca 0.21 -0.41 0.26 0.00 -1.95 0.00 0.00 55.36 53.47 2bx5 s GLN 79 Cb -0.18 -2.44 0.78 0.00 -0.22 0.00 0.00 33.01 30.95 2bx5 s GLN 79 CO 0.11 -0.55 1.59 -0.35 -0.25 0.00 0.00 175.29 175.85 2bx5 n PRO 80 N -2.33 0.37 0.00 2.91 -0.04 -1.26 -2.92 135.00 131.74 2bx5 n PRO 80 Ca 0.04 -0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2bx5 n PRO 80 Cb 0.58 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2bx5 n PRO 80 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2bx5 n GLU 81 N -1.15 0.00 -0.00 0.54 0.00 -1.26 -2.12 120.64 116.65 2bx5 n GLU 81 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 57.16 57.27 2bx5 n GLU 81 Cb 0.33 -1.04 -0.04 0.00 0.00 0.00 0.00 31.44 30.69 2bx5 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2bx5 n ASP 82 N -0.52 3.88 -3.02 -1.84 8.00 -1.15 -4.91 116.55 116.99 2bx5 n ASP 82 Ca 0.00 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 2bx5 n ASP 82 Cb 0.00 1.19 -0.09 0.00 -0.02 0.00 0.00 41.12 42.20 2bx5 n ASP 82 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2bx5 n PHE 83 N -1.70 0.75 0.00 1.24 7.35 -0.90 -4.66 117.46 119.55 2bx5 n PHE 83 Ca -0.01 0.50 0.00 0.00 -0.76 0.00 0.00 57.45 57.18 2bx5 n PHE 83 Cb 0.16 -1.62 0.00 0.00 0.35 0.00 0.00 39.48 38.36 2bx5 n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2bx5 n ALA 84 N 5.62 0.00 -2.83 3.13 0.00 -1.10 -4.65 120.51 120.67 2bx5 n ALA 84 Ca 0.40 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.51 2bx5 n ALA 84 Cb -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.29 2bx5 n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2bx5 s THR 85 N -2.00 3.04 -0.17 0.00 2.01 -1.07 -1.16 115.64 116.29 2bx5 s THR 85 Ca 0.00 -0.69 0.01 0.00 0.31 0.00 0.00 61.69 61.32 2bx5 s THR 85 Cb 0.00 -2.24 0.02 0.00 0.01 0.00 0.00 72.50 70.29 2bx5 s THR 85 CO 0.00 0.55 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.97 2bx5 s TYR 86 N -0.10 2.75 -0.09 4.92 1.51 -0.81 -0.69 117.35 124.85 2bx5 s TYR 86 Ca -0.02 -1.61 0.02 0.00 -1.01 0.00 0.00 57.07 54.45 2bx5 s TYR 86 Cb -0.14 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 39.79 2bx5 s TYR 86 CO 0.04 -0.78 -0.14 0.71 -1.11 0.00 0.00 175.55 174.26 2bx5 s TYR 87 N 1.24 2.74 -0.69 2.71 1.51 0.50 -1.76 117.35 123.60 2bx5 s TYR 87 Ca 0.04 -0.44 -0.13 0.00 -1.01 0.00 0.00 57.07 55.54 2bx5 s TYR 87 Cb -0.13 -1.73 0.18 0.00 -0.11 0.00 0.00 41.96 40.16 2bx5 s TYR 87 CO -0.12 -0.04 0.62 0.00 -1.11 0.00 0.00 175.55 174.90 2bx5 s GLN 89 N 0.61 0.10 0.10 0.00 0.74 -1.04 -1.92 119.66 118.25 2bx5 s GLN 89 Ca 0.13 -0.45 -0.07 0.00 0.05 0.00 0.00 55.36 55.02 2bx5 s GLN 89 Cb -0.18 -1.79 -0.01 0.00 1.10 0.00 0.00 33.01 32.13 2bx5 s GLN 89 CO -0.04 -2.77 0.15 1.14 -0.55 0.00 0.00 175.29 173.22 2bx5 s GLN 90 N -5.88 0.86 -0.05 1.67 -2.07 -1.15 -2.52 119.66 110.53 2bx5 s GLN 90 Ca 0.75 -1.08 0.07 0.00 -1.82 0.00 0.00 55.36 53.28 2bx5 s GLN 90 Cb -0.03 0.31 0.11 0.00 -1.09 0.00 0.00 33.01 32.31 2bx5 s GLN 90 CO 0.54 -0.26 1.02 0.43 -1.32 0.00 0.00 175.29 175.70 2bx5 n SER 91 N -0.06 1.87 0.06 12.60 7.64 -0.90 -4.15 113.62 130.67 2bx5 n SER 91 Ca -0.13 -2.33 0.13 0.00 1.01 0.00 0.00 58.87 57.56 2bx5 n SER 91 Cb 0.62 -0.17 0.42 0.00 -1.01 0.00 0.00 64.21 64.07 2bx5 n SER 91 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bx5 n TYR 92 N -0.78 0.49 -3.62 1.43 9.36 -1.25 -4.89 117.16 117.90 2bx5 n TYR 92 Ca 0.06 0.14 -0.02 0.00 3.32 0.00 0.00 57.90 61.40 2bx5 n TYR 92 Cb 0.44 -0.69 -0.01 0.00 -0.63 0.00 0.00 39.34 38.44 2bx5 n TYR 92 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2bx5 s SER 93 N -3.86 -0.13 -0.12 2.98 0.15 -1.26 -5.11 113.70 106.36 2bx5 s SER 93 Ca 0.11 -0.12 -0.00 0.00 0.70 0.00 0.00 55.95 56.64 2bx5 s SER 93 Cb 0.15 0.22 -0.02 0.00 -1.71 0.00 0.00 66.02 64.66 2bx5 s SER 93 CO 0.61 -0.39 -0.11 0.42 1.20 0.00 0.00 173.24 174.96 2bx5 s THR 94 N -2.61 3.23 0.17 6.45 -4.23 -1.26 -0.74 115.64 116.64 2bx5 s THR 94 Ca 0.12 -0.61 -0.30 0.00 -1.18 0.00 0.00 61.69 59.71 2bx5 s THR 94 Cb 0.02 -2.35 -0.08 0.00 1.34 0.00 0.00 72.50 71.42 2bx5 s THR 94 CO -0.04 0.54 1.33 -2.16 -0.54 0.00 0.00 174.62 173.75 2bx5 s PRO 95 N 0.09 4.37 0.32 3.99 0.04 -1.26 -4.82 135.00 137.74 2bx5 s PRO 95 Ca -0.05 2.05 -0.28 0.00 0.04 0.00 0.00 61.00 62.76 2bx5 s PRO 95 Cb -0.14 -3.22 -0.13 0.00 0.04 0.00 0.00 34.50 31.05 2bx5 s PRO 95 CO 0.04 -0.31 1.27 0.09 0.04 0.00 0.00 177.00 178.13 2bx5 n ASN 96 N 3.10 2.60 -3.88 6.66 3.02 0.08 -4.67 115.26 122.17 2bx5 n ASN 96 Ca 0.08 1.20 -0.12 0.00 -0.03 0.00 0.00 54.58 55.70 2bx5 n ASN 96 Cb 0.43 -1.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.07 2bx5 n ASN 96 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2bx5 s THR 97 N -0.96 0.00 0.17 3.41 -4.23 -1.26 -4.96 115.64 107.80 2bx5 s THR 97 Ca 0.57 -1.76 0.10 0.00 -1.18 0.00 0.00 61.69 59.43 2bx5 s THR 97 Cb -0.59 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 70.76 2bx5 s THR 97 CO 0.60 0.00 -0.20 -0.36 -0.54 0.00 0.00 174.62 174.12 2bx5 s PHE 98 N -3.84 2.42 0.97 3.99 0.40 -1.26 -2.91 117.98 117.74 2bx5 s PHE 98 Ca 0.33 -0.31 -0.12 0.00 -0.60 0.00 0.00 56.93 56.22 2bx5 s PHE 98 Cb 0.03 -1.23 0.17 0.00 0.51 0.00 0.00 43.02 42.50 2bx5 s PHE 98 CO 0.14 0.46 1.10 0.20 0.70 0.00 0.00 175.22 177.83 2bx5 s GLY 99 N -2.53 1.57 0.00 4.36 0.00 -0.81 -4.51 107.32 105.41 2bx5 s GLY 99 Ca 0.20 -0.38 0.00 0.00 0.00 0.00 0.00 44.72 44.54 2bx5 s GLY 99 CO 0.11 0.20 0.76 0.61 0.00 0.00 0.00 173.10 174.78 2bx5 n GLN 100 N -4.04 0.97 -0.69 2.90 0.00 -1.26 -4.73 117.38 110.53 2bx5 n GLN 100 Ca 0.06 0.00 0.09 0.00 0.00 0.00 0.00 57.00 57.15 2bx5 n GLN 100 Cb 0.58 -1.20 -0.02 0.00 0.00 0.00 0.00 30.24 29.59 2bx5 n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bx5 n GLY 101 N 0.28 -2.07 2.87 2.61 0.00 -1.26 -4.94 105.19 102.68 2bx5 n GLY 101 Ca 0.00 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.56 2bx5 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bx5 s THR 102 N -1.55 -0.53 -1.02 2.61 2.01 -0.72 -4.60 115.64 111.84 2bx5 s THR 102 Ca 0.00 -0.08 -0.25 0.00 0.31 0.00 0.00 61.69 61.66 2bx5 s THR 102 Cb 0.00 -0.78 -0.19 0.00 0.01 0.00 0.00 72.50 71.54 2bx5 s THR 102 CO 0.00 -0.14 2.00 0.29 -0.69 0.00 0.00 174.62 176.07 2bx5 n LYS 103 N 5.35 0.72 -1.87 4.92 5.02 -1.05 -1.92 118.16 129.32 2bx5 n LYS 103 Ca -0.04 -1.94 -0.43 0.00 -2.02 0.00 0.00 58.31 53.89 2bx5 n LYS 103 Cb 0.50 -3.69 -0.03 0.00 -0.02 0.00 0.00 35.03 31.79 2bx5 n LYS 103 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2bx5 s VAL 104 N 13.58 3.35 0.61 -0.18 1.01 -0.31 -2.11 120.40 136.35 2bx5 s VAL 104 Ca 0.74 0.39 0.05 0.00 0.00 0.00 0.00 61.98 63.17 2bx5 s VAL 104 Cb -0.01 -3.35 0.11 0.00 0.00 0.00 0.00 36.38 33.14 2bx5 s VAL 104 CO 0.18 -0.14 0.84 -0.62 0.00 0.00 0.00 175.10 175.36 2bx5 n GLU 105 N 7.87 0.30 0.00 2.72 1.02 -0.01 -2.72 120.64 129.82 2bx5 n GLU 105 Ca 0.22 -2.75 0.00 0.00 -0.02 0.00 0.00 57.16 54.61 2bx5 n GLU 105 Cb 0.44 -0.42 0.00 0.00 -0.02 0.00 0.00 31.44 31.44 2bx5 n GLU 105 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42