#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 3.25 0.49 5.18 1.01 -1.26 -5.03 121.20 124.84 2bx5 s ILE 2 Ca 0.00 0.25 -0.18 0.00 0.00 0.00 0.00 60.65 60.72 2bx5 s ILE 2 Cb 0.00 -3.35 -0.09 0.00 0.01 0.00 0.00 42.46 39.03 2bx5 s ILE 2 CO 0.00 -0.23 0.98 -1.10 0.00 0.00 0.00 174.94 174.59 2bx5 s GLN 3 N 6.06 3.99 -0.05 2.79 -1.52 -1.26 -4.54 119.66 125.13 2bx5 s GLN 3 Ca 0.89 1.05 -0.01 0.00 -1.95 0.00 0.00 55.36 55.35 2bx5 s GLN 3 Cb -0.27 -2.14 -0.04 0.00 -0.22 0.00 0.00 33.01 30.35 2bx5 s GLN 3 CO 0.34 -0.24 0.03 -1.64 -0.25 0.00 0.00 175.29 173.53 2bx5 s MET 4 N -3.72 2.98 -0.39 2.91 -1.94 -1.26 -1.53 119.30 116.34 2bx5 s MET 4 Ca 0.61 -0.46 -0.04 0.00 -1.71 0.00 0.00 55.69 54.09 2bx5 s MET 4 Cb -0.10 -2.80 0.09 0.00 2.01 0.00 0.00 34.83 34.03 2bx5 s MET 4 CO 0.25 0.67 0.18 0.95 -0.01 0.00 0.00 175.02 177.07 2bx5 s THR 5 N -1.02 3.44 0.64 2.05 -4.23 0.11 -4.78 115.64 111.84 2bx5 s THR 5 Ca 0.17 -1.80 0.05 0.00 -1.18 0.00 0.00 61.69 58.92 2bx5 s THR 5 Cb -0.12 -3.24 0.10 0.00 1.34 0.00 0.00 72.50 70.59 2bx5 s THR 5 CO 0.07 -0.55 0.88 -1.58 -0.54 0.00 0.00 174.62 172.89 2bx5 s GLN 6 N 1.22 2.04 0.00 3.99 0.74 -1.26 -1.08 119.66 125.31 2bx5 s GLN 6 Ca 0.05 -1.37 0.00 0.00 0.05 0.00 0.00 55.36 54.09 2bx5 s GLN 6 Cb -0.22 -2.50 0.00 0.00 1.10 0.00 0.00 33.01 31.38 2bx5 s GLN 6 CO -0.02 -1.11 0.00 -1.13 -0.55 0.00 0.00 175.29 172.48 2bx5 n SER 7 N -2.50 0.00 -1.63 6.67 3.41 -0.12 -4.91 113.62 114.53 2bx5 n SER 7 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 2bx5 n SER 7 Cb 0.61 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 2bx5 n SER 7 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2bx5 n PRO 8 N -0.30 3.33 0.00 4.33 -0.02 -1.26 0.06 135.00 141.14 2bx5 n PRO 8 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2bx5 n PRO 8 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2bx5 n PRO 8 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2bx5 n SER 9 N 0.00 0.00 -4.24 2.55 2.88 -1.26 -3.88 113.62 109.66 2bx5 n SER 9 Ca 0.00 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 2bx5 n SER 9 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 2bx5 n SER 9 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2bx5 s SER 10 N -0.75 2.30 -0.13 -3.46 1.04 -1.26 -2.28 113.70 109.16 2bx5 s SER 10 Ca 0.00 -0.60 -0.06 0.00 0.48 0.00 0.00 55.95 55.77 2bx5 s SER 10 Cb 0.00 -0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.04 2bx5 s SER 10 CO 0.00 0.07 0.29 -0.22 0.98 0.00 0.00 173.24 174.35 2bx5 s LEU 11 N -1.57 0.00 -0.22 2.42 2.96 -1.21 -4.89 118.68 116.17 2bx5 s LEU 11 Ca 0.05 0.63 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 2bx5 s LEU 11 Cb -0.09 0.84 0.04 0.00 0.50 0.00 0.00 46.19 47.48 2bx5 s LEU 11 CO 0.03 -0.20 -0.13 -0.44 -1.32 0.00 0.00 176.35 174.29 2bx5 s SER 12 N 1.82 3.81 0.06 3.68 0.01 -1.26 -3.10 113.70 118.72 2bx5 s SER 12 Ca -0.05 -1.06 0.02 0.00 1.31 0.00 0.00 55.95 56.17 2bx5 s SER 12 Cb -0.11 -1.44 -0.03 0.00 0.21 0.00 0.00 66.02 64.65 2bx5 s SER 12 CO -0.09 -0.13 -0.08 0.00 0.41 0.00 0.00 173.24 173.35 2bx5 s ALA 13 N 1.23 0.73 0.45 1.44 0.00 -1.25 -5.05 121.76 119.31 2bx5 s ALA 13 Ca -0.03 -0.93 -0.03 0.00 0.00 0.00 0.00 51.96 50.96 2bx5 s ALA 13 Cb -0.17 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 2bx5 s ALA 13 CO -0.08 -0.06 0.72 -1.12 0.00 0.00 0.00 175.76 175.23 2bx5 s SER 14 N -1.96 6.20 0.12 0.00 0.01 -1.26 -4.60 113.70 112.20 2bx5 s SER 14 Ca -0.04 0.74 -0.35 0.00 1.31 0.00 0.00 55.95 57.61 2bx5 s SER 14 Cb -0.06 -2.11 -0.15 0.00 0.21 0.00 0.00 66.02 63.91 2bx5 s SER 14 CO -0.01 -0.54 1.45 0.52 0.41 0.00 0.00 173.24 175.08 2bx5 n VAL 15 N -2.14 0.01 0.00 3.43 0.31 -1.26 -0.95 118.33 117.73 2bx5 n VAL 15 Ca -0.01 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2bx5 n VAL 15 Cb 0.56 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 32.33 2bx5 n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bx5 n GLY 16 N 2.95 2.87 3.68 2.92 0.00 -0.27 -4.89 105.19 112.45 2bx5 n GLY 16 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2bx5 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bx5 s ASP 17 N 0.09 6.83 0.32 1.61 1.11 -0.12 -4.20 116.67 122.31 2bx5 s ASP 17 Ca 0.00 2.12 -0.29 0.00 0.18 0.00 0.00 52.55 54.56 2bx5 s ASP 17 Cb 0.00 -2.56 -0.12 0.00 1.07 0.00 0.00 42.92 41.31 2bx5 s ASP 17 CO 0.00 -0.75 1.40 -1.14 1.18 0.00 0.00 175.17 175.86 2bx5 n ARG 18 N 5.61 2.31 -4.14 8.23 0.63 -1.20 -1.88 116.66 126.21 2bx5 n ARG 18 Ca 0.14 0.81 -0.24 0.00 -0.92 0.00 0.00 57.85 57.64 2bx5 n ARG 18 Cb 0.43 -2.47 -0.06 0.00 0.45 0.00 0.00 32.46 30.82 2bx5 n ARG 18 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2bx5 s VAL 19 N -0.71 4.23 -0.02 5.15 1.01 -0.58 -4.91 120.40 124.57 2bx5 s VAL 19 Ca 0.59 -1.35 0.01 0.00 0.00 0.00 0.00 61.98 61.23 2bx5 s VAL 19 Cb -0.56 -3.21 0.01 0.00 0.00 0.00 0.00 36.38 32.62 2bx5 s VAL 19 CO 0.58 -0.23 -0.03 -0.89 0.00 0.00 0.00 175.10 174.52 2bx5 s THR 20 N -1.95 0.35 0.15 3.92 2.01 -1.26 -2.86 115.64 115.99 2bx5 s THR 20 Ca 0.31 -0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.29 2bx5 s THR 20 Cb -0.09 -0.35 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 2bx5 s THR 20 CO 0.23 0.14 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.44 2bx5 s ILE 21 N 0.36 2.00 -0.09 1.82 1.09 -0.84 -4.74 121.20 120.80 2bx5 s ILE 21 Ca -0.04 -1.81 0.03 0.00 -1.10 0.00 0.00 60.65 57.73 2bx5 s ILE 21 Cb -0.07 -1.86 0.01 0.00 -1.06 0.00 0.00 42.46 39.47 2bx5 s ILE 21 CO -0.00 -0.12 -0.18 0.42 -0.10 0.00 0.00 174.94 174.95 2bx5 s THR 22 N -1.52 1.65 -0.09 2.92 -4.23 0.11 -3.21 115.64 111.27 2bx5 s THR 22 Ca 0.14 -0.77 0.03 0.00 -1.18 0.00 0.00 61.69 59.91 2bx5 s THR 22 Cb -0.08 -1.46 -0.01 0.00 1.34 0.00 0.00 72.50 72.28 2bx5 s THR 22 CO 0.07 0.47 -0.18 0.00 -0.54 0.00 0.00 174.62 174.44 2bx5 s ARG 24 N 0.01 0.97 -0.11 0.00 0.52 -0.24 -1.62 118.95 118.48 2bx5 s ARG 24 Ca -0.06 -0.57 -0.01 0.00 -0.52 0.00 0.00 55.73 54.57 2bx5 s ARG 24 Cb -0.15 -0.95 -0.02 0.00 0.52 0.00 0.00 34.95 34.35 2bx5 s ARG 24 CO 0.05 0.25 -0.08 0.00 0.02 0.00 0.00 175.30 175.54 2bx5 s ALA 25 N -0.53 2.87 0.35 2.13 0.00 -1.05 0.08 121.76 125.62 2bx5 s ALA 25 Ca 0.03 -0.88 0.20 0.00 0.00 0.00 0.00 51.96 51.32 2bx5 s ALA 25 Cb -0.06 -1.30 1.28 0.00 0.00 0.00 0.00 23.12 23.04 2bx5 s ALA 25 CO 0.00 0.38 1.50 0.43 0.00 0.00 0.00 175.76 178.08 2bx5 n SER 26 N 2.94 0.33 -4.36 0.00 7.64 -0.58 -4.49 113.62 115.11 2bx5 n SER 26 Ca -0.18 1.58 -0.29 0.00 1.01 0.00 0.00 58.87 60.99 2bx5 n SER 26 Cb 0.53 -0.77 -0.07 0.00 -1.01 0.00 0.00 64.21 62.89 2bx5 n SER 26 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2bx5 n GLN 27 N -5.15 0.76 -3.15 1.43 7.27 -1.26 -5.04 117.38 112.24 2bx5 n GLN 27 Ca 0.36 -3.49 -0.44 0.00 0.07 0.00 0.00 57.00 53.50 2bx5 n GLN 27 Cb 1.22 1.18 -0.06 0.00 2.41 0.00 0.00 30.24 34.99 2bx5 n GLN 27 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2bx5 s SER 28 N -3.61 6.22 -0.94 1.69 0.15 -1.26 -4.74 113.70 111.21 2bx5 s SER 28 Ca 0.05 -1.01 -0.01 0.00 0.70 0.00 0.00 55.95 55.69 2bx5 s SER 28 Cb 0.00 -2.29 0.33 0.00 -1.71 0.00 0.00 66.02 62.35 2bx5 s SER 28 CO 0.04 -0.94 1.84 2.30 1.20 0.00 0.00 173.24 177.68 2bx5 n ILE 29 N 5.61 5.15 0.00 6.45 -5.35 0.27 -4.97 119.36 126.52 2bx5 n ILE 29 Ca -0.07 -5.44 0.00 0.00 -0.27 0.00 0.00 62.75 56.97 2bx5 n ILE 29 Cb 0.45 -1.44 0.00 0.00 -1.74 0.00 0.00 39.64 36.90 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 -0.22 0.00 -0.13 7.28 2.88 -1.26 -0.67 113.62 121.49 2bx5 n SER 30 Ca 0.48 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 2bx5 n SER 30 Cb 0.27 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 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 0.31 0.04 -3.21 -3.46 2.88 -1.26 -2.75 113.62 106.17 2bx5 n SER 31 Ca 0.00 -1.29 -0.36 0.00 -1.33 0.00 0.00 58.87 55.88 2bx5 n SER 31 Cb 0.00 -0.06 -0.03 0.00 -0.75 0.00 0.00 64.21 63.37 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 -0.02 2.25 -4.84 0.66 4.02 0.15 -1.81 117.16 117.57 2bx5 n TYR 32 Ca 0.00 -2.70 -0.31 0.00 -0.01 0.00 0.00 57.90 54.88 2bx5 n TYR 32 Cb 0.55 -1.95 -0.14 0.00 -0.02 0.00 0.00 39.34 37.78 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 -1.35 2.43 -0.01 7.72 2.96 -1.26 -0.42 118.68 128.75 2bx5 s LEU 33 Ca 0.60 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 54.09 2bx5 s LEU 33 Cb 0.22 -1.44 -0.01 0.00 0.50 0.00 0.00 46.19 45.46 2bx5 s LEU 33 CO -0.09 0.28 -0.09 0.20 -1.32 0.00 0.00 176.35 175.32 2bx5 s ASN 34 N -1.18 1.07 -0.09 3.68 0.01 -0.34 -1.15 114.94 116.93 2bx5 s ASN 34 Ca 0.13 -0.16 -0.08 0.00 -0.71 0.00 0.00 52.86 52.03 2bx5 s ASN 34 Cb -0.10 -0.13 -0.04 0.00 0.41 0.00 0.00 41.25 41.38 2bx5 s ASN 34 CO 0.03 0.11 0.19 0.26 -1.51 0.00 0.00 177.10 176.18 2bx5 s TRP 35 N -0.18 3.62 -0.08 2.20 0.52 -0.64 0.17 118.94 124.54 2bx5 s TRP 35 Ca 0.03 0.59 0.02 0.00 0.02 0.00 0.00 56.10 56.76 2bx5 s TRP 35 Cb -0.04 -1.99 0.01 0.00 -1.15 0.00 0.00 33.47 30.31 2bx5 s TRP 35 CO -0.00 0.71 -0.13 0.71 0.02 0.00 0.00 176.95 178.26 2bx5 s TYR 36 N -1.07 1.63 -0.11 -1.98 1.51 -0.86 -1.47 117.35 115.00 2bx5 s TYR 36 Ca 0.18 -0.65 -0.17 0.00 -1.01 0.00 0.00 57.07 55.42 2bx5 s TYR 36 Cb -0.13 -1.19 -0.05 0.00 -0.11 0.00 0.00 41.96 40.49 2bx5 s TYR 36 CO 0.07 -0.34 0.43 -1.14 -1.11 0.00 0.00 175.55 173.46 2bx5 s GLN 37 N 0.76 4.26 -0.18 -0.62 0.74 -0.85 -2.00 119.66 121.77 2bx5 s GLN 37 Ca -0.12 0.37 0.00 0.00 0.05 0.00 0.00 55.36 55.66 2bx5 s GLN 37 Cb -0.16 -3.40 0.04 0.00 1.10 0.00 0.00 33.01 30.59 2bx5 s GLN 37 CO 0.03 0.26 -0.10 -1.14 -0.55 0.00 0.00 175.29 173.79 2bx5 s GLN 38 N 0.30 1.96 0.79 1.67 0.74 0.92 -1.74 119.66 124.30 2bx5 s GLN 38 Ca 0.24 -0.71 -0.11 0.00 0.05 0.00 0.00 55.36 54.83 2bx5 s GLN 38 Cb -0.15 -2.26 0.07 0.00 1.10 0.00 0.00 33.01 31.77 2bx5 s GLN 38 CO 0.09 -0.39 1.09 0.15 -0.55 0.00 0.00 175.29 175.69 2bx5 s LYS 39 N 1.46 2.10 -0.30 1.67 -0.14 -1.26 -1.73 119.74 121.54 2bx5 s LYS 39 Ca 0.00 1.13 -0.27 0.00 -1.36 0.00 0.00 55.97 55.48 2bx5 s LYS 39 Cb -0.15 -1.88 -0.12 0.00 -1.68 0.00 0.00 37.83 34.00 2bx5 s LYS 39 CO -0.09 -1.75 1.09 -2.30 -0.76 0.00 0.00 175.35 171.55 2bx5 n PRO 40 N -3.59 0.00 -2.87 -1.68 -0.02 -1.26 -2.57 135.00 123.01 2bx5 n PRO 40 Ca 0.09 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.53 2bx5 n PRO 40 Cb 0.53 -0.90 0.00 0.00 -0.02 0.00 0.00 33.50 33.12 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 3.27 -0.16 0.00 -1.23 0.00 -1.26 -4.91 105.19 100.90 2bx5 n GLY 41 Ca 0.25 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.91 0.00 -3.76 1.61 4.76 -1.06 -5.18 118.16 113.62 2bx5 n LYS 42 Ca -0.04 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.28 2bx5 n LYS 42 Cb 0.09 0.00 -0.12 0.00 -1.84 0.00 0.00 35.03 33.16 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 -2.00 -0.64 -0.96 7.82 0.00 -1.26 -5.00 121.76 119.71 2bx5 s ALA 43 Ca 0.00 0.89 -0.26 0.00 0.00 0.00 0.00 51.96 52.59 2bx5 s ALA 43 Cb 0.00 -0.54 -0.20 0.00 0.00 0.00 0.00 23.12 22.38 2bx5 s ALA 43 CO 0.00 -0.16 2.21 -2.30 0.00 0.00 0.00 175.76 175.51 2bx5 n PRO 44 N 3.50 0.26 -2.29 0.00 -0.02 -1.26 -4.54 135.00 130.65 2bx5 n PRO 44 Ca -0.18 -1.36 -0.43 0.00 -2.02 0.00 0.00 63.50 59.51 2bx5 n PRO 44 Cb 0.56 -3.80 -0.02 0.00 -0.02 0.00 0.00 33.50 30.22 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 8.64 4.23 0.16 -0.52 1.02 -0.71 -4.81 119.74 127.75 2bx5 s LYS 45 Ca 0.85 1.84 -0.32 0.00 0.02 0.00 0.00 55.97 58.36 2bx5 s LYS 45 Cb -0.09 -3.80 -0.11 0.00 -0.52 0.00 0.00 37.83 33.31 2bx5 s LYS 45 CO 0.15 -0.72 1.78 -0.11 -0.92 0.00 0.00 175.35 175.52 2bx5 n LEU 46 N 6.59 3.98 -0.01 3.17 7.94 -1.26 -2.00 117.00 135.40 2bx5 n LEU 46 Ca 0.15 1.03 -0.01 0.00 -1.11 0.00 0.00 56.01 56.06 2bx5 n LEU 46 Cb 0.44 -1.55 -0.00 0.00 0.53 0.00 0.00 43.42 42.84 2bx5 n LEU 46 CO 0.58 0.16 -0.06 -0.07 -1.11 0.00 0.00 177.39 176.88 2bx5 h LEU 47 N 7.61 0.00 -8.67 -1.96 3.38 -1.58 -3.46 115.31 110.62 2bx5 h LEU 47 Ca -0.45 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 56.95 2bx5 h LEU 47 Cb 1.21 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.74 2bx5 h LEU 47 CO 0.95 0.15 -0.83 -0.63 0.09 0.00 0.00 178.44 178.17 2bx5 s ILE 48 N -1.24 1.74 0.38 1.22 1.01 -0.57 -2.95 121.20 120.79 2bx5 s ILE 48 Ca -0.03 -1.52 0.06 0.00 0.00 0.00 0.00 60.65 59.17 2bx5 s ILE 48 Cb 0.00 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.88 2bx5 s ILE 48 CO 0.04 -0.02 0.23 -0.72 0.00 0.00 0.00 174.94 174.47 2bx5 s TYR 49 N -1.11 1.79 -1.64 3.97 -0.85 -0.03 -1.63 117.35 117.85 2bx5 s TYR 49 Ca 0.07 -1.55 -0.10 0.00 -0.52 0.00 0.00 57.07 54.98 2bx5 s TYR 49 Cb -0.10 -0.90 0.09 0.00 0.38 0.00 0.00 41.96 41.43 2bx5 s TYR 49 CO 0.04 -0.67 0.39 0.00 -1.52 0.00 0.00 175.55 173.79 2bx5 n ALA 50 N -0.78 -1.66 0.00 9.51 0.00 -1.00 -1.10 120.51 125.48 2bx5 n ALA 50 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2bx5 n ALA 50 Cb 0.63 -1.89 0.00 0.00 0.00 0.00 0.00 19.45 18.19 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 -4.38 0.00 -0.02 0.00 0.00 -0.30 -3.63 120.51 112.19 2bx5 n ALA 51 Ca -0.13 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.30 2bx5 n ALA 51 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.01 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 0.47 3.87 -4.78 0.00 3.41 -0.97 -3.80 113.62 111.82 2bx5 n SER 52 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 2bx5 n SER 52 Cb 0.00 0.83 -0.01 0.00 -0.26 0.00 0.00 64.21 64.78 2bx5 n SER 52 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2bx5 s SER 53 N -3.21 6.43 -0.07 4.04 0.15 -0.26 -4.47 113.70 116.31 2bx5 s SER 53 Ca -0.02 2.96 0.02 0.00 0.70 0.00 0.00 55.95 59.61 2bx5 s SER 53 Cb 0.02 -2.66 -0.02 0.00 -1.71 0.00 0.00 66.02 61.64 2bx5 s SER 53 CO 0.19 -0.80 -0.13 -0.22 1.20 0.00 0.00 173.24 173.49 2bx5 s LEU 54 N -2.05 2.82 0.29 3.45 1.98 -1.26 -0.85 118.68 123.06 2bx5 s LEU 54 Ca 0.52 -0.19 -0.28 0.00 -2.89 0.00 0.00 54.13 51.29 2bx5 s LEU 54 Cb -0.45 -1.59 -0.09 0.00 0.66 0.00 0.00 46.19 44.72 2bx5 s LEU 54 CO 0.60 0.31 0.99 -1.10 -1.89 0.00 0.00 176.35 175.26 2bx5 s GLN 55 N -0.51 4.66 0.13 1.98 -1.52 -1.15 -4.98 119.66 118.27 2bx5 s GLN 55 Ca 0.07 1.52 -0.33 0.00 -1.95 0.00 0.00 55.36 54.67 2bx5 s GLN 55 Cb -0.12 -3.05 -0.12 0.00 -0.22 0.00 0.00 33.01 29.49 2bx5 s GLN 55 CO 0.02 0.32 1.71 0.43 -0.25 0.00 0.00 175.29 177.51 2bx5 n SER 56 N 1.01 3.58 0.00 5.90 7.64 -1.26 -2.07 113.62 128.42 2bx5 n SER 56 Ca -0.00 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.92 2bx5 n SER 56 Cb 0.48 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 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 3.86 2.99 3.67 0.23 0.00 -1.26 -5.04 105.19 109.64 2bx5 n GLY 57 Ca 0.18 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.84 5.09 0.45 1.61 0.11 -0.88 -5.02 120.40 118.92 2bx5 s VAL 58 Ca 0.00 1.04 -0.21 0.00 -2.93 0.00 0.00 61.98 59.88 2bx5 s VAL 58 Cb 0.00 -3.88 -0.12 0.00 -1.53 0.00 0.00 36.38 30.86 2bx5 s VAL 58 CO 0.00 0.18 0.53 -0.81 -3.33 0.00 0.00 175.10 171.68 2bx5 n PRO 59 N 4.67 0.57 -0.17 1.54 -0.04 -1.26 -4.72 135.00 135.59 2bx5 n PRO 59 Ca -0.04 0.21 0.04 0.00 -0.04 0.00 0.00 63.50 63.67 2bx5 n PRO 59 Cb 0.50 -1.55 0.12 0.00 -0.04 0.00 0.00 33.50 32.54 2bx5 n PRO 59 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2bx5 n SER 60 N 1.14 1.67 -0.31 3.54 3.41 -1.26 -3.42 113.62 118.40 2bx5 n SER 60 Ca 0.11 -2.06 0.12 0.00 -0.26 0.00 0.00 58.87 56.78 2bx5 n SER 60 Cb 0.41 -0.25 0.21 0.00 -0.26 0.00 0.00 64.21 64.33 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 0.28 0.89 -3.46 4.33 1.85 -1.26 -4.80 116.66 114.49 2bx5 n ARG 61 Ca 0.09 -0.63 -0.37 0.00 -1.00 0.00 0.00 57.85 55.95 2bx5 n ARG 61 Cb 0.29 -1.49 -0.06 0.00 -1.05 0.00 0.00 32.46 30.16 2bx5 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2bx5 s PHE 62 N -2.54 3.70 0.26 2.89 0.40 -1.22 -0.25 117.98 121.22 2bx5 s PHE 62 Ca 0.21 1.01 -0.15 0.00 -0.60 0.00 0.00 56.93 57.40 2bx5 s PHE 62 Cb 0.19 -2.31 0.06 0.00 0.51 0.00 0.00 43.02 41.46 2bx5 s PHE 62 CO 0.56 0.59 0.75 -1.13 0.70 0.00 0.00 175.22 176.69 2bx5 n SER 63 N 1.52 -1.73 -3.96 1.36 3.41 1.00 -4.98 113.62 110.24 2bx5 n SER 63 Ca -0.11 -2.09 -0.12 0.00 -0.26 0.00 0.00 58.87 56.28 2bx5 n SER 63 Cb 0.52 2.86 -0.13 0.00 -0.26 0.00 0.00 64.21 67.20 2bx5 n SER 63 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2bx5 s GLY 64 N -2.92 0.23 -0.01 5.00 0.00 -1.26 -0.52 107.32 107.84 2bx5 s GLY 64 Ca 0.16 -0.36 -0.14 0.00 0.00 0.00 0.00 44.72 44.38 2bx5 s GLY 64 CO 0.08 -0.37 0.29 -1.35 0.00 0.00 0.00 173.10 171.74 2bx5 s SER 65 N -0.70 -0.16 0.40 1.64 1.04 -1.20 -4.53 113.70 110.19 2bx5 s SER 65 Ca -0.05 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.39 2bx5 s SER 65 Cb -0.05 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.37 2bx5 s SER 65 CO -0.00 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.37 2bx5 n GLY 66 N 1.21 -0.08 0.00 7.32 0.00 -1.26 -3.40 105.19 108.98 2bx5 n GLY 66 Ca -0.21 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2bx5 n GLY 66 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bx5 n SER 67 N -3.60 0.00 0.00 1.61 3.41 -0.60 -4.80 113.62 109.64 2bx5 n SER 67 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2bx5 n SER 67 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2bx5 n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bx5 n GLY 68 N 0.00 1.25 0.00 5.00 0.00 -1.11 -1.58 105.19 108.75 2bx5 n GLY 68 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2bx5 n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2bx5 n THR 69 N 0.00 0.00 -4.15 2.61 -1.04 -1.26 -0.57 114.28 109.87 2bx5 n THR 69 Ca 0.00 -0.17 -0.25 0.00 -2.04 0.00 0.00 64.05 61.59 2bx5 n THR 69 Cb 0.00 0.87 -0.17 0.00 -1.82 0.00 0.00 70.33 69.21 2bx5 n THR 69 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2bx5 s ASP 70 N -0.47 1.82 0.05 8.00 -1.08 -0.62 -2.53 116.67 121.84 2bx5 s ASP 70 Ca 0.00 -0.26 0.04 0.00 -0.52 0.00 0.00 52.55 51.81 2bx5 s ASP 70 Cb 0.00 -0.74 -0.03 0.00 -1.46 0.00 0.00 42.92 40.69 2bx5 s ASP 70 CO 0.00 -0.07 -0.12 -0.36 0.52 0.00 0.00 175.17 175.14 2bx5 s PHE 71 N 1.28 1.02 -0.09 -5.34 0.40 -0.64 -1.55 117.98 113.06 2bx5 s PHE 71 Ca -0.04 -0.44 -0.00 0.00 -0.60 0.00 0.00 56.93 55.85 2bx5 s PHE 71 Cb -0.14 -0.59 0.02 0.00 0.51 0.00 0.00 43.02 42.83 2bx5 s PHE 71 CO -0.03 0.01 -0.06 0.99 0.70 0.00 0.00 175.22 176.83 2bx5 s THR 72 N -1.20 0.82 -0.14 0.64 2.01 -1.22 -1.78 115.64 114.77 2bx5 s THR 72 Ca -0.04 -0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.49 2bx5 s THR 72 Cb -0.09 -0.87 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 2bx5 s THR 72 CO 0.01 0.33 1.42 -0.22 -0.69 0.00 0.00 174.62 175.47 2bx5 s LEU 73 N 1.67 4.18 -0.19 4.42 2.96 -1.20 -3.22 118.68 127.30 2bx5 s LEU 73 Ca 0.03 1.83 -0.02 0.00 -0.22 0.00 0.00 54.13 55.75 2bx5 s LEU 73 Cb -0.13 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.03 2bx5 s LEU 73 CO -0.06 -0.88 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.10 2bx5 s THR 74 N 3.88 2.94 -0.43 3.68 2.01 0.32 -1.99 115.64 126.04 2bx5 s THR 74 Ca 0.62 -0.65 -0.16 0.00 0.31 0.00 0.00 61.69 61.81 2bx5 s THR 74 Cb -0.25 -2.30 0.03 0.00 0.01 0.00 0.00 72.50 69.99 2bx5 s THR 74 CO 0.21 0.47 0.37 -0.63 -0.69 0.00 0.00 174.62 174.35 2bx5 s ILE 75 N 1.23 5.19 0.36 1.82 1.01 -1.14 -0.00 121.20 129.67 2bx5 s ILE 75 Ca 0.03 -0.63 0.07 0.00 0.00 0.00 0.00 60.65 60.12 2bx5 s ILE 75 Cb -0.14 -4.01 0.30 0.00 0.01 0.00 0.00 42.46 38.63 2bx5 s ILE 75 CO -0.04 -0.40 1.92 0.77 0.00 0.00 0.00 174.94 177.19 2bx5 h SER 76 N 8.69 0.67 -1.42 3.58 4.64 -0.89 -1.54 113.55 127.28 2bx5 h SER 76 Ca -0.27 0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 60.99 2bx5 h SER 76 Cb 1.11 -0.12 -0.25 0.00 -0.31 0.00 0.00 62.40 62.83 2bx5 h SER 76 CO 0.78 0.40 -0.44 -0.55 -0.87 0.00 0.00 176.83 176.15 2bx5 s SER 77 N -6.04 -0.51 0.97 4.97 0.15 -1.26 -3.25 113.70 108.72 2bx5 s SER 77 Ca -0.10 0.09 -0.12 0.00 0.70 0.00 0.00 55.95 56.51 2bx5 s SER 77 Cb 0.20 1.55 0.09 0.00 -1.71 0.00 0.00 66.02 66.15 2bx5 s SER 77 CO 0.78 -0.31 0.63 -0.11 1.20 0.00 0.00 173.24 175.42 2bx5 n LEU 78 N 5.39 0.58 -3.99 3.45 7.94 -0.79 -4.60 117.00 124.98 2bx5 n LEU 78 Ca 0.01 0.29 -0.10 0.00 -1.11 0.00 0.00 56.01 55.10 2bx5 n LEU 78 Cb 0.51 -1.27 -0.07 0.00 0.53 0.00 0.00 43.42 43.12 2bx5 n LEU 78 CO -0.01 -3.13 0.02 -1.10 -1.11 0.00 0.00 177.39 172.07 2bx5 s GLN 79 N -3.97 1.27 -0.18 1.96 -1.52 -1.26 -1.12 119.66 114.85 2bx5 s GLN 79 Ca 0.60 -1.23 0.01 0.00 -1.95 0.00 0.00 55.36 52.80 2bx5 s GLN 79 Cb -0.21 0.40 0.24 0.00 -0.22 0.00 0.00 33.01 33.21 2bx5 s GLN 79 CO 0.64 -0.48 1.45 -0.35 -0.25 0.00 0.00 175.29 176.30 2bx5 n PRO 80 N -0.27 1.49 0.00 2.91 -0.05 -1.26 -2.39 135.00 135.43 2bx5 n PRO 80 Ca -0.05 -1.14 0.00 0.00 -0.05 0.00 0.00 63.50 62.26 2bx5 n PRO 80 Cb 0.63 -1.45 0.00 0.00 -0.05 0.00 0.00 33.50 32.63 2bx5 n PRO 80 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 175.50 174.60 2bx5 n GLU 81 N 0.00 0.52 -0.25 0.54 0.28 -1.26 -4.50 120.64 115.97 2bx5 n GLU 81 Ca 0.23 -0.62 0.06 0.00 -0.16 0.00 0.00 57.16 56.67 2bx5 n GLU 81 Cb 0.88 -0.62 0.18 0.00 1.43 0.00 0.00 31.44 33.31 2bx5 n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2bx5 n ASP 82 N -0.09 3.20 -4.56 -1.84 9.92 -1.01 -4.84 116.55 117.33 2bx5 n ASP 82 Ca 0.00 -2.28 -0.35 0.00 -0.53 0.00 0.00 54.79 51.64 2bx5 n ASP 82 Cb 0.39 -0.32 -0.04 0.00 -0.64 0.00 0.00 41.12 40.52 2bx5 n ASP 82 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2bx5 s PHE 83 N -1.50 2.03 -0.09 1.24 5.36 -1.26 -4.81 117.98 118.96 2bx5 s PHE 83 Ca 0.28 0.19 -0.32 0.00 -0.96 0.00 0.00 56.93 56.13 2bx5 s PHE 83 Cb 0.18 -4.30 0.12 0.00 -0.34 0.00 0.00 43.02 38.68 2bx5 s PHE 83 CO 0.14 -1.96 1.11 0.00 -1.46 0.00 0.00 175.22 173.05 2bx5 s ALA 84 N 7.96 -1.99 0.10 11.12 0.00 -0.91 -4.64 121.76 133.40 2bx5 s ALA 84 Ca 0.58 1.18 -0.20 0.00 0.00 0.00 0.00 51.96 53.53 2bx5 s ALA 84 Cb -0.06 0.16 -0.07 0.00 0.00 0.00 0.00 23.12 23.15 2bx5 s ALA 84 CO 0.04 -0.73 0.61 0.99 0.00 0.00 0.00 175.76 176.67 2bx5 s THR 85 N -2.68 4.68 -0.10 0.00 2.01 -0.71 -1.64 115.64 117.20 2bx5 s THR 85 Ca 0.09 1.27 0.03 0.00 0.31 0.00 0.00 61.69 63.39 2bx5 s THR 85 Cb -0.00 -3.92 -0.01 0.00 0.01 0.00 0.00 72.50 68.58 2bx5 s THR 85 CO -0.05 0.50 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.86 2bx5 s TYR 86 N -1.18 2.61 -0.07 4.92 1.51 -1.21 -0.06 117.35 123.87 2bx5 s TYR 86 Ca 0.32 -0.87 0.02 0.00 -1.01 0.00 0.00 57.07 55.53 2bx5 s TYR 86 Cb -0.19 -1.72 0.01 0.00 -0.11 0.00 0.00 41.96 39.94 2bx5 s TYR 86 CO 0.20 -0.32 -0.12 0.71 -1.11 0.00 0.00 175.55 174.91 2bx5 s TYR 87 N 0.23 1.48 -0.21 2.71 1.51 -0.85 -1.76 117.35 120.47 2bx5 s TYR 87 Ca -0.14 -0.56 -0.18 0.00 -1.01 0.00 0.00 57.07 55.18 2bx5 s TYR 87 Cb -0.17 -1.09 -0.03 0.00 -0.11 0.00 0.00 41.96 40.56 2bx5 s TYR 87 CO 0.07 -0.29 0.50 0.00 -1.11 0.00 0.00 175.55 174.72 2bx5 s GLN 89 N 1.71 3.73 -0.16 0.00 0.74 0.45 0.46 119.66 126.58 2bx5 s GLN 89 Ca 0.23 -0.32 -0.29 0.00 0.05 0.00 0.00 55.36 55.03 2bx5 s GLN 89 Cb -0.15 -3.14 -0.00 0.00 1.10 0.00 0.00 33.01 30.81 2bx5 s GLN 89 CO 0.09 0.43 0.99 -1.14 -0.55 0.00 0.00 175.29 175.12 2bx5 s GLN 90 N -0.07 4.35 -0.15 1.67 0.74 -0.41 -1.20 119.66 124.57 2bx5 s GLN 90 Ca 0.07 1.33 0.17 0.00 0.05 0.00 0.00 55.36 56.97 2bx5 s GLN 90 Cb -0.12 -3.58 0.74 0.00 1.10 0.00 0.00 33.01 31.15 2bx5 s GLN 90 CO 0.01 -0.43 1.65 0.45 -0.55 0.00 0.00 175.29 176.42 2bx5 n SER 91 N 5.51 5.00 -0.12 6.67 2.88 0.44 -3.72 113.62 130.28 2bx5 n SER 91 Ca 0.09 -2.61 -0.16 0.00 -1.33 0.00 0.00 58.87 54.86 2bx5 n SER 91 Cb 0.48 -0.60 -0.11 0.00 -0.75 0.00 0.00 64.21 63.22 2bx5 n SER 91 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bx5 n TYR 92 N 0.89 0.00 -4.41 0.66 9.36 -1.26 -4.97 117.16 117.42 2bx5 n TYR 92 Ca 0.26 0.00 -0.22 0.00 3.32 0.00 0.00 57.90 61.27 2bx5 n TYR 92 Cb 0.98 -0.90 -0.09 0.00 -0.63 0.00 0.00 39.34 38.70 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 -6.22 2.10 -0.07 2.98 0.15 -1.26 -5.12 113.70 106.26 2bx5 s SER 93 Ca -0.30 -1.57 0.04 0.00 0.70 0.00 0.00 55.95 54.82 2bx5 s SER 93 Cb 0.08 0.35 -0.01 0.00 -1.71 0.00 0.00 66.02 64.73 2bx5 s SER 93 CO 0.55 -0.86 -0.20 0.42 1.20 0.00 0.00 173.24 174.35 2bx5 s THR 94 N -3.42 2.46 0.44 6.45 -4.23 -1.26 -2.75 115.64 113.33 2bx5 s THR 94 Ca 0.32 -0.91 -0.21 0.00 -1.18 0.00 0.00 61.69 59.70 2bx5 s THR 94 Cb 0.05 -1.94 -0.10 0.00 1.34 0.00 0.00 72.50 71.84 2bx5 s THR 94 CO 0.16 0.56 0.98 -2.16 -0.54 0.00 0.00 174.62 173.63 2bx5 s PRO 95 N -0.14 4.13 0.18 3.99 0.04 -1.26 -4.52 135.00 137.42 2bx5 s PRO 95 Ca -0.03 1.23 -0.31 0.00 0.04 0.00 0.00 61.00 61.93 2bx5 s PRO 95 Cb -0.14 -2.22 -0.10 0.00 0.04 0.00 0.00 34.50 32.08 2bx5 s PRO 95 CO 0.04 -0.13 1.49 -0.80 0.04 0.00 0.00 177.00 177.64 2bx5 s ASN 96 N -2.04 6.65 -0.08 6.66 0.01 -1.11 -4.81 114.94 120.22 2bx5 s ASN 96 Ca 0.62 2.57 -0.00 0.00 -0.71 0.00 0.00 52.86 55.35 2bx5 s ASN 96 Cb -0.13 -2.60 -0.03 0.00 0.41 0.00 0.00 41.25 38.90 2bx5 s ASN 96 CO 0.17 -0.75 -0.04 0.42 -1.51 0.00 0.00 177.10 175.38 2bx5 s THR 97 N 0.78 3.90 0.00 1.60 -4.23 -1.24 -4.92 115.64 111.53 2bx5 s THR 97 Ca 0.66 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.77 2bx5 s THR 97 Cb -0.42 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 70.80 2bx5 s THR 97 CO 0.35 0.59 0.00 0.49 -0.54 0.00 0.00 174.62 175.51 2bx5 n PHE 98 N 2.28 -3.00 0.00 3.99 3.01 -1.26 -1.29 117.46 121.19 2bx5 n PHE 98 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 2bx5 n PHE 98 Cb 0.53 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.00 2bx5 n PHE 98 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2bx5 n GLY 99 N 3.99 0.83 0.00 1.37 0.00 0.17 -4.10 105.19 107.46 2bx5 n GLY 99 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2bx5 n GLY 99 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bx5 n GLN 100 N 0.00 3.68 0.00 1.61 6.02 -1.26 -4.90 117.38 122.54 2bx5 n GLN 100 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2bx5 n GLN 100 Cb 0.00 -0.31 0.00 0.00 1.02 0.00 0.00 30.24 30.95 2bx5 n GLN 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2bx5 n GLY 101 N 0.00 -0.95 2.94 1.08 0.00 -1.26 -4.96 105.19 102.05 2bx5 n GLY 101 Ca 0.00 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.53 1.88 -0.71 2.61 2.01 -0.72 -4.24 115.64 113.94 2bx5 s THR 102 Ca 0.00 -2.03 -0.26 0.00 0.31 0.00 0.00 61.69 59.71 2bx5 s THR 102 Cb 0.00 -2.38 -0.01 0.00 0.01 0.00 0.00 72.50 70.12 2bx5 s THR 102 CO 0.00 -0.58 1.77 -0.54 -0.69 0.00 0.00 174.62 174.58 2bx5 s LYS 103 N 1.11 2.74 -1.13 4.92 1.02 -0.96 -3.36 119.74 124.09 2bx5 s LYS 103 Ca 0.09 0.22 -0.17 0.00 0.02 0.00 0.00 55.97 56.13 2bx5 s LYS 103 Cb -0.19 -4.53 0.12 0.00 -0.52 0.00 0.00 37.83 32.72 2bx5 s LYS 103 CO -0.12 -2.74 1.42 0.08 -0.92 0.00 0.00 175.35 173.06 2bx5 s VAL 104 N 8.56 4.62 0.82 3.17 1.01 -0.65 -3.29 120.40 134.64 2bx5 s VAL 104 Ca 0.62 -1.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.51 2bx5 s VAL 104 Cb -0.10 -4.96 0.09 0.00 0.00 0.00 0.00 36.38 31.41 2bx5 s VAL 104 CO 0.14 -1.72 1.18 -1.83 0.00 0.00 0.00 175.10 172.88 2bx5 s GLU 105 N 2.86 1.88 0.00 2.72 -1.05 -1.18 -2.15 118.70 121.78 2bx5 s GLU 105 Ca 0.43 0.06 0.00 0.00 -0.15 0.00 0.00 54.97 55.31 2bx5 s GLU 105 Cb -0.02 -1.95 0.00 0.00 -0.44 0.00 0.00 34.13 31.72 2bx5 s GLU 105 CO -0.02 -1.64 0.25 1.51 0.95 0.00 0.00 175.26 176.31