#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3db5 s VAL 5 N 0.00 5.07 -0.05 0.52 0.11 -1.26 -5.08 120.40 119.70 3db5 s VAL 5 Ca 0.00 0.31 0.00 0.00 -2.93 0.00 0.00 61.98 59.36 3db5 s VAL 5 Cb 0.00 -3.63 -0.03 0.00 -1.53 0.00 0.00 36.38 31.18 3db5 s VAL 5 CO 0.00 0.09 -0.03 0.28 -3.33 0.00 0.00 175.10 172.11 3db5 s THR 6 N -1.62 4.00 -0.15 5.04 -1.32 -1.26 -5.11 115.64 115.22 3db5 s THR 6 Ca 0.40 -0.45 -0.05 0.00 -1.21 0.00 0.00 61.69 60.38 3db5 s THR 6 Cb -0.12 -2.69 -0.03 0.00 -1.51 0.00 0.00 72.50 68.14 3db5 s THR 6 CO 0.22 0.54 0.02 -0.36 -2.21 0.00 0.00 174.62 172.82 3db5 s PHE 7 N -0.91 3.17 -0.30 9.09 0.40 -1.26 -5.08 117.98 123.09 3db5 s PHE 7 Ca 0.15 -0.01 -0.09 0.00 -0.60 0.00 0.00 56.93 56.38 3db5 s PHE 7 Cb -0.11 -1.98 -0.01 0.00 0.51 0.00 0.00 43.02 41.43 3db5 s PHE 7 CO 0.04 0.18 0.13 0.08 0.70 0.00 0.00 175.22 176.35 3db5 s VAL 8 N 0.06 4.49 0.69 -0.44 1.01 -1.26 -5.11 120.40 119.85 3db5 s VAL 8 Ca 0.03 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.48 3db5 s VAL 8 Cb -0.13 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 32.99 3db5 s VAL 8 CO 0.02 0.10 1.07 -2.16 0.00 0.00 0.00 175.10 174.13 3db5 s PRO 9 N 1.60 2.96 0.76 2.72 0.04 -1.26 -5.04 135.00 136.78 3db5 s PRO 9 Ca 0.05 0.62 -0.13 0.00 0.04 0.00 0.00 61.00 61.57 3db5 s PRO 9 Cb -0.17 -2.02 0.06 0.00 0.04 0.00 0.00 34.50 32.41 3db5 s PRO 9 CO 0.05 -1.00 1.16 -0.51 0.04 0.00 0.00 177.00 176.74 3db5 s ASP 10 N -4.18 4.14 0.01 6.66 1.01 -1.26 -4.96 116.67 118.09 3db5 s ASP 10 Ca 0.58 2.18 -0.30 0.00 0.71 0.00 0.00 52.55 55.71 3db5 s ASP 10 Cb -0.12 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.17 3db5 s ASP 10 CO 0.53 -2.29 1.77 -0.89 0.21 0.00 0.00 175.17 174.50 3db5 s THR 11 N -2.33 3.24 0.51 -1.27 2.01 -1.26 -4.97 115.64 111.57 3db5 s THR 11 Ca 0.69 0.40 -0.22 0.00 0.31 0.00 0.00 61.69 62.87 3db5 s THR 11 Cb -0.24 -3.26 -0.07 0.00 0.01 0.00 0.00 72.50 68.94 3db5 s THR 11 CO 0.49 -0.03 1.09 -2.65 -0.69 0.00 0.00 174.62 172.83 3db5 n PRO 12 N 6.93 1.34 -3.24 4.92 -0.02 -1.26 -4.95 135.00 138.72 3db5 n PRO 12 Ca 0.18 0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 61.75 3db5 n PRO 12 Cb 0.42 -2.23 -0.08 0.00 -0.02 0.00 0.00 33.50 31.59 3db5 n PRO 12 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3db5 s ILE 13 N -1.36 5.06 0.72 4.25 -0.00 -1.26 -5.07 121.20 123.54 3db5 s ILE 13 Ca 0.69 0.80 -0.12 0.00 -0.00 0.00 0.00 60.65 62.02 3db5 s ILE 13 Cb -0.47 -3.84 0.03 0.00 -0.00 0.00 0.00 42.46 38.17 3db5 s ILE 13 CO 0.52 0.05 1.09 -1.61 -0.00 0.00 0.00 174.94 174.99 3db5 s GLU 14 N 2.32 2.58 0.71 0.37 2.02 -1.26 -5.03 118.70 120.42 3db5 s GLU 14 Ca 0.21 1.20 -0.16 0.00 0.02 0.00 0.00 54.97 56.24 3db5 s GLU 14 Cb -0.16 -1.94 0.03 0.00 0.10 0.00 0.00 34.13 32.17 3db5 s GLU 14 CO 0.10 -1.39 1.22 -1.54 0.02 0.00 0.00 175.26 173.66 3db5 s SER 15 N -3.18 4.28 0.28 -0.19 1.04 -1.26 -4.79 113.70 109.87 3db5 s SER 15 Ca 0.62 2.40 0.02 0.00 0.48 0.00 0.00 55.95 59.47 3db5 s SER 15 Cb -0.17 -2.59 0.61 0.00 0.10 0.00 0.00 66.02 63.96 3db5 s SER 15 CO 0.50 -2.20 1.77 -0.09 0.98 0.00 0.00 173.24 174.20 3db5 h ARG 16 N -0.12 0.67 -0.60 4.02 2.43 -1.84 -1.00 114.38 117.94 3db5 h ARG 16 Ca -0.48 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.64 3db5 h ARG 16 Cb 1.30 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 3db5 h ARG 16 CO 0.50 0.45 0.36 0.00 -1.51 0.00 0.00 179.97 179.76 3db5 h ALA 17 N 1.59 0.76 -0.35 2.80 0.00 -0.93 -1.04 119.26 122.09 3db5 h ALA 17 Ca 0.51 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.19 3db5 h ALA 17 Cb 0.74 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3db5 h ALA 17 CO -0.37 0.25 -0.37 0.00 0.00 0.00 0.00 179.25 178.76 3db5 h ARG 18 N 0.81 0.87 -0.13 0.00 3.08 -1.72 -2.68 114.38 114.61 3db5 h ARG 18 Ca 0.21 -0.47 -0.08 0.00 0.07 0.00 0.00 59.98 59.72 3db5 h ARG 18 Cb -0.01 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3db5 h ARG 18 CO -0.04 1.11 -0.27 -0.07 -1.07 0.00 0.00 179.97 179.63 3db5 h LEU 19 N 0.67 0.24 -0.48 3.04 3.38 -0.87 -2.77 115.31 118.51 3db5 h LEU 19 Ca 0.05 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3db5 h LEU 19 Cb 0.96 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3db5 h LEU 19 CO 0.09 0.52 0.00 -1.54 0.09 0.00 0.00 178.44 177.60 3db5 n SER 20 N -4.14 0.67 -4.69 -0.43 3.41 -0.42 -4.86 113.62 103.16 3db5 n SER 20 Ca -0.01 0.63 -0.53 0.00 -0.26 0.00 0.00 58.87 58.71 3db5 n SER 20 Cb 0.38 -0.79 -0.06 0.00 -0.26 0.00 0.00 64.21 63.48 3db5 n SER 20 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3db5 n LEU 21 N -2.21 2.83 -4.61 1.04 7.94 -1.05 -4.78 117.00 116.16 3db5 n LEU 21 Ca 0.03 1.03 -0.46 0.00 -1.11 0.00 0.00 56.01 55.50 3db5 n LEU 21 Cb 0.28 -1.26 -0.03 0.00 0.53 0.00 0.00 43.42 42.95 3db5 n LEU 21 CO 0.23 -0.30 0.78 -2.65 -1.11 0.00 0.00 177.39 174.34 3db5 n PRO 22 N 5.66 1.52 0.31 1.96 -0.02 -1.26 -4.88 135.00 138.29 3db5 n PRO 22 Ca 0.24 0.54 0.18 0.00 -2.02 0.00 0.00 63.50 62.44 3db5 n PRO 22 Cb 0.21 -2.06 1.03 0.00 -0.02 0.00 0.00 33.50 32.67 3db5 n PRO 22 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3db5 h LYS 23 N 3.25 0.00 0.00 -0.52 -0.00 -1.98 -1.86 116.57 115.46 3db5 h LYS 23 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.22 3db5 h LYS 23 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.55 3db5 h LYS 23 CO 0.69 0.01 0.00 0.00 -0.00 0.00 0.00 179.45 180.15 3db5 n GLN 24 N -3.50 0.70 -4.43 0.07 0.00 -1.26 -4.81 117.38 104.15 3db5 n GLN 24 Ca -0.03 0.01 -0.25 0.00 0.00 0.00 0.00 57.00 56.73 3db5 n GLN 24 Cb 0.09 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 28.73 3db5 n GLN 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3db5 s LEU 25 N -2.19 2.63 0.08 2.61 1.43 -0.70 -0.74 118.68 121.80 3db5 s LEU 25 Ca 0.36 -0.91 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 3db5 s LEU 25 Cb 0.19 -1.22 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 3db5 s LEU 25 CO 0.35 0.06 -0.07 0.68 0.23 0.00 0.00 176.35 177.60 3db5 s VAL 26 N -2.20 0.68 -0.22 -1.59 -7.23 0.22 -4.77 120.40 105.29 3db5 s VAL 26 Ca 0.27 -1.66 -0.11 0.00 -1.81 0.00 0.00 61.98 58.67 3db5 s VAL 26 Cb -0.06 -1.34 -0.05 0.00 0.56 0.00 0.00 36.38 35.49 3db5 s VAL 26 CO 0.14 -0.70 0.19 -0.76 -0.31 0.00 0.00 175.10 173.66 3db5 s LEU 27 N -2.55 4.16 0.21 1.32 1.43 -1.26 0.13 118.68 122.12 3db5 s LEU 27 Ca 0.05 0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 53.20 3db5 s LEU 27 Cb -0.00 -2.17 0.03 0.00 0.03 0.00 0.00 46.19 44.08 3db5 s LEU 27 CO -0.03 0.09 0.55 0.00 0.23 0.00 0.00 176.35 177.20 3db5 s ARG 28 N 0.79 1.43 0.07 1.70 1.70 -0.73 -4.96 118.95 118.95 3db5 s ARG 28 Ca 0.10 -0.87 -0.36 0.00 -0.47 0.00 0.00 55.73 54.13 3db5 s ARG 28 Cb -0.13 0.53 -0.15 0.00 -0.57 0.00 0.00 34.95 34.63 3db5 s ARG 28 CO 0.03 -0.62 1.49 0.94 -1.08 0.00 0.00 175.30 176.06 3db5 n GLN 29 N -0.36 1.55 -1.92 3.89 7.27 -1.26 0.59 117.38 127.13 3db5 n GLN 29 Ca -0.09 0.56 -0.34 0.00 0.07 0.00 0.00 57.00 57.19 3db5 n GLN 29 Cb 0.62 -2.26 0.04 0.00 2.41 0.00 0.00 30.24 31.05 3db5 n GLN 29 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 3db5 s SER 30 N 1.11 5.17 0.00 1.69 0.15 -1.26 -4.57 113.70 116.00 3db5 s SER 30 Ca 0.84 2.20 0.00 0.00 0.70 0.00 0.00 55.95 59.69 3db5 s SER 30 Cb -0.86 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 60.88 3db5 s SER 30 CO 0.46 -1.60 0.24 0.00 1.20 0.00 0.00 173.24 173.55 3db5 n ILE 31 N -1.93 0.19 -0.15 6.45 0.13 -1.26 -4.95 119.36 117.83 3db5 n ILE 31 Ca 0.12 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.77 3db5 n ILE 31 Cb 0.51 -0.46 0.00 0.00 -0.84 0.00 0.00 39.64 38.85 3db5 n ILE 31 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3db5 n GLU 35 N 0.66 2.14 -2.19 9.51 -0.58 -1.26 -5.10 120.64 123.81 3db5 n GLU 35 Ca 0.00 -0.16 -0.41 0.00 -0.42 0.00 0.00 57.16 56.17 3db5 n GLU 35 Cb 0.12 -0.58 -0.03 0.00 -0.57 0.00 0.00 31.44 30.38 3db5 n GLU 35 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3db5 s VAL 36 N -0.35 2.92 0.37 2.62 -7.23 -1.26 -4.44 120.40 113.03 3db5 s VAL 36 Ca 0.00 0.90 0.04 0.00 -1.81 0.00 0.00 61.98 61.11 3db5 s VAL 36 Cb 0.00 -3.57 -0.05 0.00 0.56 0.00 0.00 36.38 33.32 3db5 s VAL 36 CO 0.00 0.20 0.07 -0.83 -0.31 0.00 0.00 175.10 174.23 3db5 s GLY 37 N -0.43 2.35 -0.25 2.32 0.00 0.20 -4.57 107.32 106.95 3db5 s GLY 37 Ca 0.49 -1.69 -0.08 0.00 0.00 0.00 0.00 44.72 43.44 3db5 s GLY 37 CO 0.49 -1.88 0.08 0.14 0.00 0.00 0.00 173.10 171.92 3db5 s VAL 38 N -3.18 4.47 0.24 1.40 1.01 -1.25 -1.78 120.40 121.30 3db5 s VAL 38 Ca 0.30 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 62.26 3db5 s VAL 38 Cb 0.06 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 3db5 s VAL 38 CO 0.14 0.34 -0.07 0.26 0.00 0.00 0.00 175.10 175.77 3db5 s TRP 39 N 1.53 2.60 0.04 5.22 0.52 0.35 0.55 118.94 129.75 3db5 s TRP 39 Ca 0.06 -0.24 -0.27 0.00 0.02 0.00 0.00 56.10 55.66 3db5 s TRP 39 Cb -0.15 -1.19 -0.05 0.00 -1.15 0.00 0.00 33.47 30.93 3db5 s TRP 39 CO 0.04 0.60 0.86 0.95 0.02 0.00 0.00 176.95 179.42 3db5 s THR 40 N -2.11 4.75 -1.61 2.01 -4.23 0.14 0.69 115.64 115.27 3db5 s THR 40 Ca 0.29 1.82 0.26 0.00 -1.18 0.00 0.00 61.69 62.88 3db5 s THR 40 Cb -0.07 -4.21 0.22 0.00 1.34 0.00 0.00 72.50 69.78 3db5 s THR 40 CO 0.17 0.29 1.55 0.61 -0.54 0.00 0.00 174.62 176.70 3db5 n GLY 41 N 2.57 -0.74 3.82 3.99 0.00 0.08 -0.34 105.19 114.57 3db5 n GLY 41 Ca 0.01 -0.39 -0.05 0.00 0.00 0.00 0.00 46.02 45.59 3db5 n GLY 41 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3db5 s GLU 42 N -2.60 1.59 0.20 1.61 -1.05 -1.25 -4.81 118.70 112.40 3db5 s GLU 42 Ca 0.22 -0.95 -0.31 0.00 -0.15 0.00 0.00 54.97 53.79 3db5 s GLU 42 Cb 0.19 0.50 -0.10 0.00 -0.44 0.00 0.00 34.13 34.28 3db5 s GLU 42 CO 0.55 -0.74 1.46 0.99 0.95 0.00 0.00 175.26 178.47 3db5 s THR 43 N -3.03 2.79 -0.34 1.83 2.01 -1.26 -3.92 115.64 113.71 3db5 s THR 43 Ca 0.14 0.62 -0.08 0.00 0.31 0.00 0.00 61.69 62.68 3db5 s THR 43 Cb -0.04 -3.40 0.03 0.00 0.01 0.00 0.00 72.50 69.11 3db5 s THR 43 CO 0.06 0.08 0.14 -0.63 -0.69 0.00 0.00 174.62 173.58 3db5 s ILE 44 N 0.48 4.13 0.58 1.82 -1.09 0.29 -4.96 121.20 122.45 3db5 s ILE 44 Ca 0.63 -0.94 -0.20 0.00 -2.23 0.00 0.00 60.65 57.91 3db5 s ILE 44 Cb -0.41 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.15 3db5 s ILE 44 CO 0.38 -0.15 1.28 -2.84 -1.23 0.00 0.00 174.94 172.37 3db5 s PRO 45 N 1.48 2.97 0.72 2.79 0.02 -1.26 -0.21 135.00 141.51 3db5 s PRO 45 Ca 0.01 2.02 -0.17 0.00 0.02 0.00 0.00 61.00 62.88 3db5 s PRO 45 Cb -0.19 -2.05 -0.11 0.00 0.02 0.00 0.00 34.50 32.17 3db5 s PRO 45 CO 0.04 -1.26 -0.06 1.55 -0.33 0.00 0.00 177.00 176.94 3db5 n VAL 46 N -1.40 0.61 -3.41 3.83 3.14 -1.22 -2.78 118.33 117.11 3db5 n VAL 46 Ca 0.13 -0.46 -0.25 0.00 -2.96 0.00 0.00 64.34 60.80 3db5 n VAL 46 Cb 0.48 -0.27 0.02 0.00 -1.06 0.00 0.00 33.84 33.01 3db5 n VAL 46 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 3db5 n ARG 47 N 0.91 -4.85 -3.44 1.45 1.74 -0.99 -4.91 116.66 106.57 3db5 n ARG 47 Ca 0.06 0.68 -0.38 0.00 -0.77 0.00 0.00 57.85 57.44 3db5 n ARG 47 Cb 0.51 -5.52 -0.08 0.00 -1.02 0.00 0.00 32.46 26.35 3db5 n ARG 47 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3db5 s THR 48 N -3.14 5.23 -0.10 0.55 2.01 -1.12 -4.91 115.64 114.17 3db5 s THR 48 Ca 0.45 0.62 -0.01 0.00 0.31 0.00 0.00 61.69 63.06 3db5 s THR 48 Cb -0.22 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.57 3db5 s THR 48 CO 0.56 0.28 -0.07 0.00 -0.69 0.00 0.00 174.62 174.70 3db5 s PHE 50 N -0.28 2.53 0.00 0.00 0.08 0.78 -4.96 117.98 116.14 3db5 s PHE 50 Ca 0.04 -0.27 0.00 0.00 0.12 0.00 0.00 56.93 56.82 3db5 s PHE 50 Cb -0.13 -1.44 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 3db5 s PHE 50 CO 0.02 0.26 0.00 0.41 -0.10 0.00 0.00 175.22 175.81 3db5 n GLY 51 N 1.47 1.05 3.86 4.36 0.00 -1.26 -1.13 105.19 113.54 3db5 n GLY 51 Ca -0.16 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.56 3db5 n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3db5 s PRO 52 N -1.02 3.72 0.24 1.61 0.04 -1.26 -5.07 135.00 133.26 3db5 s PRO 52 Ca 0.00 0.85 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 3db5 s PRO 52 Cb 0.00 -2.10 -0.14 0.00 0.04 0.00 0.00 34.50 32.30 3db5 s PRO 52 CO 0.00 -0.46 1.27 -0.11 0.04 0.00 0.00 177.00 177.73 3db5 n LEU 53 N -2.26 2.48 -4.34 -3.56 7.94 0.48 -4.96 117.00 112.79 3db5 n LEU 53 Ca 0.06 1.15 -0.33 0.00 -1.11 0.00 0.00 56.01 55.78 3db5 n LEU 53 Cb 0.54 -1.35 -0.14 0.00 0.53 0.00 0.00 43.42 43.00 3db5 n LEU 53 CO 0.53 -0.86 -0.44 -0.63 -1.11 0.00 0.00 177.39 174.88 3db5 s ILE 54 N -0.34 3.07 0.09 1.96 1.01 -1.26 -4.69 121.20 121.04 3db5 s ILE 54 Ca 0.67 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 60.67 3db5 s ILE 54 Cb -0.71 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 39.45 3db5 s ILE 54 CO 0.53 0.50 0.14 0.61 0.00 0.00 0.00 174.94 176.72 3db5 n GLY 55 N 3.90 2.59 3.63 6.18 0.00 -1.25 -2.51 105.19 117.73 3db5 n GLY 55 Ca -0.18 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 3db5 n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3db5 s GLN 56 N -2.15 3.91 0.00 1.61 -0.21 -0.79 -4.83 119.66 117.21 3db5 s GLN 56 Ca 0.06 1.19 -0.27 0.00 0.02 0.00 0.00 55.36 56.36 3db5 s GLN 56 Cb -0.00 -3.87 -0.04 0.00 1.00 0.00 0.00 33.01 30.10 3db5 s GLN 56 CO 0.04 -1.12 0.86 -0.65 -2.12 0.00 0.00 175.29 172.30 3db5 s GLN 57 N 4.15 4.53 -0.07 2.91 -0.21 -1.26 -0.87 119.66 128.84 3db5 s GLN 57 Ca 0.55 1.20 -0.02 0.00 0.02 0.00 0.00 55.36 57.11 3db5 s GLN 57 Cb -0.16 -3.43 0.03 0.00 1.00 0.00 0.00 33.01 30.45 3db5 s GLN 57 CO 0.23 0.07 0.02 -1.54 -2.12 0.00 0.00 175.29 171.95 3db5 s SER 58 N 0.64 1.56 -0.06 5.90 1.04 -0.30 -5.00 113.70 117.48 3db5 s SER 58 Ca 0.45 -0.09 -0.04 0.00 0.48 0.00 0.00 55.95 56.74 3db5 s SER 58 Cb -0.20 -0.37 -0.14 0.00 0.10 0.00 0.00 66.02 65.41 3db5 s SER 58 CO 0.24 -0.22 3.01 0.00 0.98 0.00 0.00 173.24 177.26 3db5 n HIS 59 N 5.18 0.25 -4.19 5.02 1.44 -1.26 -1.20 115.22 120.46 3db5 n HIS 59 Ca -0.06 -1.44 -0.20 0.00 -2.01 0.00 0.00 57.72 54.01 3db5 n HIS 59 Cb 0.50 -1.25 -0.16 0.00 0.12 0.00 0.00 29.99 29.20 3db5 n HIS 59 CO 0.00 0.00 0.00 0.14 -2.81 0.00 0.00 176.34 173.67 3db5 s VAL 71 N 0.22 0.55 0.00 0.61 -7.23 -1.26 -4.96 120.40 108.32 3db5 s VAL 71 Ca 0.46 -0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.50 3db5 s VAL 71 Cb 0.24 -0.57 0.00 0.00 0.56 0.00 0.00 36.38 36.61 3db5 s VAL 71 CO -0.02 0.23 0.00 0.59 -0.31 0.00 0.00 175.10 175.58 3db5 n ASN 72 N 4.00 0.00 -2.83 4.85 3.02 -1.26 -4.90 115.26 118.14 3db5 n ASN 72 Ca -0.25 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.08 3db5 n ASN 72 Cb 0.51 -0.29 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 3db5 n ASN 72 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3db5 n HIS 73 N -1.98 2.56 -3.70 3.10 8.25 -1.26 -5.03 115.22 117.15 3db5 n HIS 73 Ca 0.00 -3.54 -0.17 0.00 -0.26 0.00 0.00 57.72 53.75 3db5 n HIS 73 Cb 0.00 -0.35 -0.16 0.00 1.12 0.00 0.00 29.99 30.60 3db5 n HIS 73 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3db5 s ILE 74 N -4.07 -0.15 -0.09 1.59 1.01 -1.26 -1.08 121.20 117.16 3db5 s ILE 74 Ca 0.43 0.32 0.00 0.00 0.00 0.00 0.00 60.65 61.41 3db5 s ILE 74 Cb 0.36 -0.21 -0.03 0.00 0.01 0.00 0.00 42.46 42.58 3db5 s ILE 74 CO -0.11 0.13 -0.07 0.26 0.00 0.00 0.00 174.94 175.15 3db5 s TRP 75 N 1.87 2.93 -0.20 3.97 0.52 0.11 -4.92 118.94 123.21 3db5 s TRP 75 Ca -0.01 -0.09 -0.08 0.00 0.02 0.00 0.00 56.10 55.95 3db5 s TRP 75 Cb -0.12 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.40 3db5 s TRP 75 CO -0.05 0.23 0.08 0.15 0.02 0.00 0.00 176.95 177.38 3db5 s LYS 76 N -0.53 3.94 -0.27 4.98 1.02 -1.26 0.01 119.74 127.62 3db5 s LYS 76 Ca 0.08 -0.35 -0.05 0.00 0.02 0.00 0.00 55.97 55.66 3db5 s LYS 76 Cb -0.12 -3.28 0.01 0.00 -0.52 0.00 0.00 37.83 33.92 3db5 s LYS 76 CO 0.02 0.16 0.03 0.42 -0.92 0.00 0.00 175.35 175.07 3db5 s ILE 77 N 0.68 3.64 0.04 2.17 -1.09 0.57 -4.99 121.20 122.22 3db5 s ILE 77 Ca 0.04 -0.74 -0.07 0.00 -2.23 0.00 0.00 60.65 57.66 3db5 s ILE 77 Cb -0.13 -2.85 -0.05 0.00 -1.58 0.00 0.00 42.46 37.85 3db5 s ILE 77 CO 0.02 0.15 0.30 -0.31 -1.23 0.00 0.00 174.94 173.87 3db5 s TYR 78 N 1.46 3.56 -0.10 3.97 1.51 -1.26 -0.85 117.35 125.63 3db5 s TYR 78 Ca 0.02 0.59 -0.05 0.00 -1.01 0.00 0.00 57.07 56.63 3db5 s TYR 78 Cb -0.17 -2.01 0.05 0.00 -0.11 0.00 0.00 41.96 39.72 3db5 s TYR 78 CO 0.00 0.57 0.23 -1.58 -1.11 0.00 0.00 175.55 173.66 3db5 s HIS 79 N -1.38 -0.32 -1.47 2.71 2.46 -0.18 -4.85 115.29 112.27 3db5 s HIS 79 Ca 0.31 0.77 -0.17 0.00 0.47 0.00 0.00 55.06 56.44 3db5 s HIS 79 Cb -0.13 0.00 0.16 0.00 -0.13 0.00 0.00 32.58 32.48 3db5 s HIS 79 CO 0.18 -0.25 0.54 0.09 -2.47 0.00 0.00 174.74 172.83 3db5 n ASN 80 N 4.45 -2.37 0.00 9.88 3.02 -1.26 -2.29 115.26 126.70 3db5 n ASN 80 Ca -0.22 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 3db5 n ASN 80 Cb 0.52 -2.02 0.00 0.00 -0.61 0.00 0.00 39.78 37.67 3db5 n ASN 80 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3db5 n GLY 81 N -1.07 0.64 3.15 7.41 0.00 -1.26 -5.06 105.19 109.00 3db5 n GLY 81 Ca 0.07 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 3db5 n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3db5 s VAL 82 N -2.00 1.29 -0.44 1.61 0.11 -0.97 -5.09 120.40 114.92 3db5 s VAL 82 Ca 0.00 -0.72 -0.29 0.00 -2.93 0.00 0.00 61.98 58.04 3db5 s VAL 82 Cb 0.00 -1.07 0.01 0.00 -1.53 0.00 0.00 36.38 33.79 3db5 s VAL 82 CO 0.00 0.34 1.41 -0.22 -3.33 0.00 0.00 175.10 173.31 3db5 s LEU 83 N -0.43 3.56 -0.02 2.54 2.96 -1.26 -1.01 118.68 125.02 3db5 s LEU 83 Ca 0.06 0.74 -0.15 0.00 -0.22 0.00 0.00 54.13 54.56 3db5 s LEU 83 Cb -0.06 -3.47 -0.33 0.00 0.50 0.00 0.00 46.19 42.82 3db5 s LEU 83 CO -0.00 -1.48 0.85 -0.33 -1.32 0.00 0.00 176.35 174.06 3db5 h GLU 84 N 10.78 0.44 -2.13 1.98 4.39 -1.33 -3.49 114.58 125.23 3db5 h GLU 84 Ca -0.27 -0.76 0.14 0.00 0.34 0.00 0.00 59.36 58.81 3db5 h GLU 84 Cb 1.10 0.28 -0.15 0.00 -0.10 0.00 0.00 28.75 29.88 3db5 h GLU 84 CO 1.10 1.36 0.55 -0.59 -1.16 0.00 0.00 179.01 180.28 3db5 s PHE 85 N -2.56 -0.29 0.01 4.33 -0.12 -1.15 -4.57 117.98 113.63 3db5 s PHE 85 Ca -0.13 0.15 0.01 0.00 -0.05 0.00 0.00 56.93 56.91 3db5 s PHE 85 Cb 0.04 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 3db5 s PHE 85 CO 0.89 -0.50 0.04 0.00 -0.05 0.00 0.00 175.22 175.60 3db5 s ILE 87 N -1.17 3.99 -0.09 0.00 1.01 0.10 -1.15 121.20 123.90 3db5 s ILE 87 Ca 0.22 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.58 3db5 s ILE 87 Cb -0.12 -2.79 -0.02 0.00 0.01 0.00 0.00 42.46 39.54 3db5 s ILE 87 CO 0.13 0.45 -0.12 0.27 0.00 0.00 0.00 174.94 175.67 3db5 s ILE 88 N 0.77 3.24 -0.57 2.92 -5.25 -0.05 0.07 121.20 122.34 3db5 s ILE 88 Ca 0.00 -0.63 0.06 0.00 -0.99 0.00 0.00 60.65 59.09 3db5 s ILE 88 Cb -0.14 -2.32 0.31 0.00 2.95 0.00 0.00 42.46 43.26 3db5 s ILE 88 CO 0.02 0.57 0.85 0.35 -1.79 0.00 0.00 174.94 174.94 3db5 n THR 89 N 2.75 2.41 -0.01 8.37 -2.24 -0.24 -1.88 114.28 123.44 3db5 n THR 89 Ca -0.18 -5.32 -0.01 0.00 -2.27 0.00 0.00 64.05 56.27 3db5 n THR 89 Cb 0.52 -1.51 -0.02 0.00 -2.10 0.00 0.00 70.33 67.23 3db5 n THR 89 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 3db5 n THR 90 N 0.17 0.16 -3.66 4.28 5.66 -1.26 -4.88 114.28 114.75 3db5 n THR 90 Ca 0.30 -0.11 -0.39 0.00 -3.05 0.00 0.00 64.05 60.80 3db5 n THR 90 Cb 0.43 -0.71 -0.12 0.00 -1.55 0.00 0.00 70.33 68.38 3db5 n THR 90 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3db5 s ASP 91 N -3.18 5.53 0.59 1.09 -1.08 -1.26 -4.96 116.67 113.40 3db5 s ASP 91 Ca -0.01 -0.75 0.34 0.00 -0.52 0.00 0.00 52.55 51.61 3db5 s ASP 91 Cb 0.01 -1.98 1.86 0.00 -1.46 0.00 0.00 42.92 41.35 3db5 s ASP 91 CO 0.11 -0.27 2.04 -0.33 0.52 0.00 0.00 175.17 177.24 3db5 h GLU 92 N 8.35 0.00 0.00 4.34 5.08 -1.93 -0.77 114.58 129.65 3db5 h GLU 92 Ca -0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 3db5 h GLU 92 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3db5 h GLU 92 CO 0.63 0.00 -0.65 0.09 -1.00 0.00 0.00 179.01 178.08 3db5 n ASN 93 N -2.81 0.63 -0.31 1.42 3.02 -1.26 -1.52 115.26 114.43 3db5 n ASN 93 Ca -0.02 -0.01 0.06 0.00 -0.03 0.00 0.00 54.58 54.57 3db5 n ASN 93 Cb 0.18 0.28 0.01 0.00 -0.61 0.00 0.00 39.78 39.64 3db5 n ASN 93 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3db5 n GLU 94 N -1.94 1.66 -4.35 3.52 -0.58 -0.33 -4.78 120.64 113.85 3db5 n GLU 94 Ca 0.04 -0.78 -0.18 0.00 -0.42 0.00 0.00 57.16 55.81 3db5 n GLU 94 Cb 0.41 -1.14 -0.10 0.00 -0.57 0.00 0.00 31.44 30.04 3db5 n GLU 94 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3db5 s ASN 96 N -3.32 4.08 -0.20 0.00 4.22 -1.04 -2.44 114.94 116.23 3db5 s ASN 96 Ca 0.24 -0.15 -0.33 0.00 -2.14 0.00 0.00 52.86 50.49 3db5 s ASN 96 Cb 0.02 -0.17 -0.10 0.00 1.28 0.00 0.00 41.25 42.29 3db5 s ASN 96 CO 0.07 -2.05 2.07 -2.67 -2.04 0.00 0.00 177.10 172.49 3db5 n TRP 97 N -3.06 2.01 0.00 1.54 4.27 -1.02 -4.72 117.44 116.47 3db5 n TRP 97 Ca 0.14 0.03 0.00 0.00 -3.89 0.00 0.00 57.50 53.79 3db5 n TRP 97 Cb 0.60 -2.65 0.00 0.00 -1.36 0.00 0.00 31.31 27.91 3db5 n TRP 97 CO 0.00 0.00 0.00 1.19 -2.29 0.00 0.00 177.69 176.59 3db5 n PHE 100 N 9.06 0.00 -2.52 -2.67 3.72 -1.26 -5.01 117.46 118.77 3db5 n PHE 100 Ca 0.30 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.28 3db5 n PHE 100 Cb 0.32 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.84 3db5 n PHE 100 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3db5 s VAL 101 N -2.33 4.42 0.43 -4.37 1.01 -1.26 -3.83 120.40 114.47 3db5 s VAL 101 Ca 0.00 1.72 -0.07 0.00 0.00 0.00 0.00 61.98 63.64 3db5 s VAL 101 Cb 0.00 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 3db5 s VAL 101 CO 0.00 -0.04 0.75 -0.13 0.00 0.00 0.00 175.10 175.68 3db5 s ARG 102 N 2.45 3.63 -0.09 2.72 1.81 -1.25 -4.89 118.95 123.33 3db5 s ARG 102 Ca 0.53 0.25 -0.26 0.00 -1.72 0.00 0.00 55.73 54.54 3db5 s ARG 102 Cb -0.22 -2.42 -0.03 0.00 -0.45 0.00 0.00 34.95 31.84 3db5 s ARG 102 CO 0.18 -0.10 0.81 0.21 -0.68 0.00 0.00 175.30 175.73 3db5 s LYS 103 N -4.31 4.41 0.38 3.54 2.20 -1.26 -1.74 119.74 122.95 3db5 s LYS 103 Ca 0.48 1.05 -0.26 0.00 -0.36 0.00 0.00 55.97 56.88 3db5 s LYS 103 Cb -0.10 -3.50 -0.11 0.00 -1.51 0.00 0.00 37.83 32.61 3db5 s LYS 103 CO 0.39 -0.10 1.19 0.00 -0.36 0.00 0.00 175.35 176.47 3db5 n ALA 104 N 4.33 0.89 1.08 3.13 0.00 0.31 -4.76 120.51 125.49 3db5 n ALA 104 Ca 0.02 0.31 0.12 0.00 0.00 0.00 0.00 53.44 53.90 3db5 n ALA 104 Cb 0.50 -2.19 0.28 0.00 0.00 0.00 0.00 19.45 18.04 3db5 n ALA 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3db5 n ARG 105 N 0.34 0.30 -3.75 0.00 1.74 -1.26 -4.93 116.66 109.10 3db5 n ARG 105 Ca 0.07 -0.18 -0.07 0.00 -0.77 0.00 0.00 57.85 56.90 3db5 n ARG 105 Cb 0.37 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.30 3db5 n ARG 105 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3db5 s ASN 106 N -2.82 -0.30 0.39 0.55 2.20 -1.26 -5.07 114.94 108.63 3db5 s ASN 106 Ca 0.16 -0.43 0.18 0.00 -0.94 0.00 0.00 52.86 51.83 3db5 s ASN 106 Cb 0.18 0.64 0.80 0.00 -2.00 0.00 0.00 41.25 40.87 3db5 s ASN 106 CO 0.64 -1.16 1.80 0.03 -2.94 0.00 0.00 177.10 175.47 3db5 h ARG 107 N 2.00 0.00 -0.10 3.55 3.08 -1.96 -3.20 114.38 117.74 3db5 h ARG 107 Ca -0.23 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 3db5 h ARG 107 Cb 1.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 3db5 h ARG 107 CO 0.26 0.35 0.05 1.05 -1.07 0.00 0.00 179.97 180.61 3db5 h GLU 108 N 0.00 0.14 0.00 0.04 9.09 -2.02 -3.25 114.58 118.58 3db5 h GLU 108 Ca -0.00 -0.02 -0.06 0.00 0.05 0.00 0.00 59.36 59.33 3db5 h GLU 108 Cb 0.76 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.82 3db5 h GLU 108 CO 0.05 0.19 -0.28 1.49 0.05 0.00 0.00 179.01 180.50 3db5 h GLU 109 N 0.06 0.00 -6.61 1.06 4.81 -1.98 -3.46 114.58 108.46 3db5 h GLU 109 Ca 0.03 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.74 3db5 h GLU 109 Cb 0.09 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.49 3db5 h GLU 109 CO -0.01 0.28 0.62 -1.14 -0.73 0.00 0.00 179.01 178.04 3db5 s GLN 110 N -4.06 4.41 0.00 1.92 0.74 -1.21 -4.66 119.66 116.80 3db5 s GLN 110 Ca -0.02 1.95 0.00 0.00 0.05 0.00 0.00 55.36 57.34 3db5 s GLN 110 Cb 0.13 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.99 3db5 s GLN 110 CO 0.67 -0.25 0.13 0.27 -0.55 0.00 0.00 175.29 175.56 3db5 n ASN 111 N 3.14 0.12 -4.08 6.67 0.23 -0.20 -4.97 115.26 116.17 3db5 n ASN 111 Ca 0.07 -1.02 -0.22 0.00 -0.53 0.00 0.00 54.58 52.89 3db5 n ASN 111 Cb 0.44 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 37.99 3db5 n ASN 111 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3db5 s LEU 112 N -0.02 1.96 -0.15 -4.53 1.43 -1.06 -0.96 118.68 115.36 3db5 s LEU 112 Ca 0.00 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 3db5 s LEU 112 Cb 0.00 -0.70 -0.04 0.00 0.03 0.00 0.00 46.19 45.49 3db5 s LEU 112 CO 0.00 0.14 0.03 0.54 0.23 0.00 0.00 176.35 177.29 3db5 s VAL 113 N -0.17 4.47 -0.17 -1.59 0.11 -0.31 -1.08 120.40 121.67 3db5 s VAL 113 Ca 0.02 -0.16 -0.04 0.00 -2.93 0.00 0.00 61.98 58.88 3db5 s VAL 113 Cb -0.07 -2.97 -0.02 0.00 -1.53 0.00 0.00 36.38 31.79 3db5 s VAL 113 CO 0.00 0.51 -0.03 0.00 -3.33 0.00 0.00 175.10 172.24 3db5 s ALA 114 N 0.06 2.97 -0.03 1.54 0.00 0.38 -1.21 121.76 125.48 3db5 s ALA 114 Ca 0.03 -0.89 -0.14 0.00 0.00 0.00 0.00 51.96 50.97 3db5 s ALA 114 Cb -0.13 -1.60 0.02 0.00 0.00 0.00 0.00 23.12 21.42 3db5 s ALA 114 CO 0.01 0.09 0.31 1.52 0.00 0.00 0.00 175.76 177.69 3db5 s TYR 115 N 0.58 -0.20 0.18 0.00 -0.85 -0.80 -0.78 117.35 115.48 3db5 s TYR 115 Ca -0.03 0.33 -0.30 0.00 -0.52 0.00 0.00 57.07 56.56 3db5 s TYR 115 Cb -0.14 0.10 -0.08 0.00 0.38 0.00 0.00 41.96 42.22 3db5 s TYR 115 CO 0.03 -0.36 1.10 -1.25 -1.52 0.00 0.00 175.55 173.54 3db5 s PRO 116 N -1.14 4.60 -0.08 -3.49 0.04 -1.26 -1.34 135.00 132.32 3db5 s PRO 116 Ca -0.12 1.71 -0.03 0.00 0.04 0.00 0.00 61.00 62.60 3db5 s PRO 116 Cb -0.05 -3.28 0.05 0.00 0.04 0.00 0.00 34.50 31.26 3db5 s PRO 116 CO 0.04 0.08 0.15 -1.58 0.04 0.00 0.00 177.00 175.73 3db5 s HIS 117 N -0.23 -0.17 -1.29 0.56 2.46 0.10 -4.87 115.29 111.85 3db5 s HIS 117 Ca 0.49 0.59 -0.07 0.00 0.47 0.00 0.00 55.06 56.54 3db5 s HIS 117 Cb -0.29 -0.25 0.01 0.00 -0.13 0.00 0.00 32.58 31.91 3db5 s HIS 117 CO 0.35 -0.26 1.12 -0.25 -2.47 0.00 0.00 174.74 173.23 3db5 n ASP 118 N 5.22 -5.52 -1.94 9.88 8.00 -1.26 -2.73 116.55 128.20 3db5 n ASP 118 Ca -0.07 -0.54 -0.19 0.00 0.71 0.00 0.00 54.79 54.71 3db5 n ASP 118 Cb 0.50 -4.91 -0.03 0.00 -0.02 0.00 0.00 41.12 36.67 3db5 n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3db5 n GLY 119 N -1.82 0.20 3.14 0.44 0.00 -1.26 -5.01 105.19 100.88 3db5 n GLY 119 Ca -0.04 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 3db5 n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3db5 s LYS 120 N -4.56 0.74 -0.15 1.61 1.02 -1.11 -5.03 119.74 112.26 3db5 s LYS 120 Ca 0.00 -1.20 -0.07 0.00 0.02 0.00 0.00 55.97 54.73 3db5 s LYS 120 Cb 0.00 -0.17 -0.04 0.00 -0.52 0.00 0.00 37.83 37.10 3db5 s LYS 120 CO 0.00 -0.02 0.08 0.42 -0.92 0.00 0.00 175.35 174.92 3db5 s ILE 121 N -3.18 4.99 0.12 2.17 -1.09 -1.26 0.00 121.20 122.94 3db5 s ILE 121 Ca 0.06 0.03 0.06 0.00 -2.23 0.00 0.00 60.65 58.58 3db5 s ILE 121 Cb 0.02 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.66 3db5 s ILE 121 CO -0.04 0.52 -0.15 -0.36 -1.23 0.00 0.00 174.94 173.68 3db5 s PHE 122 N -0.19 1.46 -0.08 3.97 0.40 -0.45 -0.38 117.98 122.72 3db5 s PHE 122 Ca 0.08 -0.52 0.05 0.00 -0.60 0.00 0.00 56.93 55.94 3db5 s PHE 122 Cb -0.12 -0.77 -0.00 0.00 0.51 0.00 0.00 43.02 42.64 3db5 s PHE 122 CO 0.01 0.16 -0.23 -0.06 0.70 0.00 0.00 175.22 175.80 3db5 s PHE 123 N -1.96 2.40 -0.02 0.36 2.99 -0.28 -1.91 117.98 119.56 3db5 s PHE 123 Ca 0.08 -0.85 0.04 0.00 0.00 0.00 0.00 56.93 56.20 3db5 s PHE 123 Cb -0.06 -1.60 -0.01 0.00 0.00 0.00 0.00 43.02 41.36 3db5 s PHE 123 CO 0.03 -0.31 -0.12 0.00 -0.00 0.00 0.00 175.22 174.82 3db5 s THR 125 N -0.12 3.11 -0.65 0.00 -4.23 -0.46 -1.16 115.64 112.14 3db5 s THR 125 Ca 0.02 0.80 0.26 0.00 -1.18 0.00 0.00 61.69 61.58 3db5 s THR 125 Cb -0.07 -3.51 0.29 0.00 1.34 0.00 0.00 72.50 70.55 3db5 s THR 125 CO 0.00 0.06 1.76 0.28 -0.54 0.00 0.00 174.62 176.18 3db5 h SER 126 N 6.80 0.00 -5.10 3.99 0.02 -1.40 -2.63 113.55 115.22 3db5 h SER 126 Ca -0.42 0.00 0.13 0.00 -0.84 0.00 0.00 61.79 60.66 3db5 h SER 126 Cb 1.21 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.65 3db5 h SER 126 CO 0.88 0.00 0.43 0.00 -1.14 0.00 0.00 176.83 177.00 3db5 s GLN 127 N -3.16 1.19 0.24 3.45 -2.07 -1.26 -4.90 119.66 113.16 3db5 s GLN 127 Ca 0.09 -0.60 -0.31 0.00 -1.82 0.00 0.00 55.36 52.71 3db5 s GLN 127 Cb 0.11 0.44 -0.12 0.00 -1.09 0.00 0.00 33.01 32.35 3db5 s GLN 127 CO 0.57 -0.54 1.61 -0.25 -1.32 0.00 0.00 175.29 175.36 3db5 n ASP 128 N -0.41 3.66 -4.14 12.60 8.00 -1.26 -3.38 116.55 131.61 3db5 n ASP 128 Ca -0.07 1.11 -0.33 0.00 0.71 0.00 0.00 54.79 56.20 3db5 n ASP 128 Cb 0.61 -1.54 -0.15 0.00 -0.02 0.00 0.00 41.12 40.02 3db5 n ASP 128 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3db5 s ILE 129 N 0.47 2.50 1.19 0.53 1.01 0.70 -4.86 121.20 122.74 3db5 s ILE 129 Ca 0.70 -1.22 -0.15 0.00 0.00 0.00 0.00 60.65 59.98 3db5 s ILE 129 Cb -0.54 -2.30 0.29 0.00 0.01 0.00 0.00 42.46 39.91 3db5 s ILE 129 CO 0.42 0.18 1.03 -2.84 0.00 0.00 0.00 174.94 173.73 3db5 s PRO 130 N 1.24 -1.11 0.62 2.79 0.02 -1.26 -0.55 135.00 136.76 3db5 s PRO 130 Ca -0.02 0.54 -0.18 0.00 0.02 0.00 0.00 61.00 61.36 3db5 s PRO 130 Cb -0.17 -1.56 -0.02 0.00 0.02 0.00 0.00 34.50 32.77 3db5 s PRO 130 CO -0.06 -3.77 1.22 -2.14 -0.33 0.00 0.00 177.00 171.92 3db5 s PRO 131 N -4.74 2.79 -1.04 5.54 0.02 -1.25 -3.67 135.00 132.64 3db5 s PRO 131 Ca 0.68 1.86 0.00 0.00 0.02 0.00 0.00 61.00 63.56 3db5 s PRO 131 Cb -0.20 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.41 3db5 s PRO 131 CO 0.61 -1.36 0.00 0.39 -0.33 0.00 0.00 177.00 176.32 3db5 n GLU 132 N -1.80 -0.97 -4.31 5.54 4.71 0.54 -4.96 120.64 119.39 3db5 n GLU 132 Ca 0.14 0.59 -0.31 0.00 -0.01 0.00 0.00 57.16 57.57 3db5 n GLU 132 Cb 0.49 -4.77 -0.10 0.00 -1.01 0.00 0.00 31.44 26.06 3db5 n GLU 132 CO 0.00 0.00 0.00 -0.80 0.09 0.00 0.00 177.13 176.42 3db5 s ASN 133 N -2.45 4.62 0.14 1.62 0.02 -1.24 -4.90 114.94 112.75 3db5 s ASN 133 Ca 0.00 -0.24 -0.24 0.00 -1.02 0.00 0.00 52.86 51.36 3db5 s ASN 133 Cb 0.00 -1.01 -0.07 0.00 0.02 0.00 0.00 41.25 40.18 3db5 s ASN 133 CO 0.00 0.22 0.74 -0.70 0.02 0.00 0.00 177.10 177.38 3db5 s GLU 134 N -1.90 4.50 -0.07 -0.60 2.12 -1.26 -0.68 118.70 120.81 3db5 s GLU 134 Ca 0.21 1.07 -0.30 0.00 0.36 0.00 0.00 54.97 56.31 3db5 s GLU 134 Cb -0.11 -3.27 -0.02 0.00 0.26 0.00 0.00 34.13 30.99 3db5 s GLU 134 CO 0.12 0.55 1.02 -0.51 -0.54 0.00 0.00 175.26 175.90 3db5 s LEU 135 N -1.02 4.28 -0.07 2.70 1.43 0.19 -4.92 118.68 121.28 3db5 s LEU 135 Ca 0.35 1.60 -0.02 0.00 -1.03 0.00 0.00 54.13 55.02 3db5 s LEU 135 Cb -0.22 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.47 3db5 s LEU 135 CO 0.25 -0.41 0.04 -0.76 0.23 0.00 0.00 176.35 175.70 3db5 s LEU 136 N 1.76 0.33 0.11 1.79 1.43 -1.26 -3.97 118.68 118.87 3db5 s LEU 136 Ca 0.50 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.53 3db5 s LEU 136 Cb -0.20 -0.26 -0.04 0.00 0.03 0.00 0.00 46.19 45.72 3db5 s LEU 136 CO 0.21 -0.24 0.29 0.72 0.23 0.00 0.00 176.35 177.55 3db5 s PHE 137 N 2.09 3.50 0.09 0.29 -0.71 -0.71 -1.03 117.98 121.51 3db5 s PHE 137 Ca 0.05 0.34 0.02 0.00 -1.04 0.00 0.00 56.93 56.29 3db5 s PHE 137 Cb -0.13 -1.83 -0.04 0.00 -1.21 0.00 0.00 43.02 39.81 3db5 s PHE 137 CO -0.04 0.51 -0.07 -0.47 -1.34 0.00 0.00 175.22 173.80 3db5 s TYR 138 N -1.62 0.89 0.42 3.49 6.14 -0.24 -0.53 117.35 125.90 3db5 s TYR 138 Ca 0.37 -0.80 -0.25 0.00 0.64 0.00 0.00 57.07 57.03 3db5 s TYR 138 Cb -0.12 -0.51 -0.08 0.00 0.42 0.00 0.00 41.96 41.66 3db5 s TYR 138 CO 0.27 -0.11 1.18 0.71 0.64 0.00 0.00 175.55 178.25 3db5 s TYR 139 N -3.08 2.98 1.15 4.97 1.51 -1.26 -0.47 117.35 123.15 3db5 s TYR 139 Ca 0.08 1.53 -0.13 0.00 -1.01 0.00 0.00 57.07 57.54 3db5 s TYR 139 Cb 0.02 -3.42 0.28 0.00 -0.11 0.00 0.00 41.96 38.72 3db5 s TYR 139 CO -0.03 -1.47 1.03 -1.54 -1.11 0.00 0.00 175.55 172.43 3db5 s SER 140 N -1.15 1.06 0.00 2.29 1.04 0.04 -4.74 113.70 112.24 3db5 s SER 140 Ca 0.59 1.52 0.00 0.00 0.48 0.00 0.00 55.95 58.54 3db5 s SER 140 Cb -0.31 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.52 3db5 s SER 140 CO 0.39 -4.15 0.45 -2.11 0.98 0.00 0.00 173.24 168.79