#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kv8 s ARG 6 N 0.00 3.47 0.14 0.03 3.00 -1.26 -5.04 118.95 119.28 3kv8 s ARG 6 Ca 0.00 -0.54 -0.34 0.00 0.00 0.00 0.00 55.73 54.85 3kv8 s ARG 6 Cb 0.00 -2.82 -0.14 0.00 0.00 0.00 0.00 34.95 32.00 3kv8 s ARG 6 CO 0.00 0.32 1.61 0.28 0.00 0.00 0.00 175.30 177.51 3kv8 n VAL 7 N 3.28 0.06 0.00 3.52 0.31 -1.26 -1.57 118.33 122.66 3kv8 n VAL 7 Ca -0.18 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3kv8 n VAL 7 Cb 0.53 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.88 3kv8 n VAL 7 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kv8 n GLY 8 N 3.52 3.22 3.75 2.92 0.00 0.66 -4.99 105.19 114.27 3kv8 n GLY 8 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3kv8 n GLY 8 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kv8 s GLU 9 N -1.00 4.11 -0.07 1.61 2.12 -0.61 -4.73 118.70 120.13 3kv8 s GLU 9 Ca 0.00 2.60 -0.03 0.00 0.36 0.00 0.00 54.97 57.90 3kv8 s GLU 9 Cb 0.00 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.34 3kv8 s GLU 9 CO 0.00 -0.64 0.07 1.03 -0.54 0.00 0.00 175.26 175.18 3kv8 s ARG 10 N -0.71 3.14 -0.02 4.30 0.52 -1.26 -1.22 118.95 123.69 3kv8 s ARG 10 Ca 0.62 -0.36 0.04 0.00 -0.52 0.00 0.00 55.73 55.51 3kv8 s ARG 10 Cb -0.48 -2.93 -0.00 0.00 0.52 0.00 0.00 34.95 32.06 3kv8 s ARG 10 CO 0.50 0.70 -0.13 0.12 0.02 0.00 0.00 175.30 176.52 3kv8 s PHE 11 N -1.04 1.26 0.10 -0.53 5.36 0.12 -4.95 117.98 118.30 3kv8 s PHE 11 Ca 0.17 -0.30 0.08 0.00 -0.96 0.00 0.00 56.93 55.92 3kv8 s PHE 11 Cb -0.12 -0.85 -0.03 0.00 -0.34 0.00 0.00 43.02 41.68 3kv8 s PHE 11 CO 0.07 -0.09 -0.21 0.95 -1.46 0.00 0.00 175.22 174.49 3kv8 s THR 12 N -0.04 1.69 -0.04 0.12 -4.23 -1.26 -0.25 115.64 111.63 3kv8 s THR 12 Ca -0.00 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 3kv8 s THR 12 Cb -0.08 -1.53 0.03 0.00 1.34 0.00 0.00 72.50 72.25 3kv8 s THR 12 CO 0.01 -0.06 0.00 -2.28 -0.54 0.00 0.00 174.62 171.75 3kv8 s HIS 13 N -1.15 0.37 -0.00 3.99 2.46 -0.12 -4.99 115.29 115.85 3kv8 s HIS 13 Ca 0.06 -0.02 0.04 0.00 0.47 0.00 0.00 55.06 55.61 3kv8 s HIS 13 Cb -0.10 -0.47 -0.03 0.00 -0.13 0.00 0.00 32.58 31.85 3kv8 s HIS 13 CO 0.04 -0.16 -0.11 -0.51 -2.47 0.00 0.00 174.74 171.54 3kv8 s ASP 14 N 1.16 4.34 -0.18 9.88 1.01 -1.26 -1.07 116.67 130.54 3kv8 s ASP 14 Ca -0.08 -0.21 -0.04 0.00 0.71 0.00 0.00 52.55 52.93 3kv8 s ASP 14 Cb -0.13 -0.94 0.09 0.00 1.01 0.00 0.00 42.92 42.95 3kv8 s ASP 14 CO -0.02 0.29 0.31 0.12 0.21 0.00 0.00 175.17 176.08 3kv8 s PHE 15 N -0.92 -0.55 -0.10 4.23 5.36 0.01 -4.99 117.98 121.03 3kv8 s PHE 15 Ca 0.15 0.85 -0.30 0.00 -0.96 0.00 0.00 56.93 56.68 3kv8 s PHE 15 Cb -0.11 -0.04 -0.02 0.00 -0.34 0.00 0.00 43.02 42.51 3kv8 s PHE 15 CO 0.05 -0.52 1.15 0.08 -1.46 0.00 0.00 175.22 174.52 3kv8 s VAL 16 N 2.46 4.42 -0.21 3.12 1.01 -1.26 -0.37 120.40 129.57 3kv8 s VAL 16 Ca 0.05 1.73 -0.29 0.00 0.00 0.00 0.00 61.98 63.46 3kv8 s VAL 16 Cb -0.14 -4.11 -0.00 0.00 0.00 0.00 0.00 36.38 32.13 3kv8 s VAL 16 CO -0.12 -0.03 1.20 -0.69 0.00 0.00 0.00 175.10 175.46 3kv8 s VAL 17 N 2.40 4.38 0.52 2.92 1.01 -0.25 -4.92 120.40 126.47 3kv8 s VAL 17 Ca 0.53 1.66 -0.01 0.00 0.00 0.00 0.00 61.98 64.16 3kv8 s VAL 17 Cb -0.22 -4.12 0.01 0.00 0.00 0.00 0.00 36.38 32.05 3kv8 s VAL 17 CO 0.19 -0.20 0.76 -2.16 0.00 0.00 0.00 175.10 173.68 3kv8 s PRO 18 N 3.50 2.82 0.65 2.72 0.04 -1.26 -0.80 135.00 142.68 3kv8 s PRO 18 Ca 0.51 -0.50 0.39 0.00 0.04 0.00 0.00 61.00 61.44 3kv8 s PRO 18 Cb -0.19 -2.47 2.14 0.00 0.04 0.00 0.00 34.50 34.02 3kv8 s PRO 18 CO 0.13 -0.54 2.24 -1.35 0.04 0.00 0.00 177.00 177.53 3kv8 h PRO 19 N 0.15 0.00 -0.66 0.56 0.11 -1.95 -2.66 132.00 127.54 3kv8 h PRO 19 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3kv8 h PRO 19 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3kv8 h PRO 19 CO 0.56 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.96 3kv8 n HIS 20 N -3.18 1.57 -1.38 0.65 1.44 -1.26 -3.67 115.22 109.38 3kv8 n HIS 20 Ca -0.02 -0.55 0.02 0.00 -2.01 0.00 0.00 57.72 55.15 3kv8 n HIS 20 Cb 0.16 -0.39 0.20 0.00 0.12 0.00 0.00 29.99 30.09 3kv8 n HIS 20 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3kv8 n LYS 21 N 0.55 1.86 -2.73 -1.40 4.76 -1.00 -4.76 118.16 115.44 3kv8 n LYS 21 Ca 0.22 -3.10 -0.21 0.00 -2.87 0.00 0.00 58.31 52.34 3kv8 n LYS 21 Cb 0.95 -1.74 0.03 0.00 -1.84 0.00 0.00 35.03 32.44 3kv8 n LYS 21 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3kv8 s THR 22 N -3.15 2.97 0.20 -0.18 -4.23 -1.24 -1.92 115.64 108.09 3kv8 s THR 22 Ca 0.41 -0.65 -0.16 0.00 -1.18 0.00 0.00 61.69 60.12 3kv8 s THR 22 Cb 0.37 -3.10 0.20 0.00 1.34 0.00 0.00 72.50 71.31 3kv8 s THR 22 CO -0.00 -0.07 1.62 0.58 -0.54 0.00 0.00 174.62 176.20 3kv8 h VAL 23 N 0.17 0.32 -0.02 2.29 2.07 -1.64 -1.15 116.25 118.29 3kv8 h VAL 23 Ca -0.43 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3kv8 h VAL 23 Cb 1.29 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3kv8 h VAL 23 CO 0.53 0.00 0.03 0.08 0.02 0.00 0.00 177.57 178.23 3kv8 h ARG 24 N -0.06 0.00 0.00 1.57 0.11 -1.88 -2.01 114.38 112.11 3kv8 h ARG 24 Ca 0.28 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.31 3kv8 h ARG 24 Cb 0.49 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.56 3kv8 h ARG 24 CO -0.64 0.00 -0.45 0.45 0.10 0.00 0.00 179.97 179.42 3kv8 h HIS 25 N 0.00 0.00 -0.26 4.08 3.86 -1.51 -2.84 115.15 118.48 3kv8 h HIS 25 Ca 0.01 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 3kv8 h HIS 25 Cb 0.07 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 3kv8 h HIS 25 CO 0.00 0.20 0.00 1.25 0.86 0.00 0.00 177.93 180.24 3kv8 h LEU 26 N 0.00 0.44 -6.72 2.43 5.85 -1.16 -3.38 115.31 112.78 3kv8 h LEU 26 Ca -0.02 -0.31 -0.60 0.00 0.84 0.00 0.00 57.88 57.79 3kv8 h LEU 26 Cb 1.17 -0.12 -0.40 0.00 0.37 0.00 0.00 40.66 41.68 3kv8 h LEU 26 CO 0.02 0.64 -0.79 -0.31 -0.34 0.00 0.00 178.44 177.67 3kv8 s TYR 27 N -4.99 2.21 -0.06 1.25 2.02 -1.23 -4.94 117.35 111.60 3kv8 s TYR 27 Ca -0.14 -2.76 0.27 0.00 -0.37 0.00 0.00 57.07 54.07 3kv8 s TYR 27 Cb 0.08 -1.75 1.40 0.00 -0.40 0.00 0.00 41.96 41.29 3kv8 s TYR 27 CO 0.75 -0.70 1.83 -1.35 -1.57 0.00 0.00 175.55 174.50 3kv8 h PRO 28 N 5.62 0.00 0.00 -1.71 0.11 -1.69 -2.12 132.00 132.21 3kv8 h PRO 28 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 3kv8 h PRO 28 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3kv8 h PRO 28 CO 0.53 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.71 3kv8 n GLU 29 N -2.46 0.18 -3.51 1.05 4.71 -1.26 -4.76 120.64 114.59 3kv8 n GLU 29 Ca -0.01 0.13 -0.42 0.00 -0.01 0.00 0.00 57.16 56.85 3kv8 n GLU 29 Cb 0.09 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 28.92 3kv8 n GLU 29 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3kv8 s SER 30 N -2.72 5.97 0.42 1.62 0.15 -0.80 -4.95 113.70 113.40 3kv8 s SER 30 Ca 0.15 -0.91 0.10 0.00 0.70 0.00 0.00 55.95 56.00 3kv8 s SER 30 Cb 0.12 -2.11 0.89 0.00 -1.71 0.00 0.00 66.02 63.21 3kv8 s SER 30 CO 0.30 -0.41 1.99 -0.65 1.20 0.00 0.00 173.24 175.67 3kv8 h PRO 31 N 8.55 0.25 -0.83 5.44 0.11 -1.88 -2.23 132.00 141.41 3kv8 h PRO 31 Ca -0.27 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.90 3kv8 h PRO 31 Cb 1.12 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 3kv8 h PRO 31 CO 0.70 0.30 0.54 0.93 -0.21 0.00 0.00 178.00 180.27 3kv8 h GLU 32 N 0.25 0.77 -0.00 1.05 3.07 -1.96 -3.09 114.58 114.67 3kv8 h GLU 32 Ca 0.06 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 3kv8 h GLU 32 Cb 0.22 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3kv8 h GLU 32 CO 0.01 0.51 -0.43 1.19 -1.40 0.00 0.00 179.01 178.89 3kv8 n PHE 33 N -4.51 0.00 -0.03 4.33 3.01 -0.87 -4.33 117.46 115.06 3kv8 n PHE 33 Ca 0.14 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.49 3kv8 n PHE 33 Cb 0.31 -0.19 -0.05 0.00 -0.01 0.00 0.00 39.48 39.54 3kv8 n PHE 33 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3kv8 h ALA 34 N 3.26 0.18 -1.02 4.37 0.00 -1.40 -2.81 119.26 121.83 3kv8 h ALA 34 Ca 0.00 -0.09 -0.67 0.00 0.00 0.00 0.00 54.91 54.15 3kv8 h ALA 34 Cb 0.51 -0.06 -0.33 0.00 0.00 0.00 0.00 17.79 17.91 3kv8 h ALA 34 CO 0.00 -0.24 0.39 0.39 0.00 0.00 0.00 179.25 179.78 3kv8 n GLU 35 N -4.90 2.99 -3.33 0.00 -0.58 -1.26 -4.90 120.64 108.66 3kv8 n GLU 35 Ca -0.05 -3.69 -0.33 0.00 -0.42 0.00 0.00 57.16 52.67 3kv8 n GLU 35 Cb 0.11 -2.28 -0.06 0.00 -0.57 0.00 0.00 31.44 28.64 3kv8 n GLU 35 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 3kv8 s PHE 36 N -3.82 3.45 0.51 -0.32 5.36 -1.06 -5.05 117.98 117.05 3kv8 s PHE 36 Ca 0.56 1.00 -0.21 0.00 -0.96 0.00 0.00 56.93 57.32 3kv8 s PHE 36 Cb 0.46 -2.35 -0.08 0.00 -0.34 0.00 0.00 43.02 40.70 3kv8 s PHE 36 CO -0.14 0.25 0.97 -2.30 -1.46 0.00 0.00 175.22 172.54 3kv8 n PRO 37 N -0.02 1.13 -2.05 10.12 -0.02 -1.26 -4.82 135.00 138.08 3kv8 n PRO 37 Ca 0.00 0.42 -0.39 0.00 -2.02 0.00 0.00 63.50 61.51 3kv8 n PRO 37 Cb 0.52 -2.09 -0.02 0.00 -0.02 0.00 0.00 33.50 31.89 3kv8 n PRO 37 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3kv8 n GLU 38 N -0.37 2.47 -4.28 -0.52 -0.58 -1.26 -4.57 120.64 111.52 3kv8 n GLU 38 Ca 0.11 -2.71 -0.20 0.00 -0.42 0.00 0.00 57.16 53.94 3kv8 n GLU 38 Cb 0.43 -3.42 -0.11 0.00 -0.57 0.00 0.00 31.44 27.77 3kv8 n GLU 38 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3kv8 s VAL 39 N 5.83 1.57 0.08 2.62 -7.23 -1.26 -4.30 120.40 117.70 3kv8 s VAL 39 Ca 0.57 -1.78 -0.32 0.00 -1.81 0.00 0.00 61.98 58.64 3kv8 s VAL 39 Cb 0.07 -1.66 -0.11 0.00 0.56 0.00 0.00 36.38 35.23 3kv8 s VAL 39 CO 0.06 -0.34 1.81 0.33 -0.31 0.00 0.00 175.10 176.66 3kv8 n PHE 40 N 0.50 2.48 -2.41 2.82 7.35 0.13 -1.96 117.46 126.38 3kv8 n PHE 40 Ca -0.15 -0.05 -0.35 0.00 -0.76 0.00 0.00 57.45 56.14 3kv8 n PHE 40 Cb 0.57 -2.69 -0.02 0.00 0.35 0.00 0.00 39.48 37.69 3kv8 n PHE 40 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3kv8 s ALA 41 N 2.79 2.85 0.27 3.13 0.00 -0.81 -4.78 121.76 125.22 3kv8 s ALA 41 Ca 0.84 0.74 -0.02 0.00 0.00 0.00 0.00 51.96 53.52 3kv8 s ALA 41 Cb -0.56 -3.31 0.43 0.00 0.00 0.00 0.00 23.12 19.67 3kv8 s ALA 41 CO 0.41 -0.51 1.89 1.15 0.00 0.00 0.00 175.76 178.71 3kv8 h THR 42 N 1.55 1.10 0.00 0.00 2.02 -1.93 -0.51 112.91 115.14 3kv8 h THR 42 Ca -0.50 -0.40 -0.08 0.00 0.77 0.00 0.00 66.41 66.20 3kv8 h THR 42 Cb 1.24 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 3kv8 h THR 42 CO 0.59 0.21 -0.40 1.23 0.37 0.00 0.00 175.52 177.52 3kv8 h GLY 43 N 1.16 0.00 1.59 2.16 0.00 -1.98 0.83 103.07 106.83 3kv8 h GLY 43 Ca 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.61 3kv8 h GLY 43 CO -0.16 0.00 -0.49 0.74 0.00 0.00 0.00 176.54 176.63 3kv8 h PHE 44 N 0.00 0.54 -0.54 5.60 0.04 -1.58 -1.77 116.94 119.23 3kv8 h PHE 44 Ca -0.00 -0.18 -0.04 0.00 2.80 0.00 0.00 57.97 60.55 3kv8 h PHE 44 Cb 0.75 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.77 3kv8 h PHE 44 CO 0.00 0.85 0.18 1.98 -0.60 0.00 0.00 178.31 180.72 3kv8 h MET 45 N 0.35 0.83 -0.14 1.51 4.05 -0.03 0.46 114.93 121.97 3kv8 h MET 45 Ca 0.02 -0.17 0.02 0.00 -0.28 0.00 0.00 59.70 59.29 3kv8 h MET 45 Cb 0.99 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.65 3kv8 h MET 45 CO 0.09 0.75 -0.01 0.28 0.23 0.00 0.00 176.91 178.25 3kv8 h VAL 46 N 0.74 0.89 -0.74 -5.77 2.07 -0.84 0.87 116.25 113.47 3kv8 h VAL 46 Ca 0.18 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.75 3kv8 h VAL 46 Cb 0.26 0.85 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 3kv8 h VAL 46 CO -0.01 0.01 0.44 1.23 0.02 0.00 0.00 177.57 179.25 3kv8 h GLY 47 N 0.03 1.10 1.11 2.17 0.00 -0.94 0.11 103.07 106.65 3kv8 h GLY 47 Ca 0.07 -0.31 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 3kv8 h GLY 47 CO -0.12 0.20 -0.12 -2.00 0.00 0.00 0.00 176.54 174.50 3kv8 h LEU 48 N 0.80 1.04 -0.44 3.11 5.85 -0.47 1.00 115.31 126.20 3kv8 h LEU 48 Ca 0.33 -0.35 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 3kv8 h LEU 48 Cb 0.18 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3kv8 h LEU 48 CO -0.18 1.16 0.18 0.24 -0.34 0.00 0.00 178.44 179.50 3kv8 h MET 49 N 0.92 0.66 -0.57 1.25 2.86 -0.29 -1.67 114.93 118.10 3kv8 h MET 49 Ca 0.14 -0.12 -0.09 0.00 -2.06 0.00 0.00 59.70 57.57 3kv8 h MET 49 Cb 0.69 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 3kv8 h MET 49 CO 0.05 0.60 -0.01 0.93 1.06 0.00 0.00 176.91 179.54 3kv8 h GLU 50 N 0.58 1.01 -0.49 1.72 5.08 -0.65 -2.75 114.58 119.07 3kv8 h GLU 50 Ca 0.15 -0.33 0.08 0.00 -1.00 0.00 0.00 59.36 58.26 3kv8 h GLU 50 Cb 0.18 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.28 3kv8 h GLU 50 CO -0.01 1.01 0.09 2.35 -1.00 0.00 0.00 179.01 181.45 3kv8 h TRP 51 N 0.90 0.15 -0.64 4.33 7.01 -0.67 -0.03 115.95 127.00 3kv8 h TRP 51 Ca 0.16 0.03 0.10 0.00 2.11 0.00 0.00 58.89 61.29 3kv8 h TRP 51 Cb 0.56 0.01 -0.08 0.00 -2.10 0.00 0.00 29.16 27.55 3kv8 h TRP 51 CO 0.04 -0.01 0.24 0.00 -2.79 0.00 0.00 178.44 175.93 3kv8 h ALA 52 N 1.38 0.83 -0.13 2.65 0.00 -1.10 -1.76 119.26 121.14 3kv8 h ALA 52 Ca 0.24 0.09 -0.19 0.00 0.00 0.00 0.00 54.91 55.05 3kv8 h ALA 52 Cb 0.32 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3kv8 h ALA 52 CO -0.32 -0.19 -0.71 0.00 0.00 0.00 0.00 179.25 178.03 3kv8 h VAL 54 N 0.41 0.66 -0.31 0.00 2.07 -0.76 -0.76 116.25 117.55 3kv8 h VAL 54 Ca -0.03 -0.06 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 3kv8 h VAL 54 Cb 1.30 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 3kv8 h VAL 54 CO 0.13 0.03 -0.10 0.03 0.02 0.00 0.00 177.57 177.68 3kv8 h ARG 55 N 0.16 0.62 -0.72 1.57 3.08 -1.05 -2.04 114.38 116.01 3kv8 h ARG 55 Ca 0.25 -0.25 0.12 0.00 0.07 0.00 0.00 59.98 60.17 3kv8 h ARG 55 Cb 0.36 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 3kv8 h ARG 55 CO -0.38 0.82 0.48 0.00 -1.07 0.00 0.00 179.97 179.82 3kv8 h ALA 56 N 0.78 1.99 -0.02 0.04 0.00 -0.64 -3.08 119.26 118.33 3kv8 h ALA 56 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3kv8 h ALA 56 Cb 0.60 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3kv8 h ALA 56 CO 0.04 -0.16 -0.15 0.00 0.00 0.00 0.00 179.25 178.98 3kv8 n MET 57 N -4.49 1.92 -0.32 0.00 0.00 -0.32 -4.52 117.12 109.39 3kv8 n MET 57 Ca 0.13 -1.60 0.16 0.00 0.00 0.00 0.00 57.70 56.39 3kv8 n MET 57 Cb 0.43 -1.45 0.35 0.00 0.00 0.00 0.00 33.22 32.55 3kv8 n MET 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3kv8 h ALA 58 N 4.30 1.61 0.00 3.17 0.00 -1.28 -0.39 119.26 126.68 3kv8 h ALA 58 Ca 0.00 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3kv8 h ALA 58 Cb 0.89 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 3kv8 h ALA 58 CO 0.00 -0.34 -0.09 -1.35 0.00 0.00 0.00 179.25 177.48 3kv8 h PRO 59 N 0.46 0.00 0.00 0.00 0.11 -1.83 -2.60 132.00 128.14 3kv8 h PRO 59 Ca 0.61 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.66 3kv8 h PRO 59 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3kv8 h PRO 59 CO -0.52 0.09 -0.29 -0.92 -0.21 0.00 0.00 178.00 176.15 3kv8 h TYR 60 N 0.00 0.00 -3.85 0.65 3.20 -1.38 -3.46 116.97 112.13 3kv8 h TYR 60 Ca -0.00 0.00 -0.51 0.00 3.14 0.00 0.00 58.73 61.36 3kv8 h TYR 60 Cb 0.19 0.00 0.04 0.00 1.54 0.00 0.00 36.73 38.50 3kv8 h TYR 60 CO 0.00 0.29 0.54 -0.51 -1.64 0.00 0.00 178.16 176.83 3kv8 s LEU 61 N -7.33 4.47 0.42 2.82 1.43 -0.98 -5.07 118.68 114.45 3kv8 s LEU 61 Ca -0.01 2.44 -0.01 0.00 -1.03 0.00 0.00 54.13 55.52 3kv8 s LEU 61 Cb 0.12 -3.67 -0.02 0.00 0.03 0.00 0.00 46.19 42.65 3kv8 s LEU 61 CO 0.66 -0.34 0.65 -1.61 0.23 0.00 0.00 176.35 175.95 3kv8 s GLU 62 N -1.66 3.30 0.21 1.70 0.41 -1.26 -5.01 118.70 116.40 3kv8 s GLU 62 Ca 0.47 -0.29 -0.32 0.00 -0.41 0.00 0.00 54.97 54.43 3kv8 s GLU 62 Cb -0.35 -2.55 -0.14 0.00 -1.78 0.00 0.00 34.13 29.31 3kv8 s GLU 62 CO 0.45 -0.12 1.41 -2.30 -0.49 0.00 0.00 175.26 174.22 3kv8 n PRO 63 N -2.02 1.94 -0.41 0.39 -0.02 -1.26 -1.60 135.00 132.02 3kv8 n PRO 63 Ca -0.01 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3kv8 n PRO 63 Cb 0.57 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3kv8 n PRO 63 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kv8 n GLY 64 N 2.38 1.00 3.82 -1.23 0.00 -1.26 -5.05 105.19 104.85 3kv8 n GLY 64 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 3kv8 n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kv8 s GLU 65 N -0.45 2.99 0.00 1.61 2.02 -0.63 -1.22 118.70 123.02 3kv8 s GLU 65 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.17 3kv8 s GLU 65 Cb 0.00 -2.70 0.00 0.00 0.10 0.00 0.00 34.13 31.53 3kv8 s GLU 65 CO 0.00 0.49 0.00 0.41 0.02 0.00 0.00 175.26 176.18 3kv8 n GLY 66 N -0.37 4.41 3.12 -1.39 0.00 -0.45 -4.84 105.19 105.68 3kv8 n GLY 66 Ca -0.08 -1.37 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 3kv8 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kv8 s SER 67 N 0.52 0.25 0.06 1.61 1.04 -1.26 -0.84 113.70 115.08 3kv8 s SER 67 Ca 0.00 -0.67 0.07 0.00 0.48 0.00 0.00 55.95 55.83 3kv8 s SER 67 Cb 0.00 0.23 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 3kv8 s SER 67 CO 0.00 -0.56 -0.21 -0.76 0.98 0.00 0.00 173.24 172.70 3kv8 s LEU 68 N -2.42 2.20 -0.12 2.42 1.43 -0.06 -4.92 118.68 117.21 3kv8 s LEU 68 Ca -0.01 -0.56 -0.28 0.00 -1.03 0.00 0.00 54.13 52.25 3kv8 s LEU 68 Cb 0.02 -0.94 -0.02 0.00 0.03 0.00 0.00 46.19 45.28 3kv8 s LEU 68 CO -0.07 0.13 0.92 -0.83 0.23 0.00 0.00 176.35 176.74 3kv8 s GLY 69 N -1.36 2.32 0.00 -3.19 0.00 -1.26 -0.66 107.32 103.17 3kv8 s GLY 69 Ca 0.07 0.25 0.09 0.00 0.00 0.00 0.00 44.72 45.13 3kv8 s GLY 69 CO 0.02 1.77 0.43 -1.30 0.00 0.00 0.00 173.10 174.02 3kv8 n THR 70 N 4.52 0.00 -3.59 0.90 -2.24 0.23 -4.95 114.28 109.15 3kv8 n THR 70 Ca 0.06 -0.30 -0.14 0.00 -2.27 0.00 0.00 64.05 61.40 3kv8 n THR 70 Cb 0.49 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.68 3kv8 n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kv8 s ALA 71 N -1.78 -1.84 -0.04 6.98 0.00 -1.19 -4.96 121.76 118.93 3kv8 s ALA 71 Ca 0.04 1.70 -0.00 0.00 0.00 0.00 0.00 51.96 53.70 3kv8 s ALA 71 Cb 0.07 -0.77 0.03 0.00 0.00 0.00 0.00 23.12 22.45 3kv8 s ALA 71 CO 0.36 -0.33 0.00 -1.50 0.00 0.00 0.00 175.76 174.29 3kv8 s ILE 72 N -0.39 0.24 -0.34 0.00 1.10 -1.26 -1.77 121.20 118.78 3kv8 s ILE 72 Ca -0.03 0.11 -0.01 0.00 -0.51 0.00 0.00 60.65 60.21 3kv8 s ILE 72 Cb -0.03 -0.36 0.11 0.00 0.15 0.00 0.00 42.46 42.33 3kv8 s ILE 72 CO 0.03 0.19 0.15 0.00 -2.11 0.00 0.00 174.94 173.20 3kv8 s VAL 74 N 1.39 0.18 0.28 0.00 -7.23 -1.26 -0.83 120.40 112.92 3kv8 s VAL 74 Ca 0.12 -1.47 0.04 0.00 -1.81 0.00 0.00 61.98 58.87 3kv8 s VAL 74 Cb -0.19 -1.15 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 3kv8 s VAL 74 CO -0.19 -0.81 0.42 0.42 -0.31 0.00 0.00 175.10 174.63 3kv8 s THR 75 N -3.21 4.98 -0.26 5.32 -4.23 -0.28 -4.93 115.64 113.03 3kv8 s THR 75 Ca 0.00 -0.89 -0.03 0.00 -1.18 0.00 0.00 61.69 59.59 3kv8 s THR 75 Cb 0.03 -3.76 0.09 0.00 1.34 0.00 0.00 72.50 70.19 3kv8 s THR 75 CO -0.07 -0.33 0.09 -2.28 -0.54 0.00 0.00 174.62 171.48 3kv8 s HIS 76 N -2.09 1.00 -0.71 3.99 2.46 -1.26 -3.09 115.29 115.59 3kv8 s HIS 76 Ca 0.37 -1.14 0.10 0.00 0.47 0.00 0.00 55.06 54.86 3kv8 s HIS 76 Cb -0.09 -1.21 -0.05 0.00 -0.13 0.00 0.00 32.58 31.10 3kv8 s HIS 76 CO 0.31 -0.76 0.53 0.25 -2.47 0.00 0.00 174.74 172.60 3kv8 n THR 77 N 5.05 0.00 -3.52 0.89 -2.24 0.77 -4.97 114.28 110.26 3kv8 n THR 77 Ca -0.05 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.25 3kv8 n THR 77 Cb 0.44 1.07 -0.04 0.00 -2.10 0.00 0.00 70.33 69.69 3kv8 n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kv8 s ALA 78 N -1.60 -1.41 0.08 6.98 0.00 -1.24 -4.98 121.76 119.58 3kv8 s ALA 78 Ca 0.06 0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.57 3kv8 s ALA 78 Cb 0.08 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 3kv8 s ALA 78 CO 0.32 -0.61 0.14 0.00 0.00 0.00 0.00 175.76 175.60 3kv8 s ALA 79 N -3.01 3.75 -0.10 0.00 0.00 -1.26 -4.79 121.76 116.35 3kv8 s ALA 79 Ca -0.02 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 50.97 3kv8 s ALA 79 Cb -0.00 -1.59 0.03 0.00 0.00 0.00 0.00 23.12 21.55 3kv8 s ALA 79 CO -0.06 0.76 -0.04 0.99 0.00 0.00 0.00 175.76 177.41 3kv8 s THR 80 N -1.46 0.77 0.54 0.00 2.01 -1.26 -5.02 115.64 111.22 3kv8 s THR 80 Ca 0.32 -0.16 -0.06 0.00 0.31 0.00 0.00 61.69 62.10 3kv8 s THR 80 Cb -0.12 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.50 3kv8 s THR 80 CO 0.25 0.30 0.85 -2.16 -0.69 0.00 0.00 174.62 173.17 3kv8 s PRO 81 N 1.81 3.30 0.57 4.92 0.04 -1.26 -0.69 135.00 143.68 3kv8 s PRO 81 Ca 0.05 0.17 -0.21 0.00 0.04 0.00 0.00 61.00 61.05 3kv8 s PRO 81 Cb -0.13 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 3kv8 s PRO 81 CO -0.07 -0.43 1.28 -2.30 0.04 0.00 0.00 177.00 175.51 3kv8 n PRO 82 N -2.43 1.46 0.00 0.56 -0.02 -1.26 -3.30 135.00 130.01 3kv8 n PRO 82 Ca 0.03 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3kv8 n PRO 82 Cb 0.56 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3kv8 n PRO 82 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kv8 n GLY 83 N 0.88 2.27 3.87 -1.23 0.00 0.02 -5.00 105.19 106.00 3kv8 n GLY 83 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3kv8 n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kv8 s LEU 84 N 0.00 3.42 -0.25 0.99 1.43 -1.21 -4.72 118.68 118.34 3kv8 s LEU 84 Ca 0.00 1.36 -0.16 0.00 -1.03 0.00 0.00 54.13 54.30 3kv8 s LEU 84 Cb 0.00 -4.36 -0.03 0.00 0.03 0.00 0.00 46.19 41.83 3kv8 s LEU 84 CO 0.00 -0.73 0.43 -0.89 0.23 0.00 0.00 176.35 175.39 3kv8 s THR 85 N -2.93 5.15 -0.18 5.49 2.01 -1.26 -1.10 115.64 122.82 3kv8 s THR 85 Ca 0.54 0.71 -0.16 0.00 0.31 0.00 0.00 61.69 63.09 3kv8 s THR 85 Cb -0.11 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 3kv8 s THR 85 CO 0.46 0.16 0.42 -0.69 -0.69 0.00 0.00 174.62 174.28 3kv8 s VAL 86 N 1.95 5.19 -0.23 3.82 1.01 0.50 -3.67 120.40 128.97 3kv8 s VAL 86 Ca 0.18 0.77 -0.07 0.00 0.00 0.00 0.00 61.98 62.86 3kv8 s VAL 86 Cb -0.15 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 3kv8 s VAL 86 CO 0.09 0.27 0.06 -0.89 0.00 0.00 0.00 175.10 174.63 3kv8 s THR 87 N 1.16 4.43 -0.17 3.92 2.01 0.16 -0.81 115.64 126.34 3kv8 s THR 87 Ca 0.21 -0.14 -0.09 0.00 0.31 0.00 0.00 61.69 61.98 3kv8 s THR 87 Cb -0.15 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 3kv8 s THR 87 CO 0.08 0.38 0.12 -0.69 -0.69 0.00 0.00 174.62 173.82 3kv8 s VAL 88 N 1.22 5.36 -0.17 3.82 1.01 -0.23 -1.95 120.40 129.45 3kv8 s VAL 88 Ca 0.05 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 3kv8 s VAL 88 Cb -0.14 -3.40 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 3kv8 s VAL 88 CO 0.03 0.51 -0.12 -0.89 0.00 0.00 0.00 175.10 174.63 3kv8 s THR 89 N -0.15 2.87 -0.26 3.92 2.01 -0.08 -0.94 115.64 123.01 3kv8 s THR 89 Ca 0.10 -0.69 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 3kv8 s THR 89 Cb -0.11 -2.24 0.01 0.00 0.01 0.00 0.00 72.50 70.16 3kv8 s THR 89 CO 0.00 0.49 -0.00 0.00 -0.69 0.00 0.00 174.62 174.42 3kv8 s ALA 90 N 0.99 2.86 -0.21 7.40 0.00 0.65 -1.22 121.76 132.24 3kv8 s ALA 90 Ca -0.01 -1.38 -0.06 0.00 0.00 0.00 0.00 51.96 50.50 3kv8 s ALA 90 Cb -0.15 -1.86 -0.03 0.00 0.00 0.00 0.00 23.12 21.08 3kv8 s ALA 90 CO -0.02 -0.76 0.02 -2.00 0.00 0.00 0.00 175.76 173.01 3kv8 s GLU 91 N 1.43 3.66 0.10 0.00 2.12 0.91 -0.70 118.70 126.22 3kv8 s GLU 91 Ca 0.02 -0.49 -0.31 0.00 0.36 0.00 0.00 54.97 54.55 3kv8 s GLU 91 Cb -0.16 -3.15 -0.07 0.00 0.26 0.00 0.00 34.13 31.00 3kv8 s GLU 91 CO -0.02 -0.02 1.32 -1.17 -0.54 0.00 0.00 175.26 174.84 3kv8 s LEU 92 N 1.10 4.38 -0.16 2.70 2.96 -0.36 -1.12 118.68 128.17 3kv8 s LEU 92 Ca 0.03 2.23 0.05 0.00 -0.22 0.00 0.00 54.13 56.22 3kv8 s LEU 92 Cb -0.14 -3.59 -0.13 0.00 0.50 0.00 0.00 46.19 42.83 3kv8 s LEU 92 CO 0.02 -0.58 -0.09 0.54 -1.32 0.00 0.00 176.35 174.92 3kv8 n ARG 93 N 3.82 0.86 -3.60 1.98 5.12 0.88 -0.25 116.66 125.47 3kv8 n ARG 93 Ca 0.10 0.07 -0.16 0.00 -1.93 0.00 0.00 57.85 55.92 3kv8 n ARG 93 Cb 0.44 -1.35 -0.07 0.00 -1.16 0.00 0.00 32.46 30.31 3kv8 n ARG 93 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3kv8 s SER 94 N -5.39 -0.51 -0.10 0.55 1.04 -0.95 -4.85 113.70 103.49 3kv8 s SER 94 Ca -0.18 0.52 -0.03 0.00 0.48 0.00 0.00 55.95 56.73 3kv8 s SER 94 Cb 0.05 0.47 0.05 0.00 0.10 0.00 0.00 66.02 66.70 3kv8 s SER 94 CO 0.46 -0.55 0.14 -0.69 0.98 0.00 0.00 173.24 173.57 3kv8 s VAL 95 N -1.22 -0.22 -0.23 5.02 1.01 -1.26 -1.45 120.40 122.05 3kv8 s VAL 95 Ca -0.12 0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.07 3kv8 s VAL 95 Cb -0.02 -0.35 0.10 0.00 0.00 0.00 0.00 36.38 36.11 3kv8 s VAL 95 CO 0.08 0.05 0.22 -1.61 0.00 0.00 0.00 175.10 173.84 3kv8 s GLU 96 N 2.25 0.21 7.38 2.72 2.02 -0.01 -5.02 118.70 128.25 3kv8 s GLU 96 Ca 0.04 0.04 0.00 0.00 0.02 0.00 0.00 54.97 55.07 3kv8 s GLU 96 Cb -0.13 -1.15 0.00 0.00 0.10 0.00 0.00 34.13 32.95 3kv8 s GLU 96 CO -0.06 -0.77 0.00 0.41 0.02 0.00 0.00 175.26 174.86 3kv8 n GLY 97 N 5.31 3.44 0.01 -1.39 0.00 -1.26 -1.45 105.19 109.85 3kv8 n GLY 97 Ca -0.05 0.23 0.13 0.00 0.00 0.00 0.00 46.02 46.33 3kv8 n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kv8 n ARG 98 N 9.68 0.07 -4.22 1.61 5.12 -1.26 -4.89 116.66 122.76 3kv8 n ARG 98 Ca 0.00 -0.02 -0.34 0.00 -1.93 0.00 0.00 57.85 55.56 3kv8 n ARG 98 Cb 0.00 -1.50 -0.12 0.00 -1.16 0.00 0.00 32.46 29.68 3kv8 n ARG 98 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3kv8 s ARG 99 N -2.94 3.69 0.03 5.56 1.81 -0.53 0.00 118.95 126.57 3kv8 s ARG 99 Ca 0.15 -0.50 0.03 0.00 -1.72 0.00 0.00 55.73 53.69 3kv8 s ARG 99 Cb 0.19 -3.02 -0.02 0.00 -0.45 0.00 0.00 34.95 31.65 3kv8 s ARG 99 CO 0.58 0.15 -0.10 -0.51 -0.68 0.00 0.00 175.30 174.74 3kv8 s LEU 100 N 0.62 2.16 -0.00 2.53 1.02 -0.51 -0.83 118.68 123.66 3kv8 s LEU 100 Ca -0.01 -0.41 0.02 0.00 0.02 0.00 0.00 54.13 53.75 3kv8 s LEU 100 Cb -0.14 -0.39 -0.00 0.00 0.02 0.00 0.00 46.19 45.68 3kv8 s LEU 100 CO 0.02 -0.04 -0.05 -0.55 0.02 0.00 0.00 176.35 175.75 3kv8 s SER 101 N -1.06 0.60 0.10 2.29 0.15 -0.53 -0.76 113.70 114.49 3kv8 s SER 101 Ca -0.02 -0.09 0.04 0.00 0.70 0.00 0.00 55.95 56.58 3kv8 s SER 101 Cb -0.07 -0.07 -0.03 0.00 -1.71 0.00 0.00 66.02 64.13 3kv8 s SER 101 CO 0.01 0.06 -0.11 0.26 1.20 0.00 0.00 173.24 174.65 3kv8 s TRP 102 N -0.09 1.14 -0.10 3.44 0.51 0.28 -0.08 118.94 124.04 3kv8 s TRP 102 Ca 0.02 -0.60 -0.21 0.00 -2.12 0.00 0.00 56.10 53.19 3kv8 s TRP 102 Cb -0.02 -0.62 -0.04 0.00 -0.81 0.00 0.00 33.47 31.98 3kv8 s TRP 102 CO -0.00 0.04 0.58 0.50 -0.51 0.00 0.00 176.95 177.56 3kv8 s ARG 103 N -2.56 4.38 0.11 4.98 3.52 -0.27 -1.52 118.95 127.58 3kv8 s ARG 103 Ca 0.04 0.64 0.10 0.00 -0.13 0.00 0.00 55.73 56.38 3kv8 s ARG 103 Cb -0.05 -3.45 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 3kv8 s ARG 103 CO 0.01 0.11 -0.22 0.14 -0.81 0.00 0.00 175.30 174.52 3kv8 s VAL 104 N 0.74 2.54 0.03 7.11 -7.23 0.10 -0.06 120.40 123.62 3kv8 s VAL 104 Ca 0.31 -1.57 -0.10 0.00 -1.81 0.00 0.00 61.98 58.81 3kv8 s VAL 104 Cb -0.16 -2.13 0.01 0.00 0.56 0.00 0.00 36.38 34.66 3kv8 s VAL 104 CO 0.14 0.14 0.22 -0.94 -0.31 0.00 0.00 175.10 174.34 3kv8 s SER 105 N -1.97 -0.02 0.04 4.85 1.04 -0.35 -1.16 113.70 116.13 3kv8 s SER 105 Ca 0.15 -0.25 0.03 0.00 0.48 0.00 0.00 55.95 56.36 3kv8 s SER 105 Cb -0.10 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.28 3kv8 s SER 105 CO 0.07 -0.52 -0.09 0.00 0.98 0.00 0.00 173.24 173.68 3kv8 s ALA 106 N -2.20 0.71 -0.03 5.32 0.00 -0.08 -0.90 121.76 124.57 3kv8 s ALA 106 Ca -0.08 -0.74 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 3kv8 s ALA 106 Cb -0.03 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.08 3kv8 s ALA 106 CO -0.02 0.05 0.10 -1.58 0.00 0.00 0.00 175.76 174.32 3kv8 s HIS 107 N -1.16 -0.08 -0.33 0.00 5.04 -0.82 -0.39 115.29 117.55 3kv8 s HIS 107 Ca -0.06 0.21 0.09 0.00 -1.54 0.00 0.00 55.06 53.75 3kv8 s HIS 107 Cb -0.09 0.02 0.59 0.00 0.04 0.00 0.00 32.58 33.15 3kv8 s HIS 107 CO 0.01 -0.09 1.64 -0.40 -2.34 0.00 0.00 174.74 173.56 3kv8 n ASP 108 N 2.79 3.39 0.00 9.88 5.68 -0.55 -0.66 116.55 137.08 3kv8 n ASP 108 Ca -0.14 -3.54 0.00 0.00 -0.50 0.00 0.00 54.79 50.61 3kv8 n ASP 108 Cb 0.59 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 3kv8 n ASP 108 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kv8 n GLY 109 N -0.89 2.84 0.82 6.12 0.00 -1.24 -4.11 105.19 108.72 3kv8 n GLY 109 Ca 0.40 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.37 3kv8 n GLY 109 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kv8 n VAL 110 N -2.00 0.62 -4.35 1.61 0.31 -1.26 -5.08 118.33 108.17 3kv8 n VAL 110 Ca 0.00 0.04 -0.23 0.00 -0.01 0.00 0.00 64.34 64.14 3kv8 n VAL 110 Cb 0.00 -1.63 -0.11 0.00 -0.91 0.00 0.00 33.84 31.18 3kv8 n VAL 110 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3kv8 s ASP 111 N -5.68 2.89 0.11 4.52 1.01 -1.26 -5.10 116.67 113.16 3kv8 s ASP 111 Ca -0.08 -0.85 -0.31 0.00 0.71 0.00 0.00 52.55 52.02 3kv8 s ASP 111 Cb 0.03 -0.18 -0.09 0.00 1.01 0.00 0.00 42.92 43.69 3kv8 s ASP 111 CO 0.10 0.02 1.51 -1.61 0.21 0.00 0.00 175.17 175.41 3kv8 s GLU 112 N -2.67 4.25 0.00 8.23 0.41 -1.26 -1.48 118.70 126.18 3kv8 s GLU 112 Ca 0.16 2.22 0.14 0.00 -0.41 0.00 0.00 54.97 57.09 3kv8 s GLU 112 Cb -0.07 -3.32 -0.13 0.00 -1.78 0.00 0.00 34.13 28.83 3kv8 s GLU 112 CO 0.07 -0.58 0.63 0.44 -0.49 0.00 0.00 175.26 175.33 3kv8 n ILE 113 N 4.19 0.00 0.00 -1.63 -5.35 0.48 -4.31 119.36 112.74 3kv8 n ILE 113 Ca 0.13 -0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 3kv8 n ILE 113 Cb 0.41 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.33 3kv8 n ILE 113 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3kv8 n GLY 114 N 1.30 2.28 3.54 3.28 0.00 -1.20 -0.16 105.19 114.23 3kv8 n GLY 114 Ca 0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 45.08 3kv8 n GLY 114 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kv8 s SER 115 N 0.00 -0.41 0.00 1.61 1.04 -1.18 -0.91 113.70 113.86 3kv8 s SER 115 Ca 0.00 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.32 3kv8 s SER 115 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 3kv8 s SER 115 CO 0.00 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 173.97 3kv8 n GLY 116 N -0.34 -0.55 3.21 7.32 0.00 -0.31 -1.12 105.19 113.39 3kv8 n GLY 116 Ca -0.11 -0.35 -0.14 0.00 0.00 0.00 0.00 46.02 45.42 3kv8 n GLY 116 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kv8 s THR 117 N -3.63 1.02 -0.01 2.61 -4.23 -0.01 -0.72 115.64 110.66 3kv8 s THR 117 Ca 0.00 -1.83 -0.00 0.00 -1.18 0.00 0.00 61.69 58.68 3kv8 s THR 117 Cb 0.00 -1.58 0.01 0.00 1.34 0.00 0.00 72.50 72.27 3kv8 s THR 117 CO 0.00 -0.65 0.02 -2.28 -0.54 0.00 0.00 174.62 171.17 3kv8 s HIS 118 N -2.87 -0.01 0.00 3.99 5.04 -0.58 -0.83 115.29 120.04 3kv8 s HIS 118 Ca 0.10 0.06 0.06 0.00 -1.54 0.00 0.00 55.06 53.75 3kv8 s HIS 118 Cb -0.00 -0.05 -0.03 0.00 0.04 0.00 0.00 32.58 32.54 3kv8 s HIS 118 CO -0.00 -0.03 -0.19 -1.21 -2.34 0.00 0.00 174.74 170.97 3kv8 s GLU 119 N 0.27 2.18 0.15 2.88 8.01 -0.73 -0.56 118.70 130.91 3kv8 s GLU 119 Ca -0.02 -0.90 0.05 0.00 0.01 0.00 0.00 54.97 54.11 3kv8 s GLU 119 Cb -0.03 -2.20 -0.04 0.00 -4.31 0.00 0.00 34.13 27.55 3kv8 s GLU 119 CO -0.01 0.57 -0.11 1.03 0.01 0.00 0.00 175.26 176.74 3kv8 s ARG 120 N -1.06 1.08 -0.08 1.61 0.52 0.06 -0.60 118.95 120.48 3kv8 s ARG 120 Ca 0.13 -1.43 0.02 0.00 -0.52 0.00 0.00 55.73 53.93 3kv8 s ARG 120 Cb -0.10 -0.74 0.01 0.00 0.52 0.00 0.00 34.95 34.64 3kv8 s ARG 120 CO 0.02 0.11 -0.15 0.00 0.02 0.00 0.00 175.30 175.30 3kv8 s ALA 121 N -3.05 1.50 0.21 2.13 0.00 0.17 -1.43 121.76 121.28 3kv8 s ALA 121 Ca 0.16 -0.57 -0.30 0.00 0.00 0.00 0.00 51.96 51.25 3kv8 s ALA 121 Cb 0.01 -0.67 -0.08 0.00 0.00 0.00 0.00 23.12 22.38 3kv8 s ALA 121 CO 0.02 0.10 1.22 0.08 0.00 0.00 0.00 175.76 177.18 3kv8 s VAL 122 N 0.69 3.43 0.16 0.00 1.01 0.10 -0.88 120.40 124.91 3kv8 s VAL 122 Ca -0.13 1.23 0.09 0.00 0.00 0.00 0.00 61.98 63.16 3kv8 s VAL 122 Cb -0.16 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3kv8 s VAL 122 CO 0.03 0.21 -0.19 0.27 0.00 0.00 0.00 175.10 175.42 3kv8 s ILE 123 N -0.18 1.86 -0.32 2.22 -4.36 -0.02 -4.93 121.20 115.46 3kv8 s ILE 123 Ca 0.53 -1.86 -0.23 0.00 -0.26 0.00 0.00 60.65 58.83 3kv8 s ILE 123 Cb -0.34 -1.82 0.00 0.00 1.25 0.00 0.00 42.46 41.55 3kv8 s ILE 123 CO 0.38 -0.25 0.76 -2.28 0.24 0.00 0.00 174.94 173.80 3kv8 s HIS 124 N -1.84 3.18 0.17 1.37 5.65 -1.26 -1.34 115.29 121.21 3kv8 s HIS 124 Ca 0.15 0.69 -0.14 0.00 0.25 0.00 0.00 55.06 56.01 3kv8 s HIS 124 Cb -0.07 -3.24 0.07 0.00 -1.18 0.00 0.00 32.58 28.16 3kv8 s HIS 124 CO 0.06 -0.60 1.82 -0.07 -0.65 0.00 0.00 174.74 175.30 3kv8 h LEU 125 N 9.50 0.64 -0.15 8.88 3.38 -1.49 -0.65 115.31 135.42 3kv8 h LEU 125 Ca -0.25 -0.04 -0.23 0.00 0.09 0.00 0.00 57.88 57.45 3kv8 h LEU 125 Cb 1.10 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.70 3kv8 h LEU 125 CO 0.88 0.49 -0.90 -0.33 0.09 0.00 0.00 178.44 178.68 3kv8 h GLU 126 N 0.73 0.62 -0.42 1.13 4.39 -1.93 -0.45 114.58 118.65 3kv8 h GLU 126 Ca 0.20 -0.59 -0.04 0.00 0.34 0.00 0.00 59.36 59.26 3kv8 h GLU 126 Cb -0.04 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 3kv8 h GLU 126 CO -0.04 1.21 0.09 -0.22 -1.16 0.00 0.00 179.01 178.89 3kv8 h LYS 127 N 0.39 0.68 -0.28 2.33 3.64 -1.91 -1.92 116.57 119.50 3kv8 h LYS 127 Ca -0.08 -0.17 0.02 0.00 -1.27 0.00 0.00 60.65 59.15 3kv8 h LYS 127 Cb 1.53 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 33.23 3kv8 h LYS 127 CO 0.17 0.70 0.11 0.35 -2.27 0.00 0.00 179.45 178.52 3kv8 h PHE 128 N 0.54 0.21 -0.42 1.91 3.57 -1.03 -1.79 116.94 119.93 3kv8 h PHE 128 Ca 0.13 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.67 3kv8 h PHE 128 Cb 0.34 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3kv8 h PHE 128 CO 0.02 0.10 0.28 -0.91 -2.23 0.00 0.00 178.31 175.57 3kv8 h ASN 129 N 0.25 0.40 -0.43 0.41 2.35 -0.91 -1.19 115.58 116.47 3kv8 h ASN 129 Ca 0.12 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.74 3kv8 h ASN 129 Cb 0.07 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3kv8 h ASN 129 CO -0.11 0.28 -0.20 0.00 -1.65 0.00 0.00 177.43 175.75 3kv8 h ALA 130 N 1.76 0.77 -0.64 -0.83 0.00 -0.92 -0.03 119.26 119.37 3kv8 h ALA 130 Ca 0.17 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3kv8 h ALA 130 Cb 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3kv8 h ALA 130 CO -0.04 0.66 0.27 0.87 0.00 0.00 0.00 179.25 181.01 3kv8 h LYS 131 N 0.81 0.95 -0.33 0.00 1.57 -0.42 -1.96 116.57 117.19 3kv8 h LYS 131 Ca 0.11 -0.17 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 3kv8 h LYS 131 Cb 0.75 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 3kv8 h LYS 131 CO 0.06 0.79 -0.21 -0.24 -0.57 0.00 0.00 179.45 179.29 3kv8 h VAL 132 N 0.90 1.29 -0.98 0.50 3.04 -1.05 -2.74 116.25 117.21 3kv8 h VAL 132 Ca 0.21 -1.34 0.18 0.00 -1.01 0.00 0.00 66.70 64.75 3kv8 h VAL 132 Cb 0.19 1.44 -0.11 0.00 -2.01 0.00 0.00 31.29 30.80 3kv8 h VAL 132 CO -0.02 0.44 0.59 0.03 -1.01 0.00 0.00 177.57 177.59 3kv8 h ARG 133 N 0.50 0.73 0.00 4.17 3.08 -0.88 -1.90 114.38 120.08 3kv8 h ARG 133 Ca 0.07 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3kv8 h ARG 133 Cb 0.76 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3kv8 h ARG 133 CO 0.06 0.48 0.00 0.00 -1.07 0.00 0.00 179.97 179.44 3kv8 n GLN 134 N -4.78 0.11 -0.15 0.04 10.64 -0.75 -1.97 117.38 120.52 3kv8 n GLN 134 Ca 0.22 0.36 0.05 0.00 -1.83 0.00 0.00 57.00 55.80 3kv8 n GLN 134 Cb 0.55 -1.72 0.12 0.00 -0.86 0.00 0.00 30.24 28.33 3kv8 n GLN 134 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 3kv8 n LYS 135 N -1.92 2.76 -3.03 2.61 2.85 -0.75 -4.98 118.16 115.70 3kv8 n LYS 135 Ca 0.03 -2.04 -0.40 0.00 -1.05 0.00 0.00 58.31 54.85 3kv8 n LYS 135 Cb 0.20 -1.29 -0.05 0.00 -0.65 0.00 0.00 35.03 33.24 3kv8 n LYS 135 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 3kv8 s THR 136 N -1.46 5.01 -2.00 0.58 2.01 -0.83 -5.10 115.64 113.85 3kv8 s THR 136 Ca 0.19 1.43 0.06 0.00 0.31 0.00 0.00 61.69 63.69 3kv8 s THR 136 Cb 0.13 -4.04 0.18 0.00 0.01 0.00 0.00 72.50 68.77 3kv8 s THR 136 CO 0.08 0.19 0.84 -2.65 -0.69 0.00 0.00 174.62 172.39