#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kvz s ARG 6 N 0.00 2.92 0.10 0.03 1.04 -1.26 -5.05 118.95 116.73 3kvz s ARG 6 Ca 0.00 -0.96 -0.35 0.00 -1.04 0.00 0.00 55.73 53.38 3kvz s ARG 6 Cb 0.00 -3.24 -0.18 0.00 -2.04 0.00 0.00 34.95 29.49 3kvz s ARG 6 CO 0.00 -0.46 1.00 0.28 -0.04 0.00 0.00 175.30 176.07 3kvz n VAL 7 N 4.78 0.70 0.00 4.99 0.31 -1.26 0.39 118.33 128.24 3kvz n VAL 7 Ca -0.15 -0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 3kvz n VAL 7 Cb 0.47 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 33.09 3kvz n VAL 7 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kvz n GLY 8 N 1.84 2.42 3.76 2.92 0.00 0.67 -5.01 105.19 111.79 3kvz n GLY 8 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3kvz n GLY 8 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kvz s GLU 9 N -0.92 4.21 -0.01 1.61 2.12 0.16 -4.79 118.70 121.09 3kvz s GLU 9 Ca 0.00 2.41 0.04 0.00 0.36 0.00 0.00 54.97 57.78 3kvz s GLU 9 Cb 0.00 -3.04 -0.01 0.00 0.26 0.00 0.00 34.13 31.33 3kvz s GLU 9 CO 0.00 -0.44 -0.13 1.03 -0.54 0.00 0.00 175.26 175.18 3kvz s ARG 10 N -1.18 1.04 -0.03 4.30 0.52 -1.26 -0.89 118.95 121.45 3kvz s ARG 10 Ca 0.56 -0.48 0.03 0.00 -0.52 0.00 0.00 55.73 55.33 3kvz s ARG 10 Cb -0.44 -1.01 -0.00 0.00 0.52 0.00 0.00 34.95 34.02 3kvz s ARG 10 CO 0.52 0.28 -0.13 0.12 0.02 0.00 0.00 175.30 176.10 3kvz s PHE 11 N -0.33 1.35 0.02 -0.53 5.36 -0.35 -5.00 117.98 118.50 3kvz s PHE 11 Ca 0.05 -0.37 0.06 0.00 -0.96 0.00 0.00 56.93 55.71 3kvz s PHE 11 Cb -0.05 -0.93 -0.03 0.00 -0.34 0.00 0.00 43.02 41.67 3kvz s PHE 11 CO -0.00 -0.13 -0.16 0.99 -1.46 0.00 0.00 175.22 174.46 3kvz s THR 12 N 0.10 2.93 -0.04 0.12 2.01 -1.26 -0.68 115.64 118.82 3kvz s THR 12 Ca -0.03 -1.03 -0.00 0.00 0.31 0.00 0.00 61.69 60.93 3kvz s THR 12 Cb -0.10 -2.22 0.03 0.00 0.01 0.00 0.00 72.50 70.22 3kvz s THR 12 CO 0.01 0.41 0.01 -2.28 -0.69 0.00 0.00 174.62 172.08 3kvz s HIS 13 N -0.88 0.41 0.08 4.92 2.46 0.28 -4.98 115.29 117.57 3kvz s HIS 13 Ca 0.14 -0.02 0.06 0.00 0.47 0.00 0.00 55.06 55.71 3kvz s HIS 13 Cb -0.11 -0.56 -0.04 0.00 -0.13 0.00 0.00 32.58 31.75 3kvz s HIS 13 CO 0.04 -0.20 -0.10 -0.51 -2.47 0.00 0.00 174.74 171.50 3kvz s ASP 14 N 1.49 4.37 -0.27 9.88 1.01 -1.26 0.23 116.67 132.12 3kvz s ASP 14 Ca -0.03 -0.35 -0.04 0.00 0.71 0.00 0.00 52.55 52.85 3kvz s ASP 14 Cb -0.13 -0.86 0.15 0.00 1.01 0.00 0.00 42.92 43.10 3kvz s ASP 14 CO -0.03 0.21 0.52 0.12 0.21 0.00 0.00 175.17 176.20 3kvz s PHE 15 N -1.14 -1.25 0.01 4.23 5.36 -0.31 -4.97 117.98 119.91 3kvz s PHE 15 Ca 0.20 1.54 -0.30 0.00 -0.96 0.00 0.00 56.93 57.40 3kvz s PHE 15 Cb -0.11 0.42 -0.06 0.00 -0.34 0.00 0.00 43.02 42.93 3kvz s PHE 15 CO 0.12 -0.76 1.37 0.08 -1.46 0.00 0.00 175.22 174.57 3kvz s VAL 16 N 2.75 3.74 -0.10 3.12 1.01 -1.26 -1.22 120.40 128.43 3kvz s VAL 16 Ca 0.12 1.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.95 3kvz s VAL 16 Cb -0.14 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 3kvz s VAL 16 CO -0.18 0.01 1.07 -0.69 0.00 0.00 0.00 175.10 175.31 3kvz s VAL 17 N 2.15 4.61 0.54 2.92 1.01 -0.48 -4.89 120.40 126.26 3kvz s VAL 17 Ca 0.63 1.90 -0.04 0.00 0.00 0.00 0.00 61.98 64.47 3kvz s VAL 17 Cb -0.31 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 31.85 3kvz s VAL 17 CO 0.27 -0.01 0.82 -2.16 0.00 0.00 0.00 175.10 174.02 3kvz s PRO 18 N 2.13 3.03 0.57 2.72 0.04 -1.26 0.54 135.00 142.77 3kvz s PRO 18 Ca 0.50 -0.12 0.27 0.00 0.04 0.00 0.00 61.00 61.69 3kvz s PRO 18 Cb -0.20 -2.37 1.53 0.00 0.04 0.00 0.00 34.50 33.50 3kvz s PRO 18 CO 0.19 -0.52 2.03 -1.00 0.04 0.00 0.00 177.00 177.73 3kvz h PRO 19 N 0.03 0.00 -0.35 0.56 0.13 -1.95 -2.55 132.00 127.87 3kvz h PRO 19 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3kvz h PRO 19 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3kvz h PRO 19 CO 0.60 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 175.98 3kvz n HIS 20 N -3.99 0.46 -1.13 1.56 1.44 -1.26 -3.66 115.22 108.64 3kvz n HIS 20 Ca 0.05 -0.22 0.00 0.00 -2.01 0.00 0.00 57.72 55.54 3kvz n HIS 20 Cb 0.46 -0.01 0.26 0.00 0.12 0.00 0.00 29.99 30.82 3kvz n HIS 20 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3kvz n LYS 21 N 0.46 2.90 -2.29 -1.40 4.76 -0.96 -4.76 118.16 116.87 3kvz n LYS 21 Ca 0.11 -3.01 -0.25 0.00 -2.87 0.00 0.00 58.31 52.29 3kvz n LYS 21 Cb 0.29 -1.96 0.08 0.00 -1.84 0.00 0.00 35.03 31.60 3kvz n LYS 21 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3kvz s THR 22 N -3.00 2.28 0.21 -0.18 -4.23 -1.24 -2.02 115.64 107.47 3kvz s THR 22 Ca 0.47 -0.35 -0.20 0.00 -1.18 0.00 0.00 61.69 60.44 3kvz s THR 22 Cb 0.39 -2.94 0.18 0.00 1.34 0.00 0.00 72.50 71.47 3kvz s THR 22 CO 0.08 0.00 1.56 0.58 -0.54 0.00 0.00 174.62 176.30 3kvz h VAL 23 N -0.59 0.04 0.00 2.29 2.07 -1.59 -1.36 116.25 117.11 3kvz h VAL 23 Ca -0.43 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.09 3kvz h VAL 23 Cb 1.30 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 3kvz h VAL 23 CO 0.54 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 176.02 3kvz n ARG 24 N -5.44 0.08 0.06 1.57 1.85 -1.26 -2.04 116.66 111.48 3kvz n ARG 24 Ca 0.08 0.19 0.11 0.00 -1.00 0.00 0.00 57.85 57.23 3kvz n ARG 24 Cb 0.38 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 30.26 3kvz n ARG 24 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3kvz n HIS 25 N -1.43 0.57 -0.12 2.89 8.25 -0.52 -3.57 115.22 121.30 3kvz n HIS 25 Ca 0.05 0.17 -0.12 0.00 -0.26 0.00 0.00 57.72 57.56 3kvz n HIS 25 Cb 0.17 -0.72 -0.02 0.00 1.12 0.00 0.00 29.99 30.54 3kvz n HIS 25 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3kvz h LEU 26 N 0.00 0.84 -6.92 2.41 5.85 -1.39 -3.36 115.31 112.73 3kvz h LEU 26 Ca 0.00 -0.42 -0.61 0.00 0.84 0.00 0.00 57.88 57.69 3kvz h LEU 26 Cb 0.92 -0.23 -0.40 0.00 0.37 0.00 0.00 40.66 41.32 3kvz h LEU 26 CO 0.00 1.08 -0.72 -0.31 -0.34 0.00 0.00 178.44 178.14 3kvz s TYR 27 N -4.56 2.45 0.49 1.25 2.02 -1.26 -4.96 117.35 112.77 3kvz s TYR 27 Ca -0.12 -2.79 0.15 0.00 -0.37 0.00 0.00 57.07 53.94 3kvz s TYR 27 Cb 0.10 -2.05 1.17 0.00 -0.40 0.00 0.00 41.96 40.78 3kvz s TYR 27 CO 0.84 -0.71 2.08 -1.35 -1.57 0.00 0.00 175.55 174.84 3kvz h PRO 28 N 6.01 0.17 0.00 -1.71 0.11 -1.71 -1.09 132.00 133.77 3kvz h PRO 28 Ca 0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3kvz h PRO 28 Cb 0.86 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3kvz h PRO 28 CO 0.56 0.11 0.00 -0.85 -0.21 0.00 0.00 178.00 177.61 3kvz n GLU 29 N -4.49 0.19 -3.42 1.05 0.00 -1.26 -4.63 120.64 108.07 3kvz n GLU 29 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 57.16 56.75 3kvz n GLU 29 Cb 0.21 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.07 3kvz n GLU 29 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3kvz s SER 30 N -2.00 6.13 0.45 -1.84 0.15 -0.42 -4.88 113.70 111.29 3kvz s SER 30 Ca 0.09 -1.13 0.17 0.00 0.70 0.00 0.00 55.95 55.78 3kvz s SER 30 Cb 0.04 -2.17 1.12 0.00 -1.71 0.00 0.00 66.02 63.30 3kvz s SER 30 CO 0.07 -0.56 1.95 -0.65 1.20 0.00 0.00 173.24 175.25 3kvz h PRO 31 N 8.70 0.31 0.00 5.44 0.11 -1.88 -1.60 132.00 143.08 3kvz h PRO 31 Ca -0.28 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 3kvz h PRO 31 Cb 1.11 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3kvz h PRO 31 CO 0.81 0.21 -0.22 0.93 -0.21 0.00 0.00 178.00 179.51 3kvz h GLU 32 N 0.32 0.00 0.00 1.05 3.07 -1.96 -3.27 114.58 113.79 3kvz h GLU 32 Ca 0.32 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 59.07 3kvz h GLU 32 Cb 0.80 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.69 3kvz h GLU 32 CO -0.08 0.22 -1.97 1.19 -1.40 0.00 0.00 179.01 176.97 3kvz n PHE 33 N -3.29 0.00 -0.58 4.33 3.72 -1.03 -4.54 117.46 116.07 3kvz n PHE 33 Ca 0.01 0.00 0.46 0.00 -0.05 0.00 0.00 57.45 57.87 3kvz n PHE 33 Cb 0.49 -0.57 0.75 0.00 -0.94 0.00 0.00 39.48 39.20 3kvz n PHE 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3kvz h ALA 34 N 1.45 3.32 0.16 4.37 0.00 -1.35 -0.64 119.26 126.57 3kvz h ALA 34 Ca -0.16 0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.46 3kvz h ALA 34 Cb 1.26 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3kvz h ALA 34 CO 0.01 -1.94 -1.60 0.93 0.00 0.00 0.00 179.25 176.65 3kvz h GLU 35 N 0.01 0.34 -3.42 0.00 4.39 -1.80 -3.47 114.58 110.63 3kvz h GLU 35 Ca 0.89 -0.57 -0.34 0.00 0.34 0.00 0.00 59.36 59.68 3kvz h GLU 35 Cb 3.23 0.21 0.11 0.00 -0.10 0.00 0.00 28.75 32.20 3kvz h GLU 35 CO -0.23 1.23 -0.69 1.19 -1.16 0.00 0.00 179.01 179.34 3kvz n PHE 36 N -3.53 -1.76 -1.64 4.33 3.01 -0.25 -4.92 117.46 112.71 3kvz n PHE 36 Ca -0.19 0.24 -0.40 0.00 1.01 0.00 0.00 57.45 58.10 3kvz n PHE 36 Cb 1.06 -0.95 0.02 0.00 -0.01 0.00 0.00 39.48 39.60 3kvz n PHE 36 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 3kvz n PRO 37 N 0.90 1.38 -1.47 -1.08 -0.02 -1.26 -4.85 135.00 128.60 3kvz n PRO 37 Ca 0.04 0.50 -0.40 0.00 -2.02 0.00 0.00 63.50 61.62 3kvz n PRO 37 Cb 0.27 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.57 3kvz n PRO 37 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3kvz n GLU 38 N -0.20 2.90 -4.38 -0.52 -0.58 -1.26 -4.45 120.64 112.16 3kvz n GLU 38 Ca 0.10 -2.32 -0.28 0.00 -0.42 0.00 0.00 57.16 54.24 3kvz n GLU 38 Cb 0.41 -3.05 -0.13 0.00 -0.57 0.00 0.00 31.44 28.11 3kvz n GLU 38 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3kvz s VAL 39 N 3.11 2.17 -0.21 2.62 -7.23 -1.26 -4.25 120.40 115.36 3kvz s VAL 39 Ca 0.54 -1.78 -0.39 0.00 -1.81 0.00 0.00 61.98 58.55 3kvz s VAL 39 Cb 0.15 -1.94 -0.15 0.00 0.56 0.00 0.00 36.38 34.99 3kvz s VAL 39 CO -0.05 0.01 1.73 0.33 -0.31 0.00 0.00 175.10 176.81 3kvz n PHE 40 N 0.80 2.06 -2.74 2.82 7.35 0.12 -1.87 117.46 125.99 3kvz n PHE 40 Ca -0.17 0.45 -0.37 0.00 -0.76 0.00 0.00 57.45 56.60 3kvz n PHE 40 Cb 0.54 -2.48 -0.06 0.00 0.35 0.00 0.00 39.48 37.82 3kvz n PHE 40 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3kvz s ALA 41 N 3.31 3.20 0.22 3.13 0.00 -0.86 -4.72 121.76 126.04 3kvz s ALA 41 Ca 0.96 0.56 -0.11 0.00 0.00 0.00 0.00 51.96 53.37 3kvz s ALA 41 Cb -0.99 -3.20 0.31 0.00 0.00 0.00 0.00 23.12 19.24 3kvz s ALA 41 CO 0.61 0.12 1.64 1.15 0.00 0.00 0.00 175.76 179.28 3kvz h THR 42 N 2.58 0.40 0.00 0.00 2.02 -1.93 -0.82 112.91 115.16 3kvz h THR 42 Ca -0.47 -0.02 -0.05 0.00 0.77 0.00 0.00 66.41 66.64 3kvz h THR 42 Cb 1.19 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 3kvz h THR 42 CO 0.65 0.01 -0.24 1.23 0.37 0.00 0.00 175.52 177.54 3kvz h GLY 43 N 0.06 0.00 0.96 2.16 0.00 -1.98 0.13 103.07 104.40 3kvz h GLY 43 Ca 0.34 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.51 3kvz h GLY 43 CO -0.62 0.00 -0.52 0.74 0.00 0.00 0.00 176.54 176.14 3kvz h PHE 44 N 0.00 0.82 -0.82 5.60 0.04 -1.67 -2.39 116.94 118.51 3kvz h PHE 44 Ca -0.00 -0.34 -0.02 0.00 2.80 0.00 0.00 57.97 60.42 3kvz h PHE 44 Cb 0.68 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.65 3kvz h PHE 44 CO 0.00 1.12 0.45 1.98 -0.60 0.00 0.00 178.31 181.26 3kvz h MET 45 N 0.29 1.14 -0.88 1.51 4.05 -0.61 0.14 114.93 120.56 3kvz h MET 45 Ca -0.02 -0.13 0.02 0.00 -0.28 0.00 0.00 59.70 59.28 3kvz h MET 45 Cb 1.15 -0.23 -0.05 0.00 -0.80 0.00 0.00 31.60 31.67 3kvz h MET 45 CO 0.11 0.84 0.58 0.28 0.23 0.00 0.00 176.91 178.95 3kvz h VAL 46 N 1.15 1.20 -0.39 -5.77 2.07 -0.81 0.30 116.25 114.01 3kvz h VAL 46 Ca 0.29 -0.40 -0.11 0.00 0.82 0.00 0.00 66.70 67.30 3kvz h VAL 46 Cb 0.03 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.71 3kvz h VAL 46 CO -0.05 0.21 -0.19 1.23 0.02 0.00 0.00 177.57 178.80 3kvz h GLY 47 N 1.17 0.80 1.27 2.17 0.00 -0.68 -0.95 103.07 106.86 3kvz h GLY 47 Ca 0.33 -0.66 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 3kvz h GLY 47 CO -0.08 0.60 -0.04 -2.00 0.00 0.00 0.00 176.54 175.02 3kvz h LEU 48 N 0.66 0.85 0.38 3.11 5.85 -0.50 0.29 115.31 125.95 3kvz h LEU 48 Ca 0.10 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 3kvz h LEU 48 Cb 0.68 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.49 3kvz h LEU 48 CO 0.05 0.94 -0.18 0.24 -0.34 0.00 0.00 178.44 179.14 3kvz h MET 49 N 0.80 -0.49 -0.61 1.25 2.86 -0.65 -2.27 114.93 115.81 3kvz h MET 49 Ca 0.14 0.03 0.12 0.00 -2.06 0.00 0.00 59.70 57.94 3kvz h MET 49 Cb 0.53 0.11 -0.12 0.00 0.06 0.00 0.00 31.60 32.19 3kvz h MET 49 CO 0.03 -0.24 -0.23 0.93 1.06 0.00 0.00 176.91 178.45 3kvz h GLU 50 N -0.66 -0.07 -0.47 1.72 5.08 -1.10 -2.76 114.58 116.31 3kvz h GLU 50 Ca -0.05 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.41 3kvz h GLU 50 Cb 0.47 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.66 3kvz h GLU 50 CO 0.09 -0.05 -0.04 2.35 -1.00 0.00 0.00 179.01 180.35 3kvz h TRP 51 N -0.08 -0.11 -0.62 4.33 7.01 -0.30 0.15 115.95 126.33 3kvz h TRP 51 Ca 0.28 0.04 0.06 0.00 2.11 0.00 0.00 58.89 61.37 3kvz h TRP 51 Cb 0.51 0.12 -0.05 0.00 -2.10 0.00 0.00 29.16 27.64 3kvz h TRP 51 CO -0.57 -0.14 0.33 0.00 -2.79 0.00 0.00 178.44 175.27 3kvz h ALA 52 N 1.44 0.82 -0.10 2.65 0.00 -1.17 -0.18 119.26 122.72 3kvz h ALA 52 Ca 0.23 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 3kvz h ALA 52 Cb 0.35 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3kvz h ALA 52 CO -0.43 0.00 -0.56 0.00 0.00 0.00 0.00 179.25 178.27 3kvz h VAL 54 N 0.24 1.23 -0.02 0.00 2.07 -0.26 -2.31 116.25 117.20 3kvz h VAL 54 Ca 0.00 -0.71 -0.17 0.00 0.82 0.00 0.00 66.70 66.64 3kvz h VAL 54 Cb 1.05 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3kvz h VAL 54 CO 0.09 0.29 -0.76 0.03 0.02 0.00 0.00 177.57 177.24 3kvz h ARG 55 N 0.98 0.18 -0.15 1.57 3.08 -0.72 -2.51 114.38 116.81 3kvz h ARG 55 Ca 0.23 -0.17 -0.14 0.00 0.07 0.00 0.00 59.98 59.97 3kvz h ARG 55 Cb 0.17 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3kvz h ARG 55 CO -0.02 0.86 -0.51 0.00 -1.07 0.00 0.00 179.97 179.22 3kvz h ALA 56 N 1.09 0.83 0.00 0.04 0.00 -1.06 -3.18 119.26 116.99 3kvz h ALA 56 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3kvz h ALA 56 Cb 1.34 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3kvz h ALA 56 CO 0.11 0.68 -0.56 0.00 0.00 0.00 0.00 179.25 179.48 3kvz n MET 57 N -3.96 0.24 -0.23 0.00 0.00 -0.89 -4.33 117.12 107.94 3kvz n MET 57 Ca -0.02 0.08 0.02 0.00 0.00 0.00 0.00 57.70 57.77 3kvz n MET 57 Cb 0.57 -1.66 0.10 0.00 0.00 0.00 0.00 33.22 32.23 3kvz n MET 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3kvz h ALA 58 N 2.60 0.56 -0.01 3.17 0.00 -1.42 -0.27 119.26 123.89 3kvz h ALA 58 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3kvz h ALA 58 Cb 0.70 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3kvz h ALA 58 CO 0.00 -0.42 0.00 -0.35 0.00 0.00 0.00 179.25 178.48 3kvz n PRO 59 N -5.39 1.04 0.00 0.00 -0.05 -1.26 -2.33 135.00 127.01 3kvz n PRO 59 Ca 0.10 -0.07 0.06 0.00 -0.05 0.00 0.00 63.50 63.54 3kvz n PRO 59 Cb 0.38 -1.21 0.02 0.00 -0.05 0.00 0.00 33.50 32.65 3kvz n PRO 59 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 3kvz n TYR 60 N -0.64 0.00 -3.15 0.54 4.01 -0.13 -4.97 117.16 112.83 3kvz n TYR 60 Ca 0.10 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.48 3kvz n TYR 60 Cb 0.06 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.03 3kvz n TYR 60 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3kvz s LEU 61 N -1.43 4.33 0.31 7.72 1.43 -0.98 -5.01 118.68 125.04 3kvz s LEU 61 Ca 0.12 1.35 -0.15 0.00 -1.03 0.00 0.00 54.13 54.42 3kvz s LEU 61 Cb 0.10 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.68 3kvz s LEU 61 CO 0.24 0.03 0.73 -1.61 0.23 0.00 0.00 176.35 175.97 3kvz s GLU 62 N -2.03 4.03 0.11 1.70 0.41 -1.26 -4.99 118.70 116.66 3kvz s GLU 62 Ca 0.43 0.69 -0.35 0.00 -0.41 0.00 0.00 54.97 55.32 3kvz s GLU 62 Cb -0.16 -2.48 -0.17 0.00 -1.78 0.00 0.00 34.13 29.54 3kvz s GLU 62 CO 0.20 0.18 1.08 -0.35 -0.49 0.00 0.00 175.26 175.88 3kvz n PRO 63 N -0.25 0.65 -0.01 0.39 -0.04 -1.26 -1.11 135.00 133.37 3kvz n PRO 63 Ca 0.03 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 3kvz n PRO 63 Cb 0.53 -1.69 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 3kvz n PRO 63 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kvz n GLY 64 N 1.94 1.25 3.87 0.55 0.00 -1.26 -5.05 105.19 106.48 3kvz n GLY 64 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3kvz n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kvz s GLU 65 N -0.58 3.26 0.00 1.61 2.02 -0.26 -0.69 118.70 124.06 3kvz s GLU 65 Ca 0.00 -0.48 0.00 0.00 0.02 0.00 0.00 54.97 54.51 3kvz s GLU 65 Cb 0.00 -2.96 0.00 0.00 0.10 0.00 0.00 34.13 31.27 3kvz s GLU 65 CO 0.00 0.62 0.00 0.41 0.02 0.00 0.00 175.26 176.31 3kvz n GLY 66 N 0.58 4.41 3.18 -1.39 0.00 -0.55 -4.85 105.19 106.57 3kvz n GLY 66 Ca -0.08 -1.57 -0.10 0.00 0.00 0.00 0.00 46.02 44.26 3kvz n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kvz s SER 67 N -0.31 0.05 0.14 1.61 1.04 -1.26 -1.28 113.70 113.68 3kvz s SER 67 Ca 0.00 -0.40 0.11 0.00 0.48 0.00 0.00 55.95 56.14 3kvz s SER 67 Cb 0.00 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.37 3kvz s SER 67 CO 0.00 -0.56 -0.26 -0.76 0.98 0.00 0.00 173.24 172.63 3kvz s LEU 68 N -2.14 2.35 -0.07 2.42 1.43 -0.79 -4.94 118.68 116.94 3kvz s LEU 68 Ca -0.04 -0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 52.01 3kvz s LEU 68 Cb -0.01 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.96 3kvz s LEU 68 CO -0.04 0.17 1.01 -0.83 0.23 0.00 0.00 176.35 176.89 3kvz s GLY 69 N -2.14 2.49 0.00 -3.19 0.00 -1.26 -1.11 107.32 102.12 3kvz s GLY 69 Ca 0.15 0.43 0.11 0.00 0.00 0.00 0.00 44.72 45.41 3kvz s GLY 69 CO 0.07 1.87 0.57 -1.30 0.00 0.00 0.00 173.10 174.30 3kvz n THR 70 N 4.38 0.00 -3.63 0.90 -2.24 0.20 -4.93 114.28 108.95 3kvz n THR 70 Ca 0.08 -0.30 -0.12 0.00 -2.27 0.00 0.00 64.05 61.44 3kvz n THR 70 Cb 0.49 1.06 -0.07 0.00 -2.10 0.00 0.00 70.33 69.71 3kvz n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kvz s ALA 71 N -1.80 -1.87 -0.07 6.98 0.00 -1.12 -4.96 121.76 118.93 3kvz s ALA 71 Ca 0.07 1.95 -0.02 0.00 0.00 0.00 0.00 51.96 53.96 3kvz s ALA 71 Cb 0.09 -1.28 0.03 0.00 0.00 0.00 0.00 23.12 21.96 3kvz s ALA 71 CO 0.38 -0.29 0.03 -1.50 0.00 0.00 0.00 175.76 174.38 3kvz s ILE 72 N 0.29 0.17 -0.36 0.00 1.10 -1.26 -1.82 121.20 119.31 3kvz s ILE 72 Ca 0.01 0.21 0.00 0.00 -0.51 0.00 0.00 60.65 60.37 3kvz s ILE 72 Cb -0.05 -0.40 0.12 0.00 0.15 0.00 0.00 42.46 42.28 3kvz s ILE 72 CO -0.02 0.19 0.17 0.00 -2.11 0.00 0.00 174.94 173.17 3kvz s VAL 74 N 1.11 0.74 0.36 0.00 -7.23 -1.26 0.02 120.40 114.14 3kvz s VAL 74 Ca 0.14 -1.57 -0.05 0.00 -1.81 0.00 0.00 61.98 58.70 3kvz s VAL 74 Cb -0.21 -1.24 -0.05 0.00 0.56 0.00 0.00 36.38 35.45 3kvz s VAL 74 CO -0.12 -0.60 0.64 0.42 -0.31 0.00 0.00 175.10 175.13 3kvz s THR 75 N -2.49 4.97 -0.25 5.32 -4.23 -0.09 -4.92 115.64 113.94 3kvz s THR 75 Ca 0.03 0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 60.61 3kvz s THR 75 Cb -0.02 -3.79 0.08 0.00 1.34 0.00 0.00 72.50 70.11 3kvz s THR 75 CO -0.01 -0.52 0.07 -2.28 -0.54 0.00 0.00 174.62 171.34 3kvz s HIS 76 N -2.33 1.21 0.00 3.99 2.46 -1.26 -3.42 115.29 115.94 3kvz s HIS 76 Ca 0.45 -1.22 0.00 0.00 0.47 0.00 0.00 55.06 54.77 3kvz s HIS 76 Cb -0.10 -1.28 0.00 0.00 -0.13 0.00 0.00 32.58 31.06 3kvz s HIS 76 CO 0.35 -0.75 0.08 0.25 -2.47 0.00 0.00 174.74 172.19 3kvz n THR 77 N 4.99 0.00 -4.02 0.89 -2.24 0.94 -4.98 114.28 109.86 3kvz n THR 77 Ca -0.06 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 3kvz n THR 77 Cb 0.44 1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 69.56 3kvz n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kvz s ALA 78 N -0.81 0.32 0.13 6.98 0.00 -1.22 -4.99 121.76 122.17 3kvz s ALA 78 Ca 0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 51.96 51.36 3kvz s ALA 78 Cb 0.00 0.05 -0.06 0.00 0.00 0.00 0.00 23.12 23.11 3kvz s ALA 78 CO 0.00 -0.04 0.44 0.00 0.00 0.00 0.00 175.76 176.16 3kvz s ALA 79 N -1.00 3.69 -0.18 0.00 0.00 -1.26 -4.80 121.76 118.20 3kvz s ALA 79 Ca -0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.51 3kvz s ALA 79 Cb -0.07 -2.31 0.04 0.00 0.00 0.00 0.00 23.12 20.78 3kvz s ALA 79 CO -0.00 0.56 -0.07 0.99 0.00 0.00 0.00 175.76 177.24 3kvz s THR 80 N -1.54 1.31 0.54 0.00 2.01 -1.26 -4.99 115.64 111.70 3kvz s THR 80 Ca 0.38 -0.80 -0.17 0.00 0.31 0.00 0.00 61.69 61.41 3kvz s THR 80 Cb -0.13 -1.46 -0.06 0.00 0.01 0.00 0.00 72.50 70.85 3kvz s THR 80 CO 0.20 0.12 1.03 -2.16 -0.69 0.00 0.00 174.62 173.11 3kvz s PRO 81 N 1.54 3.66 0.73 4.92 0.04 -1.26 0.13 135.00 144.76 3kvz s PRO 81 Ca -0.00 1.17 -0.15 0.00 0.04 0.00 0.00 61.00 62.05 3kvz s PRO 81 Cb -0.16 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 32.34 3kvz s PRO 81 CO -0.08 -0.52 1.23 -2.14 0.04 0.00 0.00 177.00 175.53 3kvz s PRO 82 N -3.82 2.08 0.00 0.56 0.02 -1.26 -3.29 135.00 129.29 3kvz s PRO 82 Ca 0.63 1.85 0.00 0.00 0.02 0.00 0.00 61.00 63.50 3kvz s PRO 82 Cb -0.14 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.56 3kvz s PRO 82 CO 0.30 -1.90 0.00 0.41 -0.33 0.00 0.00 177.00 175.47 3kvz n GLY 83 N 0.57 2.90 3.79 0.52 0.00 0.19 -4.98 105.19 108.19 3kvz n GLY 83 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3kvz n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kvz s LEU 84 N 0.00 3.49 -0.22 0.99 1.43 -1.21 -4.73 118.68 118.43 3kvz s LEU 84 Ca 0.00 1.89 -0.13 0.00 -1.03 0.00 0.00 54.13 54.86 3kvz s LEU 84 Cb 0.00 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.63 3kvz s LEU 84 CO 0.00 -1.30 0.28 -0.89 0.23 0.00 0.00 176.35 174.66 3kvz s THR 85 N -2.37 5.28 -0.21 5.49 2.01 -1.26 -1.39 115.64 123.19 3kvz s THR 85 Ca 0.65 0.44 -0.14 0.00 0.31 0.00 0.00 61.69 62.96 3kvz s THR 85 Cb -0.18 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 3kvz s THR 85 CO 0.37 0.30 0.30 -0.69 -0.69 0.00 0.00 174.62 174.21 3kvz s VAL 86 N 1.20 5.27 -0.23 3.82 1.01 -0.36 -3.62 120.40 127.50 3kvz s VAL 86 Ca 0.13 0.49 -0.07 0.00 0.00 0.00 0.00 61.98 62.54 3kvz s VAL 86 Cb -0.14 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 3kvz s VAL 86 CO 0.06 0.30 0.06 -0.89 0.00 0.00 0.00 175.10 174.64 3kvz s THR 87 N 1.10 4.34 -0.18 3.92 2.01 0.10 -1.16 115.64 125.77 3kvz s THR 87 Ca 0.14 -0.17 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 3kvz s THR 87 Cb -0.14 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.33 3kvz s THR 87 CO 0.06 0.37 0.03 -0.69 -0.69 0.00 0.00 174.62 173.70 3kvz s VAL 88 N 1.31 4.40 -0.10 3.82 1.01 0.13 -1.62 120.40 129.37 3kvz s VAL 88 Ca 0.05 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.87 3kvz s VAL 88 Cb -0.15 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 3kvz s VAL 88 CO 0.03 0.46 -0.13 -0.89 0.00 0.00 0.00 175.10 174.57 3kvz s THR 89 N 0.53 3.12 -0.13 3.92 2.01 0.14 -0.55 115.64 124.68 3kvz s THR 89 Ca 0.01 -0.67 0.00 0.00 0.31 0.00 0.00 61.69 61.35 3kvz s THR 89 Cb -0.13 -2.27 0.02 0.00 0.01 0.00 0.00 72.50 70.12 3kvz s THR 89 CO 0.02 0.55 -0.12 0.00 -0.69 0.00 0.00 174.62 174.38 3kvz s ALA 90 N -0.12 1.67 -0.18 7.40 0.00 0.14 -0.90 121.76 129.77 3kvz s ALA 90 Ca -0.01 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.18 3kvz s ALA 90 Cb -0.14 -0.99 0.03 0.00 0.00 0.00 0.00 23.12 22.03 3kvz s ALA 90 CO 0.03 -0.36 -0.13 -2.00 0.00 0.00 0.00 175.76 173.30 3kvz s GLU 91 N 1.51 2.23 0.02 0.00 2.12 0.59 -1.21 118.70 123.96 3kvz s GLU 91 Ca 0.04 -0.73 -0.30 0.00 0.36 0.00 0.00 54.97 54.34 3kvz s GLU 91 Cb -0.13 -2.31 -0.08 0.00 0.26 0.00 0.00 34.13 31.87 3kvz s GLU 91 CO -0.09 -0.33 1.97 -1.17 -0.54 0.00 0.00 175.26 175.10 3kvz s LEU 92 N 1.42 4.36 -0.16 2.70 2.96 -0.07 -0.96 118.68 128.94 3kvz s LEU 92 Ca 0.02 2.60 -0.03 0.00 -0.22 0.00 0.00 54.13 56.50 3kvz s LEU 92 Cb -0.15 -3.53 -0.23 0.00 0.50 0.00 0.00 46.19 42.78 3kvz s LEU 92 CO -0.10 -1.11 0.20 0.54 -1.32 0.00 0.00 176.35 174.57 3kvz n ARG 93 N 7.61 0.72 -3.53 1.98 5.12 0.57 -0.24 116.66 128.90 3kvz n ARG 93 Ca 0.20 0.23 -0.11 0.00 -1.93 0.00 0.00 57.85 56.24 3kvz n ARG 93 Cb 0.41 -1.66 -0.02 0.00 -1.16 0.00 0.00 32.46 30.04 3kvz n ARG 93 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3kvz s SER 94 N -6.81 -0.48 -0.04 0.55 1.04 -1.10 -4.82 113.70 102.04 3kvz s SER 94 Ca -0.25 -0.15 0.10 0.00 0.48 0.00 0.00 55.95 56.13 3kvz s SER 94 Cb 0.07 0.62 0.18 0.00 0.10 0.00 0.00 66.02 67.00 3kvz s SER 94 CO 0.73 -1.05 1.08 0.52 0.98 0.00 0.00 173.24 175.50 3kvz n VAL 95 N -0.40 0.52 -1.49 5.02 0.31 -1.26 -1.56 118.33 119.47 3kvz n VAL 95 Ca -0.13 -0.90 -0.16 0.00 -0.01 0.00 0.00 64.34 63.14 3kvz n VAL 95 Cb 0.63 0.42 -0.14 0.00 -0.91 0.00 0.00 33.84 33.84 3kvz n VAL 95 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3kvz n GLU 96 N -0.24 0.23 0.00 5.55 0.28 -1.18 -4.52 120.64 120.77 3kvz n GLU 96 Ca 0.06 -0.46 0.00 0.00 -0.16 0.00 0.00 57.16 56.60 3kvz n GLU 96 Cb 0.79 -2.29 0.00 0.00 1.43 0.00 0.00 31.44 31.37 3kvz n GLU 96 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3kvz n GLY 97 N 6.00 1.41 0.67 -1.84 0.00 -1.26 -3.27 105.19 106.91 3kvz n GLY 97 Ca 0.53 -0.83 0.10 0.00 0.00 0.00 0.00 46.02 45.82 3kvz n GLY 97 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kvz n ARG 98 N 4.08 1.88 -4.07 1.61 0.00 -1.26 -4.89 116.66 114.02 3kvz n ARG 98 Ca 0.00 -1.33 -0.34 0.00 -0.00 0.00 0.00 57.85 56.18 3kvz n ARG 98 Cb 0.00 -1.41 -0.15 0.00 0.00 0.00 0.00 32.46 30.90 3kvz n ARG 98 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 3kvz s ARG 99 N -1.72 3.22 0.10 -0.14 1.04 -1.20 -0.10 118.95 120.15 3kvz s ARG 99 Ca 0.33 -0.71 0.05 0.00 -1.04 0.00 0.00 55.73 54.36 3kvz s ARG 99 Cb 0.18 -2.80 -0.04 0.00 -2.04 0.00 0.00 34.95 30.25 3kvz s ARG 99 CO 0.26 -0.17 -0.01 -0.51 -0.04 0.00 0.00 175.30 174.84 3kvz s LEU 100 N 1.31 3.42 -0.10 -1.89 1.02 -0.42 -3.09 118.68 118.93 3kvz s LEU 100 Ca 0.04 -0.21 -0.00 0.00 0.02 0.00 0.00 54.13 53.98 3kvz s LEU 100 Cb -0.14 -2.15 0.02 0.00 0.02 0.00 0.00 46.19 43.94 3kvz s LEU 100 CO -0.06 0.17 -0.07 -0.55 0.02 0.00 0.00 176.35 175.85 3kvz s SER 101 N -2.37 1.98 0.01 2.29 0.15 -0.60 -1.81 113.70 113.35 3kvz s SER 101 Ca 0.26 -0.26 0.01 0.00 0.70 0.00 0.00 55.95 56.66 3kvz s SER 101 Cb -0.11 -0.76 -0.04 0.00 -1.71 0.00 0.00 66.02 63.40 3kvz s SER 101 CO 0.18 -0.11 0.03 0.26 1.20 0.00 0.00 173.24 174.80 3kvz s TRP 102 N 1.57 3.13 -0.24 3.44 0.52 0.14 -0.31 118.94 127.19 3kvz s TRP 102 Ca 0.02 0.11 -0.16 0.00 0.02 0.00 0.00 56.10 56.09 3kvz s TRP 102 Cb -0.13 -1.68 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 3kvz s TRP 102 CO -0.06 0.49 0.40 0.50 0.02 0.00 0.00 176.95 178.30 3kvz s ARG 103 N -1.71 4.09 -0.09 4.98 3.52 -0.13 -0.79 118.95 128.82 3kvz s ARG 103 Ca 0.21 0.14 0.02 0.00 -0.13 0.00 0.00 55.73 55.97 3kvz s ARG 103 Cb -0.12 -3.61 -0.02 0.00 -1.56 0.00 0.00 34.95 29.64 3kvz s ARG 103 CO 0.12 -0.19 -0.13 0.14 -0.81 0.00 0.00 175.30 174.44 3kvz s VAL 104 N 1.80 3.16 0.18 7.11 -7.23 -0.79 -0.30 120.40 124.34 3kvz s VAL 104 Ca 0.17 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 3kvz s VAL 104 Cb -0.15 -2.29 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 3kvz s VAL 104 CO 0.09 0.56 0.06 -0.94 -0.31 0.00 0.00 175.10 174.56 3kvz s SER 105 N -0.28 0.80 -0.13 4.85 1.04 -0.08 -1.35 113.70 118.55 3kvz s SER 105 Ca 0.02 -1.26 -0.17 0.00 0.48 0.00 0.00 55.95 55.02 3kvz s SER 105 Cb -0.13 0.22 0.04 0.00 0.10 0.00 0.00 66.02 66.25 3kvz s SER 105 CO 0.03 -0.69 0.45 0.00 0.98 0.00 0.00 173.24 174.01 3kvz s ALA 106 N -3.86 -1.13 0.10 5.32 0.00 -0.62 -0.68 121.76 120.88 3kvz s ALA 106 Ca 0.29 1.09 -0.08 0.00 0.00 0.00 0.00 51.96 53.26 3kvz s ALA 106 Cb 0.07 -0.49 -0.00 0.00 0.00 0.00 0.00 23.12 22.69 3kvz s ALA 106 CO 0.07 -0.24 0.19 -3.38 0.00 0.00 0.00 175.76 172.39 3kvz s HIS 107 N -0.26 0.21 -0.25 0.00 -3.43 -0.64 0.11 115.29 111.04 3kvz s HIS 107 Ca -0.04 -0.64 0.12 0.00 -0.80 0.00 0.00 55.06 53.70 3kvz s HIS 107 Cb -0.03 -0.08 0.51 0.00 -1.43 0.00 0.00 32.58 31.55 3kvz s HIS 107 CO 0.02 -0.56 1.45 -0.40 -2.00 0.00 0.00 174.74 173.25 3kvz n ASP 108 N -0.08 3.02 0.00 7.38 5.68 -0.41 0.00 116.55 132.15 3kvz n ASP 108 Ca -0.14 -3.47 0.00 0.00 -0.50 0.00 0.00 54.79 50.68 3kvz n ASP 108 Cb 0.62 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 3kvz n ASP 108 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kvz n GLY 109 N -0.92 2.89 0.44 6.12 0.00 -1.24 -4.17 105.19 108.32 3kvz n GLY 109 Ca 0.29 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.18 3kvz n GLY 109 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kvz n VAL 110 N -1.97 1.17 -4.30 1.61 0.31 -1.26 -5.07 118.33 108.82 3kvz n VAL 110 Ca 0.00 -0.03 -0.24 0.00 -0.01 0.00 0.00 64.34 64.06 3kvz n VAL 110 Cb 0.00 -1.89 -0.13 0.00 -0.91 0.00 0.00 33.84 30.91 3kvz n VAL 110 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3kvz s ASP 111 N -6.31 2.54 0.04 4.52 1.01 -1.26 -5.11 116.67 112.10 3kvz s ASP 111 Ca -0.22 -0.68 -0.31 0.00 0.71 0.00 0.00 52.55 52.05 3kvz s ASP 111 Cb 0.06 -0.14 -0.10 0.00 1.01 0.00 0.00 42.92 43.76 3kvz s ASP 111 CO 0.30 0.06 1.95 -0.62 0.21 0.00 0.00 175.17 177.06 3kvz n GLU 112 N 1.11 2.82 0.00 8.23 -0.58 -1.26 -1.29 120.64 129.67 3kvz n GLU 112 Ca -0.19 1.03 0.10 0.00 -0.42 0.00 0.00 57.16 57.68 3kvz n GLU 112 Cb 0.54 -2.97 -0.08 0.00 -0.57 0.00 0.00 31.44 28.35 3kvz n GLU 112 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 3kvz n ILE 113 N 5.37 0.01 0.00 -3.67 -5.35 0.12 -4.15 119.36 111.68 3kvz n ILE 113 Ca 0.20 -0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.63 3kvz n ILE 113 Cb 0.39 0.82 0.00 0.00 -1.74 0.00 0.00 39.64 39.12 3kvz n ILE 113 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3kvz n GLY 114 N 1.48 1.99 3.63 3.28 0.00 -1.15 -0.04 105.19 114.37 3kvz n GLY 114 Ca 0.03 -1.06 -0.00 0.00 0.00 0.00 0.00 46.02 44.99 3kvz n GLY 114 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kvz s SER 115 N 0.00 -0.09 0.00 1.61 1.04 -1.22 -1.59 113.70 113.45 3kvz s SER 115 Ca 0.00 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.28 3kvz s SER 115 Cb 0.00 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.33 3kvz s SER 115 CO 0.00 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.46 3kvz n GLY 116 N -0.43 0.03 3.12 7.32 0.00 -0.46 -0.92 105.19 113.86 3kvz n GLY 116 Ca -0.07 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 3kvz n GLY 116 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kvz s THR 117 N -4.00 0.53 -0.02 2.61 -4.23 0.10 -1.88 115.64 108.74 3kvz s THR 117 Ca 0.00 -1.72 0.01 0.00 -1.18 0.00 0.00 61.69 58.80 3kvz s THR 117 Cb 0.00 -1.40 0.02 0.00 1.34 0.00 0.00 72.50 72.46 3kvz s THR 117 CO 0.00 -0.80 -0.01 -2.28 -0.54 0.00 0.00 174.62 170.99 3kvz s HIS 118 N -3.22 0.32 0.02 3.99 5.04 0.03 -1.51 115.29 119.96 3kvz s HIS 118 Ca 0.06 -0.02 0.07 0.00 -1.54 0.00 0.00 55.06 53.63 3kvz s HIS 118 Cb 0.03 -0.36 -0.03 0.00 0.04 0.00 0.00 32.58 32.25 3kvz s HIS 118 CO -0.05 -0.10 -0.19 -1.21 -2.34 0.00 0.00 174.74 170.85 3kvz s GLU 119 N 0.76 2.12 0.07 2.88 2.02 -0.76 0.27 118.70 126.06 3kvz s GLU 119 Ca -0.08 -0.94 0.03 0.00 0.02 0.00 0.00 54.97 54.00 3kvz s GLU 119 Cb -0.11 -2.18 -0.03 0.00 0.10 0.00 0.00 34.13 31.91 3kvz s GLU 119 CO -0.01 0.55 -0.09 1.03 0.02 0.00 0.00 175.26 176.76 3kvz s ARG 120 N -1.22 0.69 -0.10 1.61 0.52 -0.75 -0.62 118.95 119.08 3kvz s ARG 120 Ca 0.13 -0.98 0.04 0.00 -0.52 0.00 0.00 55.73 54.40 3kvz s ARG 120 Cb -0.10 -0.39 0.00 0.00 0.52 0.00 0.00 34.95 34.98 3kvz s ARG 120 CO 0.03 0.06 -0.23 0.00 0.02 0.00 0.00 175.30 175.18 3kvz s ALA 121 N -2.05 2.11 0.04 2.13 0.00 -0.26 -1.30 121.76 122.43 3kvz s ALA 121 Ca -0.01 -0.94 -0.31 0.00 0.00 0.00 0.00 51.96 50.70 3kvz s ALA 121 Cb -0.05 -0.80 -0.06 0.00 0.00 0.00 0.00 23.12 22.20 3kvz s ALA 121 CO -0.00 0.26 1.36 0.08 0.00 0.00 0.00 175.76 177.45 3kvz s VAL 122 N 0.39 3.66 0.32 0.00 1.01 0.85 -1.89 120.40 124.74 3kvz s VAL 122 Ca -0.18 1.12 0.10 0.00 0.00 0.00 0.00 61.98 63.02 3kvz s VAL 122 Cb -0.18 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 3kvz s VAL 122 CO 0.08 0.04 -0.06 0.27 0.00 0.00 0.00 175.10 175.43 3kvz s ILE 123 N 1.80 2.65 -0.35 2.22 -4.36 -0.41 -4.91 121.20 117.83 3kvz s ILE 123 Ca 0.63 -2.10 -0.19 0.00 -0.26 0.00 0.00 60.65 58.73 3kvz s ILE 123 Cb -0.32 -2.67 -0.00 0.00 1.25 0.00 0.00 42.46 40.72 3kvz s ILE 123 CO 0.28 -0.27 0.54 -2.28 0.24 0.00 0.00 174.94 173.45 3kvz s HIS 124 N -2.50 3.17 0.12 1.37 2.46 -1.26 -1.48 115.29 117.16 3kvz s HIS 124 Ca 0.33 0.20 -0.17 0.00 0.47 0.00 0.00 55.06 55.89 3kvz s HIS 124 Cb -0.02 -2.98 -0.03 0.00 -0.13 0.00 0.00 32.58 29.42 3kvz s HIS 124 CO 0.18 -0.57 1.67 -0.07 -2.47 0.00 0.00 174.74 173.48 3kvz h LEU 125 N 9.17 0.46 -0.84 8.88 3.38 -1.24 0.02 115.31 135.14 3kvz h LEU 125 Ca -0.27 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.42 3kvz h LEU 125 Cb 1.12 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 3kvz h LEU 125 CO 0.79 0.50 -0.42 -0.33 0.09 0.00 0.00 178.44 179.08 3kvz h GLU 126 N 0.40 0.35 0.03 1.13 3.07 -1.94 0.10 114.58 117.72 3kvz h GLU 126 Ca 0.11 -0.17 -0.24 0.00 -0.50 0.00 0.00 59.36 58.57 3kvz h GLU 126 Cb 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 3kvz h GLU 126 CO -0.01 0.71 -1.01 1.57 -1.40 0.00 0.00 179.01 178.87 3kvz h LYS 127 N 0.29 0.36 -0.51 2.33 2.10 -1.87 -2.72 116.57 116.56 3kvz h LYS 127 Ca 0.02 -0.44 -0.00 0.00 -2.00 0.00 0.00 60.65 58.24 3kvz h LYS 127 Cb 0.86 0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 32.30 3kvz h LYS 127 CO 0.07 1.12 0.30 0.35 -2.00 0.00 0.00 179.45 179.29 3kvz h PHE 128 N 0.19 0.67 -0.98 0.07 3.57 -0.79 -2.38 116.94 117.29 3kvz h PHE 128 Ca -0.09 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.45 3kvz h PHE 128 Cb 1.66 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 40.12 3kvz h PHE 128 CO 0.06 0.47 0.64 -0.91 -2.23 0.00 0.00 178.31 176.34 3kvz h ASN 129 N 0.68 1.05 -0.72 0.41 2.35 -0.84 -1.56 115.58 116.95 3kvz h ASN 129 Ca 0.18 -0.00 0.10 0.00 -0.55 0.00 0.00 56.30 56.02 3kvz h ASN 129 Cb -0.00 -0.23 -0.07 0.00 0.05 0.00 0.00 38.32 38.06 3kvz h ASN 129 CO -0.03 0.70 0.36 0.00 -1.65 0.00 0.00 177.43 176.81 3kvz h ALA 130 N 1.41 1.00 -0.36 -0.83 0.00 -1.34 -1.89 119.26 117.25 3kvz h ALA 130 Ca 0.40 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.26 3kvz h ALA 130 Cb 0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3kvz h ALA 130 CO -0.14 -0.05 -0.20 0.87 0.00 0.00 0.00 179.25 179.73 3kvz h LYS 131 N 0.60 0.68 -0.10 0.00 1.57 -0.78 -2.89 116.57 115.66 3kvz h LYS 131 Ca 0.36 -0.25 -0.14 0.00 -1.87 0.00 0.00 60.65 58.75 3kvz h LYS 131 Cb 0.39 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3kvz h LYS 131 CO -0.28 0.83 -0.55 -0.39 -0.57 0.00 0.00 179.45 178.50 3kvz h VAL 132 N 0.60 1.36 -0.42 0.50 -1.51 -1.27 -3.06 116.25 112.45 3kvz h VAL 132 Ca 0.09 -1.84 -0.02 0.00 -1.23 0.00 0.00 66.70 63.71 3kvz h VAL 132 Cb 0.67 1.88 -0.02 0.00 -2.13 0.00 0.00 31.29 31.69 3kvz h VAL 132 CO 0.05 0.55 0.18 0.03 -1.23 0.00 0.00 177.57 177.15 3kvz h ARG 133 N 0.23 0.59 -0.57 5.19 3.08 -1.15 -0.66 114.38 121.09 3kvz h ARG 133 Ca 0.00 -0.07 0.08 0.00 0.07 0.00 0.00 59.98 60.06 3kvz h ARG 133 Cb 1.03 -0.11 -0.10 0.00 0.08 0.00 0.00 29.97 30.87 3kvz h ARG 133 CO 0.09 0.48 -0.47 1.96 -1.07 0.00 0.00 179.97 180.96 3kvz h GLN 134 N 0.59 -0.24 0.00 0.04 4.20 -1.40 -2.81 115.11 115.49 3kvz h GLN 134 Ca 0.15 0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 3kvz h GLN 134 Cb 0.10 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3kvz h GLN 134 CO -0.02 -0.16 -0.39 0.87 -0.67 0.00 0.00 178.83 178.47 3kvz h LYS 135 N -0.25 0.00 -5.98 1.46 1.57 -1.26 -3.45 116.57 108.66 3kvz h LYS 135 Ca 0.16 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.42 3kvz h LYS 135 Cb 0.56 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 3kvz h LYS 135 CO -0.69 0.39 1.39 0.99 -0.57 0.00 0.00 179.45 180.96 3kvz s THR 136 N -3.96 3.30 -2.00 -0.16 2.01 -0.78 -5.15 115.64 108.91 3kvz s THR 136 Ca -0.02 0.23 0.08 0.00 0.31 0.00 0.00 61.69 62.29 3kvz s THR 136 Cb 0.13 -3.64 0.22 0.00 0.01 0.00 0.00 72.50 69.22 3kvz s THR 136 CO 0.71 -0.56 0.91 -0.81 -0.69 0.00 0.00 174.62 174.17