#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvm n GLU 2 N 0.00 -1.64 0.00 0.03 1.02 -1.26 -4.92 120.64 113.87 2kvm n GLU 2 Ca 0.00 1.59 0.00 0.00 -0.02 0.00 0.00 57.16 58.73 2kvm n GLU 2 Cb 0.00 -5.25 0.00 0.00 -0.02 0.00 0.00 31.44 26.17 2kvm n GLU 2 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2kvm n LEU 3 N -1.41 0.00 0.00 -4.62 7.94 -1.26 -4.98 117.00 112.67 2kvm n LEU 3 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2kvm n LEU 3 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 2kvm n LEU 3 CO 0.53 0.04 -0.14 -1.20 -1.11 0.00 0.00 177.39 175.51 2kvm n SER 4 N 0.00 0.78 0.09 1.96 7.64 -1.26 -4.77 113.62 118.06 2kvm n SER 4 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.91 2kvm n SER 4 Cb 0.04 0.00 0.40 0.00 -1.01 0.00 0.00 64.21 63.64 2kvm n SER 4 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kvm h ALA 5 N 0.00 1.55 0.03 -0.43 0.00 -1.99 -3.24 119.26 115.19 2kvm h ALA 5 Ca 0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2kvm h ALA 5 Cb 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2kvm h ALA 5 CO 0.00 0.33 -0.02 0.82 0.00 0.00 0.00 179.25 180.38 2kvm h ILE 6 N 0.31 0.00 -5.05 0.00 2.04 -1.94 -3.49 117.51 109.39 2kvm h ILE 6 Ca 0.07 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.92 2kvm h ILE 6 Cb 0.27 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 2kvm h ILE 6 CO 0.01 0.00 -0.13 0.61 0.00 0.00 0.00 178.15 178.64 2kvm n GLY 7 N -0.32 -1.16 5.67 5.37 0.00 -1.23 -4.82 105.19 108.70 2kvm n GLY 7 Ca -0.01 0.60 0.04 0.00 0.00 0.00 0.00 46.02 46.66 2kvm n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2kvm n GLU 8 N -1.26 -0.58 0.00 1.61 1.02 -1.26 -4.98 120.64 115.19 2kvm n GLU 8 Ca 0.03 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 2kvm n GLU 8 Cb 0.47 -0.71 0.00 0.00 -0.02 0.00 0.00 31.44 31.18 2kvm n GLU 8 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2kvm n GLN 9 N -2.16 0.00 -1.35 3.49 10.64 -1.26 -5.16 117.38 121.58 2kvm n GLN 9 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2kvm n GLN 9 Cb 0.13 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.51 2kvm n GLN 9 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 2kvm n VAL 10 N -0.78 -3.72 0.00 -0.39 0.31 -1.26 -5.10 118.33 107.39 2kvm n VAL 10 Ca 0.00 1.70 0.00 0.00 -0.01 0.00 0.00 64.34 66.03 2kvm n VAL 10 Cb 0.00 -2.50 0.00 0.00 -0.91 0.00 0.00 33.84 30.43 2kvm n VAL 10 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2kvm n PHE 11 N -1.58 0.00 -3.15 3.52 3.72 -1.26 -5.14 117.46 113.57 2kvm n PHE 11 Ca 0.00 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.45 2kvm n PHE 11 Cb 0.18 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.72 2kvm n PHE 11 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2kvm s ALA 12 N -2.00 -3.21 -0.09 4.37 0.00 -1.26 -5.14 121.76 114.43 2kvm s ALA 12 Ca 0.00 1.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.90 2kvm s ALA 12 Cb 0.00 -2.67 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 2kvm s ALA 12 CO 0.00 -1.93 1.05 0.08 0.00 0.00 0.00 175.76 174.96 2kvm s VAL 13 N 2.89 4.67 0.15 0.00 1.01 -1.26 -1.94 120.40 125.92 2kvm s VAL 13 Ca 0.18 1.94 -0.15 0.00 0.00 0.00 0.00 61.98 63.96 2kvm s VAL 13 Cb -0.06 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.09 2kvm s VAL 13 CO -0.24 0.00 1.70 -0.08 0.00 0.00 0.00 175.10 176.49 2kvm h GLU 14 N 7.17 0.68 0.00 2.72 4.22 -0.58 -3.44 114.58 125.35 2kvm h GLU 14 Ca -0.32 -0.12 0.00 0.00 0.08 0.00 0.00 59.36 59.00 2kvm h GLU 14 Cb 1.15 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2kvm h GLU 14 CO 0.86 0.61 0.00 0.45 -2.18 0.00 0.00 179.01 178.75 2kvm n SER 15 N -4.60 0.00 -4.70 1.04 2.88 -1.07 -4.97 113.62 102.20 2kvm n SER 15 Ca 0.01 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.23 2kvm n SER 15 Cb 0.14 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 63.74 2kvm n SER 15 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2kvm s ILE 16 N -2.00 2.25 0.00 2.46 1.01 -1.26 -0.66 121.20 123.00 2kvm s ILE 16 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.75 2kvm s ILE 16 Cb 0.00 -2.35 0.00 0.00 0.01 0.00 0.00 42.46 40.12 2kvm s ILE 16 CO 0.00 -0.10 0.00 -1.14 0.00 0.00 0.00 174.94 173.70 2kvm n ARG 17 N -3.67 0.00 -4.37 2.79 0.63 0.35 -4.69 116.66 107.71 2kvm n ARG 17 Ca 0.12 0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.84 2kvm n ARG 17 Cb 0.51 -0.59 -0.08 0.00 0.45 0.00 0.00 32.46 32.75 2kvm n ARG 17 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2kvm s LYS 18 N -2.00 1.75 -0.21 -0.14 1.02 -1.08 -4.90 119.74 114.17 2kvm s LYS 18 Ca 0.00 -2.03 -0.04 0.00 0.02 0.00 0.00 55.97 53.92 2kvm s LYS 18 Cb 0.00 -0.11 0.11 0.00 -0.52 0.00 0.00 37.83 37.31 2kvm s LYS 18 CO 0.00 -0.53 0.37 0.21 -0.92 0.00 0.00 175.35 174.48 2kvm s LYS 19 N -3.67 0.31 -0.05 1.68 2.20 -1.26 -1.10 119.74 117.85 2kvm s LYS 19 Ca 0.34 0.72 0.06 0.00 -0.36 0.00 0.00 55.97 56.72 2kvm s LYS 19 Cb 0.03 -0.19 -0.02 0.00 -1.51 0.00 0.00 37.83 36.15 2kvm s LYS 19 CO 0.20 -0.47 -0.24 -0.98 -0.36 0.00 0.00 175.35 173.51 2kvm s ARG 20 N 2.54 2.44 0.08 4.03 1.70 -0.77 -4.92 118.95 124.05 2kvm s ARG 20 Ca 0.06 -0.88 0.09 0.00 -0.47 0.00 0.00 55.73 54.53 2kvm s ARG 20 Cb -0.14 -2.17 -0.03 0.00 -0.57 0.00 0.00 34.95 32.04 2kvm s ARG 20 CO -0.14 0.46 -0.24 0.08 -1.08 0.00 0.00 175.30 174.38 2kvm s VAL 21 N -0.35 1.96 -0.29 4.99 1.01 -1.25 -0.23 120.40 126.25 2kvm s VAL 21 Ca 0.02 -1.46 -0.02 0.00 0.00 0.00 0.00 61.98 60.52 2kvm s VAL 21 Cb -0.12 -1.72 0.10 0.00 0.00 0.00 0.00 36.38 34.63 2kvm s VAL 21 CO 0.02 0.18 0.10 -0.60 0.00 0.00 0.00 175.10 174.80 2kvm s ARG 22 N -1.55 0.54 0.00 2.72 3.52 0.01 -4.77 118.95 119.41 2kvm s ARG 22 Ca 0.10 -0.83 0.00 0.00 -0.13 0.00 0.00 55.73 54.87 2kvm s ARG 22 Cb -0.10 -1.73 0.00 0.00 -1.56 0.00 0.00 34.95 31.56 2kvm s ARG 22 CO 0.03 -0.96 0.00 1.63 -0.81 0.00 0.00 175.30 175.19 2kvm n LYS 23 N 5.00 -0.45 0.00 5.12 5.02 -1.26 -0.71 118.16 130.88 2kvm n LYS 23 Ca -0.04 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2kvm n LYS 23 Cb 0.43 -4.38 0.00 0.00 -0.02 0.00 0.00 35.03 31.06 2kvm n LYS 23 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kvm n GLY 24 N -1.36 1.22 3.57 0.72 0.00 -1.26 -5.08 105.19 102.99 2kvm n GLY 24 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2kvm n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kvm s LYS 25 N 0.00 2.97 0.19 1.61 1.02 0.11 -4.97 119.74 120.66 2kvm s LYS 25 Ca 0.00 0.69 -0.12 0.00 0.02 0.00 0.00 55.97 56.56 2kvm s LYS 25 Cb 0.00 -4.27 -0.07 0.00 -0.52 0.00 0.00 37.83 32.97 2kvm s LYS 25 CO 0.00 -2.32 0.55 0.08 -0.92 0.00 0.00 175.35 172.73 2kvm s VAL 26 N 7.69 4.90 0.08 3.17 1.01 -1.26 -0.81 120.40 135.18 2kvm s VAL 26 Ca 0.64 0.63 -0.03 0.00 0.00 0.00 0.00 61.98 63.22 2kvm s VAL 26 Cb -0.14 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 2kvm s VAL 26 CO 0.24 0.08 0.05 -1.61 0.00 0.00 0.00 175.10 173.86 2kvm s GLU 27 N -2.40 0.74 -0.15 2.72 2.02 0.69 -1.52 118.70 120.79 2kvm s GLU 27 Ca 0.43 -1.18 -0.02 0.00 0.02 0.00 0.00 54.97 54.22 2kvm s GLU 27 Cb -0.13 0.26 0.05 0.00 0.10 0.00 0.00 34.13 34.40 2kvm s GLU 27 CO 0.20 -0.18 -0.01 0.71 0.02 0.00 0.00 175.26 176.00 2kvm s TYR 28 N -3.92 1.21 -0.98 1.61 2.02 -0.51 -1.85 117.35 114.93 2kvm s TYR 28 Ca 0.09 -0.79 -0.24 0.00 -0.37 0.00 0.00 57.07 55.76 2kvm s TYR 28 Cb 0.07 -1.09 -0.09 0.00 -0.40 0.00 0.00 41.96 40.45 2kvm s TYR 28 CO -0.08 -0.55 2.03 -1.17 -1.57 0.00 0.00 175.55 174.21 2kvm s LEU 29 N 1.80 3.02 0.25 -1.29 1.98 -0.26 -2.54 118.68 121.64 2kvm s LEU 29 Ca 0.01 -0.86 -0.30 0.00 -2.89 0.00 0.00 54.13 50.09 2kvm s LEU 29 Cb -0.15 -2.57 -0.09 0.00 0.66 0.00 0.00 46.19 44.04 2kvm s LEU 29 CO -0.07 -3.18 1.11 0.68 -1.89 0.00 0.00 176.35 173.00 2kvm s VAL 30 N 11.64 3.55 -0.53 1.68 -7.23 0.48 0.13 120.40 130.12 2kvm s VAL 30 Ca 0.74 1.48 -0.17 0.00 -1.81 0.00 0.00 61.98 62.23 2kvm s VAL 30 Cb -0.06 -3.94 0.11 0.00 0.56 0.00 0.00 36.38 33.05 2kvm s VAL 30 CO 0.06 0.32 0.52 -0.54 -0.31 0.00 0.00 175.10 175.15 2kvm s LYS 31 N -1.13 3.00 0.15 4.82 1.02 0.16 -2.59 119.74 125.18 2kvm s LYS 31 Ca 0.46 -1.52 -0.31 0.00 0.02 0.00 0.00 55.97 54.61 2kvm s LYS 31 Cb -0.32 -4.25 -0.09 0.00 -0.52 0.00 0.00 37.83 32.65 2kvm s LYS 31 CO 0.40 -1.29 1.51 -1.58 -0.92 0.00 0.00 175.35 173.46 2kvm s TRP 32 N 1.84 3.13 0.07 3.18 0.52 -1.26 0.12 118.94 126.53 2kvm s TRP 32 Ca 0.05 0.74 -0.36 0.00 0.02 0.00 0.00 56.10 56.56 2kvm s TRP 32 Cb -0.27 -3.84 -0.19 0.00 -1.15 0.00 0.00 33.47 28.02 2kvm s TRP 32 CO 0.05 -3.06 1.54 -0.22 0.02 0.00 0.00 176.95 175.28 2kvm h LYS 33 N 6.78 -1.16 -0.77 4.98 3.64 -1.67 -2.49 116.57 125.88 2kvm h LYS 33 Ca -0.42 0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2kvm h LYS 33 Cb 1.21 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 2kvm h LYS 33 CO 0.90 -0.77 0.00 0.41 -2.27 0.00 0.00 179.45 177.72 2kvm n GLY 34 N -1.62 1.13 3.11 5.01 0.00 -1.26 -4.74 105.19 106.82 2kvm n GLY 34 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 2kvm n GLY 34 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2kvm s TRP 35 N -0.93 0.07 0.70 1.61 0.52 -0.94 -5.16 118.94 114.82 2kvm s TRP 35 Ca 0.00 -0.21 -0.13 0.00 0.02 0.00 0.00 56.10 55.78 2kvm s TRP 35 Cb 0.00 -0.07 0.02 0.00 -1.15 0.00 0.00 33.47 32.27 2kvm s TRP 35 CO 0.00 -0.30 1.10 -2.14 0.02 0.00 0.00 176.95 175.63 2kvm s PRO 36 N -1.61 2.64 0.47 4.98 0.02 -1.26 -4.47 135.00 135.76 2kvm s PRO 36 Ca -0.13 1.29 0.29 0.00 0.02 0.00 0.00 61.00 62.46 2kvm s PRO 36 Cb -0.07 -1.94 1.57 0.00 0.02 0.00 0.00 34.50 34.08 2kvm s PRO 36 CO 0.00 -1.36 1.87 -1.00 -0.33 0.00 0.00 177.00 176.18 2kvm h PRO 37 N -0.38 0.00 0.00 5.54 0.13 -1.98 0.13 132.00 135.44 2kvm h PRO 37 Ca -0.46 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 2kvm h PRO 37 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2kvm h PRO 37 CO 0.53 0.00 -0.31 0.87 -0.23 0.00 0.00 178.00 178.86 2kvm h LYS 38 N 0.00 0.00 -0.73 0.86 6.56 -2.00 -2.67 116.57 118.59 2kvm h LYS 38 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2kvm h LYS 38 Cb 0.14 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.80 2kvm h LYS 38 CO 0.00 0.31 0.00 0.66 -2.06 0.00 0.00 179.45 178.36 2kvm n TYR 39 N -3.63 1.11 -1.03 -1.35 4.02 0.03 -4.99 117.16 111.32 2kvm n TYR 39 Ca -0.01 -0.52 -0.35 0.00 -0.01 0.00 0.00 57.90 57.01 2kvm n TYR 39 Cb 0.43 -0.05 0.09 0.00 -0.02 0.00 0.00 39.34 39.79 2kvm n TYR 39 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2kvm n SER 40 N 1.57 -1.86 -4.19 7.72 7.64 -1.01 -4.90 113.62 118.60 2kvm n SER 40 Ca 0.25 0.45 -0.11 0.00 1.01 0.00 0.00 58.87 60.47 2kvm n SER 40 Cb 0.69 -1.19 -0.10 0.00 -1.01 0.00 0.00 64.21 62.60 2kvm n SER 40 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2kvm s THR 41 N -2.14 0.50 -0.46 0.44 -4.23 -1.07 -4.96 115.64 103.71 2kvm s THR 41 Ca 0.60 -1.93 -0.12 0.00 -1.18 0.00 0.00 61.69 59.05 2kvm s THR 41 Cb -0.28 -1.93 0.09 0.00 1.34 0.00 0.00 72.50 71.72 2kvm s THR 41 CO 0.64 -0.63 0.35 0.26 -0.54 0.00 0.00 174.62 174.70 2kvm s TRP 42 N -3.77 3.30 -0.20 3.99 0.52 -1.26 -0.38 118.94 121.14 2kvm s TRP 42 Ca 0.19 -1.31 -0.08 0.00 0.02 0.00 0.00 56.10 54.92 2kvm s TRP 42 Cb 0.06 -3.19 -0.04 0.00 -1.15 0.00 0.00 33.47 29.15 2kvm s TRP 42 CO -0.00 -0.86 0.07 -1.21 0.02 0.00 0.00 176.95 174.97 2kvm s GLU 43 N 1.52 3.94 0.60 4.98 0.41 -1.05 -4.82 118.70 124.28 2kvm s GLU 43 Ca 0.04 -0.35 -0.19 0.00 -0.41 0.00 0.00 54.97 54.05 2kvm s GLU 43 Cb -0.25 -3.26 -0.04 0.00 -1.78 0.00 0.00 34.13 28.80 2kvm s GLU 43 CO 0.04 0.19 1.10 -0.35 -0.49 0.00 0.00 175.26 175.75 2kvm n PRO 44 N 3.79 1.06 0.00 0.39 -0.04 -1.26 -1.42 135.00 137.52 2kvm n PRO 44 Ca -0.16 0.41 0.04 0.00 -0.04 0.00 0.00 63.50 63.74 2kvm n PRO 44 Cb 0.52 -2.31 0.19 0.00 -0.04 0.00 0.00 33.50 31.87 2kvm n PRO 44 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2kvm n GLU 45 N -1.21 0.11 0.00 0.54 4.71 -0.57 -0.81 120.64 123.41 2kvm n GLU 45 Ca 0.14 0.21 0.11 0.00 -0.01 0.00 0.00 57.16 57.61 2kvm n GLU 45 Cb 0.47 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.40 2kvm n GLU 45 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2kvm n GLU 46 N -1.28 1.35 -0.02 3.49 1.02 -1.26 -4.39 120.64 119.55 2kvm n GLU 46 Ca 0.04 -1.08 0.01 0.00 -0.02 0.00 0.00 57.16 56.11 2kvm n GLU 46 Cb 0.06 -1.46 -0.07 0.00 -0.02 0.00 0.00 31.44 29.95 2kvm n GLU 46 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2kvm n HIS 47 N 0.11 0.00 -1.51 -0.32 8.25 0.01 -4.94 115.22 116.82 2kvm n HIS 47 Ca 0.09 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.14 2kvm n HIS 47 Cb 0.47 -0.30 -0.07 0.00 1.12 0.00 0.00 29.99 31.21 2kvm n HIS 47 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2kvm n ILE 48 N -2.03 0.03 0.45 1.59 2.08 -1.04 -4.72 119.36 115.73 2kvm n ILE 48 Ca -0.07 -0.45 0.03 0.00 0.56 0.00 0.00 62.75 62.83 2kvm n ILE 48 Cb 0.47 -1.93 0.18 0.00 -0.75 0.00 0.00 39.64 37.61 2kvm n ILE 48 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2kvm n LEU 49 N 12.80 0.00 -3.46 1.39 4.77 -1.26 -4.29 117.00 126.95 2kvm n LEU 49 Ca 0.45 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 56.26 2kvm n LEU 49 Cb 0.33 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.31 2kvm n LEU 49 CO 0.78 0.00 -0.17 -1.81 -1.33 0.00 0.00 177.39 174.85 2kvm s ASP 50 N -1.96 1.19 0.40 -1.43 1.11 -1.26 -5.01 116.67 109.70 2kvm s ASP 50 Ca 0.09 -0.18 0.09 0.00 0.18 0.00 0.00 52.55 52.73 2kvm s ASP 50 Cb 0.04 0.53 0.84 0.00 1.07 0.00 0.00 42.92 45.40 2kvm s ASP 50 CO 0.07 -0.33 1.99 -0.65 1.18 0.00 0.00 175.17 177.43 2kvm h PRO 51 N 8.28 0.36 -0.88 8.23 0.11 -2.00 -2.26 132.00 143.85 2kvm h PRO 51 Ca -0.17 -0.05 0.18 0.00 0.11 0.00 0.00 66.00 66.07 2kvm h PRO 51 Cb 1.15 -0.07 -0.11 0.00 0.11 0.00 0.00 31.00 32.08 2kvm h PRO 51 CO 0.29 0.35 0.43 0.00 -0.21 0.00 0.00 178.00 178.86 2kvm h ARG 52 N 0.36 0.51 -0.47 1.05 -0.00 -1.96 0.75 114.38 114.63 2kvm h ARG 52 Ca 0.09 -0.03 0.07 0.00 -0.50 0.00 0.00 59.98 59.61 2kvm h ARG 52 Cb 0.16 -0.12 -0.06 0.00 0.00 0.00 0.00 29.97 29.95 2kvm h ARG 52 CO -0.00 0.34 0.12 -0.07 0.00 0.00 0.00 179.97 180.35 2kvm h LEU 53 N 0.53 0.05 0.56 3.04 3.38 -1.83 -0.40 115.31 120.64 2kvm h LEU 53 Ca 0.52 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.53 2kvm h LEU 53 Cb 0.86 0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.71 2kvm h LEU 53 CO -0.44 0.06 -0.27 0.58 0.09 0.00 0.00 178.44 178.46 2kvm h VAL 54 N 0.26 0.40 -0.13 1.22 2.07 0.03 -2.49 116.25 117.60 2kvm h VAL 54 Ca 0.23 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2kvm h VAL 54 Cb 0.29 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 2kvm h VAL 54 CO -0.28 0.03 -0.18 0.24 0.02 0.00 0.00 177.57 177.40 2kvm h MET 55 N -0.90 -0.13 -1.04 1.57 2.86 0.48 -0.24 114.93 117.54 2kvm h MET 55 Ca -0.08 0.01 0.33 0.00 -2.06 0.00 0.00 59.70 57.90 2kvm h MET 55 Cb 0.63 0.03 -0.14 0.00 0.06 0.00 0.00 31.60 32.18 2kvm h MET 55 CO 0.13 -0.09 0.61 0.00 1.06 0.00 0.00 176.91 178.62 2kvm h ALA 56 N -0.89 2.06 0.29 6.32 0.00 -1.15 0.33 119.26 126.22 2kvm h ALA 56 Ca 0.02 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2kvm h ALA 56 Cb 0.20 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2kvm h ALA 56 CO -0.19 -0.67 -0.28 -0.92 0.00 0.00 0.00 179.25 177.19 2kvm h TYR 57 N 0.30 -0.74 0.00 0.00 3.20 -0.59 -0.17 116.97 118.97 2kvm h TYR 57 Ca 0.74 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.61 2kvm h TYR 57 Cb 1.77 0.29 0.00 0.00 1.54 0.00 0.00 36.73 40.33 2kvm h TYR 57 CO -0.01 -0.40 0.00 0.39 -1.64 0.00 0.00 178.16 176.50 2kvm n GLU 58 N -5.40 0.18 -0.02 1.82 1.02 0.70 -2.62 120.64 116.32 2kvm n GLU 58 Ca -0.09 0.46 -0.15 0.00 -0.02 0.00 0.00 57.16 57.35 2kvm n GLU 58 Cb 0.30 -1.87 -0.12 0.00 -0.02 0.00 0.00 31.44 29.73 2kvm n GLU 58 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2kvm h GLU 59 N 0.00 0.17 -0.76 3.49 5.08 0.97 -1.57 114.58 121.96 2kvm h GLU 59 Ca 0.00 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2kvm h GLU 59 Cb 0.30 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 2kvm h GLU 59 CO 0.00 0.95 0.43 0.87 -1.00 0.00 0.00 179.01 180.26 2kvm h LYS 60 N -0.52 1.05 0.02 2.33 1.57 -0.84 -2.49 116.57 117.69 2kvm h LYS 60 Ca -0.04 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2kvm h LYS 60 Cb 1.05 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.15 2kvm h LYS 60 CO 0.05 0.77 -0.01 0.93 -0.57 0.00 0.00 179.45 180.62 2kvm h GLU 61 N 1.04 -0.03 -0.88 3.15 4.39 -1.57 -2.74 114.58 117.95 2kvm h GLU 61 Ca 0.27 0.00 0.21 0.00 0.34 0.00 0.00 59.36 60.18 2kvm h GLU 61 Cb 0.02 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.62 2kvm h GLU 61 CO -0.04 0.20 0.59 1.05 -1.16 0.00 0.00 179.01 179.65 2kvm h GLU 62 N -0.26 0.31 0.50 2.33 4.11 -1.10 0.93 114.58 121.40 2kvm h GLU 62 Ca -0.00 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 2kvm h GLU 62 Cb 0.25 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2kvm h GLU 62 CO 0.00 0.20 -0.24 0.00 0.07 0.00 0.00 179.01 179.05 2kvm h ARG 63 N 0.31 -0.64 0.11 1.06 2.47 -1.17 -1.54 114.38 114.98 2kvm h ARG 63 Ca 0.45 0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 59.21 2kvm h ARG 63 Cb 1.25 0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.72 2kvm h ARG 63 CO -0.14 -0.34 -0.05 0.22 0.56 0.00 0.00 179.97 180.22 2kvm h ASP 64 N -0.94 -0.12 -0.88 7.04 1.82 -1.04 -3.34 116.42 118.95 2kvm h ASP 64 Ca -0.07 0.00 0.22 0.00 -0.39 0.00 0.00 57.03 56.79 2kvm h ASP 64 Cb 0.60 0.03 -0.12 0.00 0.68 0.00 0.00 39.33 40.52 2kvm h ASP 64 CO 0.11 0.21 0.37 0.03 -1.61 0.00 0.00 179.24 178.35 2kvm h ARG 65 N -0.74 0.37 0.00 0.28 3.08 0.68 -3.43 114.38 114.63 2kvm h ARG 65 Ca -0.01 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2kvm h ARG 65 Cb 0.11 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2kvm h ARG 65 CO 0.02 0.24 0.00 0.00 -1.07 0.00 0.00 179.97 179.17 2kvm n ALA 66 N -2.52 0.00 -0.12 0.04 0.00 -0.58 -3.84 120.51 113.49 2kvm n ALA 66 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2kvm n ALA 66 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 2kvm n ALA 66 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2kvm n SER 67 N 2.13 0.00 -0.26 0.00 2.88 -1.26 -4.97 113.62 112.15 2kvm n SER 67 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2kvm n SER 67 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2kvm n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kvm n GLY 68 N 1.81 0.45 3.77 0.46 0.00 -1.25 -4.71 105.19 105.71 2kvm n GLY 68 Ca 0.00 -0.86 -0.39 0.00 0.00 0.00 0.00 46.02 44.77 2kvm n GLY 68 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2kvm s TYR 69 N 0.00 2.98 0.00 1.61 5.04 -1.26 -4.83 117.35 120.89 2kvm s TYR 69 Ca 0.00 1.51 0.00 0.00 -2.44 0.00 0.00 57.07 56.14 2kvm s TYR 69 Cb 0.00 -3.49 0.00 0.00 0.35 0.00 0.00 41.96 38.82 2kvm s TYR 69 CO 0.00 -1.58 0.00 -2.13 -1.34 0.00 0.00 175.55 170.50 2kvm n ARG 70 N 0.09 0.00 0.00 4.97 3.00 -1.26 -5.22 116.66 118.24 2kvm n ARG 70 Ca 0.04 0.00 0.15 0.00 -0.00 0.00 0.00 57.85 58.04 2kvm n ARG 70 Cb 0.45 0.00 0.80 0.00 0.00 0.00 0.00 32.46 33.71 2kvm n ARG 70 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80