#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 0.00 -3.16 0.03 1.02 -1.26 -3.89 120.64 113.38 2kvm n GLU 2 Ca 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.16 2kvm n GLU 2 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.41 2kvm n GLU 2 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2kvm s LEU 3 N 0.00 -1.43 0.11 -4.62 1.98 -1.26 -4.94 118.68 108.51 2kvm s LEU 3 Ca 0.00 -0.56 0.00 0.00 -2.89 0.00 0.00 54.13 50.68 2kvm s LEU 3 Cb 0.00 1.83 0.00 0.00 0.66 0.00 0.00 46.19 48.68 2kvm s LEU 3 CO 0.00 -0.18 0.00 -1.54 -1.89 0.00 0.00 176.35 172.74 2kvm n SER 4 N 4.53 -0.94 0.01 3.68 3.41 -1.25 -4.95 113.62 118.10 2kvm n SER 4 Ca 0.10 0.25 -0.01 0.00 -0.26 0.00 0.00 58.87 58.94 2kvm n SER 4 Cb 0.57 1.16 -0.10 0.00 -0.26 0.00 0.00 64.21 65.58 2kvm n SER 4 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kvm n ALA 5 N -2.65 1.92 -1.66 7.33 0.00 -1.26 -4.81 120.51 119.38 2kvm n ALA 5 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 53.44 52.50 2kvm n ALA 5 Cb 0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 19.45 18.56 2kvm n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2kvm s ILE 6 N -2.90 3.08 -1.67 0.00 1.01 -1.26 -4.76 121.20 114.71 2kvm s ILE 6 Ca -0.04 0.00 0.13 0.00 0.00 0.00 0.00 60.65 60.74 2kvm s ILE 6 Cb 0.09 -3.21 0.44 0.00 0.01 0.00 0.00 42.46 39.78 2kvm s ILE 6 CO 0.82 -0.20 1.33 0.61 0.00 0.00 0.00 174.94 177.50 2kvm n GLY 7 N 6.24 1.46 2.21 6.18 0.00 -1.26 -5.04 105.19 114.98 2kvm n GLY 7 Ca 0.37 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 46.00 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 0.76 -1.85 0.00 1.61 1.02 -1.26 -5.01 120.64 115.91 2kvm n GLU 8 Ca 0.16 1.22 0.00 0.00 -0.02 0.00 0.00 57.16 58.52 2kvm n GLU 8 Cb 0.50 -2.25 0.00 0.00 -0.02 0.00 0.00 31.44 29.66 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 -3.06 0.00 -1.21 3.49 10.64 -1.26 -5.16 117.38 120.82 2kvm n GLN 9 Ca 0.01 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.18 2kvm n GLN 9 Cb 0.42 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.80 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 -1.47 -3.08 0.00 -0.39 0.31 -1.26 -5.09 118.33 107.35 2kvm n VAL 10 Ca 0.00 1.42 0.00 0.00 -0.01 0.00 0.00 64.34 65.75 2kvm n VAL 10 Cb 0.00 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 30.79 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 -1.77 0.00 -3.15 3.52 3.72 -1.26 -5.16 117.46 113.37 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 0.22 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.74 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 -3.09 -0.15 4.37 0.00 -1.26 -5.13 121.76 114.50 2kvm s ALA 12 Ca 0.00 1.55 -0.22 0.00 0.00 0.00 0.00 51.96 53.29 2kvm s ALA 12 Cb 0.00 -2.41 -0.03 0.00 0.00 0.00 0.00 23.12 20.69 2kvm s ALA 12 CO 0.00 -1.44 0.68 0.08 0.00 0.00 0.00 175.76 175.09 2kvm s VAL 13 N 2.92 5.01 0.20 0.00 1.01 -1.26 -1.56 120.40 126.72 2kvm s VAL 13 Ca 0.06 1.34 -0.11 0.00 0.00 0.00 0.00 61.98 63.27 2kvm s VAL 13 Cb -0.12 -4.00 0.14 0.00 0.00 0.00 0.00 36.38 32.40 2kvm s VAL 13 CO -0.14 0.14 1.85 -0.08 0.00 0.00 0.00 175.10 176.86 2kvm h GLU 14 N 7.22 0.96 0.00 2.72 4.81 -0.39 -3.42 114.58 126.48 2kvm h GLU 14 Ca -0.34 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2kvm h GLU 14 Cb 1.16 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.33 2kvm h GLU 14 CO 0.78 0.68 0.00 -1.13 -0.73 0.00 0.00 179.01 178.61 2kvm n SER 15 N -4.54 0.00 -4.52 1.04 3.41 -1.06 -4.94 113.62 103.01 2kvm n SER 15 Ca 0.06 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.37 2kvm n SER 15 Cb 0.05 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.19 2kvm n SER 15 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2kvm n ILE 16 N -0.80 0.00 0.00 -1.33 5.41 -1.26 -0.83 119.36 120.56 2kvm n ILE 16 Ca 0.00 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.54 2kvm n ILE 16 Cb 0.00 -0.90 0.00 0.00 -0.71 0.00 0.00 39.64 38.03 2kvm n ILE 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2kvm n ARG 17 N -3.87 0.00 -4.28 0.38 1.74 0.35 -4.59 116.66 106.39 2kvm n ARG 17 Ca 0.07 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.98 2kvm n ARG 17 Cb 0.54 -0.57 -0.09 0.00 -1.02 0.00 0.00 32.46 31.31 2kvm n ARG 17 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2kvm s LYS 18 N -1.66 1.50 -0.16 5.56 1.02 -0.96 -4.93 119.74 120.11 2kvm s LYS 18 Ca 0.00 -1.84 -0.06 0.00 0.02 0.00 0.00 55.97 54.09 2kvm s LYS 18 Cb 0.00 0.09 0.07 0.00 -0.52 0.00 0.00 37.83 37.47 2kvm s LYS 18 CO 0.00 -0.46 0.34 0.21 -0.92 0.00 0.00 175.35 174.52 2kvm s LYS 19 N -3.86 0.26 -0.04 1.68 2.20 -1.26 -1.09 119.74 117.63 2kvm s LYS 19 Ca 0.38 0.84 0.02 0.00 -0.36 0.00 0.00 55.97 56.85 2kvm s LYS 19 Cb 0.05 0.09 0.01 0.00 -1.51 0.00 0.00 37.83 36.48 2kvm s LYS 19 CO 0.18 -0.24 -0.08 -0.98 -0.36 0.00 0.00 175.35 173.87 2kvm s ARG 20 N 2.20 1.00 0.13 4.03 1.70 -0.26 -4.95 118.95 122.80 2kvm s ARG 20 Ca -0.03 -0.25 0.08 0.00 -0.47 0.00 0.00 55.73 55.06 2kvm s ARG 20 Cb -0.11 -0.92 -0.04 0.00 -0.57 0.00 0.00 34.95 33.30 2kvm s ARG 20 CO -0.11 0.04 -0.13 0.08 -1.08 0.00 0.00 175.30 174.11 2kvm s VAL 21 N 0.45 3.13 -0.32 4.99 1.01 -1.26 0.20 120.40 128.60 2kvm s VAL 21 Ca -0.07 -1.48 -0.01 0.00 0.00 0.00 0.00 61.98 60.42 2kvm s VAL 21 Cb -0.11 -2.48 0.11 0.00 0.00 0.00 0.00 36.38 33.89 2kvm s VAL 21 CO 0.01 0.03 0.12 -0.60 0.00 0.00 0.00 175.10 174.67 2kvm s ARG 22 N -2.39 0.69 0.00 2.72 3.52 0.35 -4.77 118.95 119.07 2kvm s ARG 22 Ca 0.21 -1.11 0.00 0.00 -0.13 0.00 0.00 55.73 54.70 2kvm s ARG 22 Cb -0.10 -1.87 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 2kvm s ARG 22 CO 0.13 -1.02 0.00 1.63 -0.81 0.00 0.00 175.30 175.23 2kvm n LYS 23 N 4.72 -0.55 0.00 5.12 5.02 -1.26 -0.68 118.16 130.52 2kvm n LYS 23 Ca -0.01 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 2kvm n LYS 23 Cb 0.41 -4.45 0.00 0.00 -0.02 0.00 0.00 35.03 30.97 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 -1.21 1.26 3.57 0.72 0.00 -1.26 -5.08 105.19 103.18 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 2.91 0.25 1.61 1.02 0.14 -4.97 119.74 120.70 2kvm s LYS 25 Ca 0.00 0.75 -0.25 0.00 0.02 0.00 0.00 55.97 56.49 2kvm s LYS 25 Cb 0.00 -4.29 -0.09 0.00 -0.52 0.00 0.00 37.83 32.93 2kvm s LYS 25 CO 0.00 -2.39 0.85 0.08 -0.92 0.00 0.00 175.35 172.98 2kvm s VAL 26 N 8.01 4.30 0.04 3.17 1.01 -1.26 -0.49 120.40 135.17 2kvm s VAL 26 Ca 0.67 1.72 0.02 0.00 0.00 0.00 0.00 61.98 64.39 2kvm s VAL 26 Cb -0.14 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 2kvm s VAL 26 CO 0.24 0.31 -0.08 -1.61 0.00 0.00 0.00 175.10 173.96 2kvm s GLU 27 N -1.67 0.53 -0.17 2.72 2.02 0.13 -1.05 118.70 121.21 2kvm s GLU 27 Ca 0.44 -0.75 -0.02 0.00 0.02 0.00 0.00 54.97 54.66 2kvm s GLU 27 Cb -0.21 -0.31 0.05 0.00 0.10 0.00 0.00 34.13 33.76 2kvm s GLU 27 CO 0.25 0.06 0.01 0.71 0.02 0.00 0.00 175.26 176.30 2kvm s TYR 28 N -1.34 1.22 -1.00 1.61 2.02 -0.60 -1.10 117.35 118.16 2kvm s TYR 28 Ca -0.09 -0.87 -0.24 0.00 -0.37 0.00 0.00 57.07 55.49 2kvm s TYR 28 Cb -0.10 -1.10 -0.07 0.00 -0.40 0.00 0.00 41.96 40.29 2kvm s TYR 28 CO 0.00 -0.58 1.98 -1.17 -1.57 0.00 0.00 175.55 174.21 2kvm s LEU 29 N 1.79 3.08 0.05 -1.29 1.98 -0.25 -1.90 118.68 122.14 2kvm s LEU 29 Ca -0.00 -0.97 -0.23 0.00 -2.89 0.00 0.00 54.13 50.03 2kvm s LEU 29 Cb -0.16 -2.57 -0.06 0.00 0.66 0.00 0.00 46.19 44.06 2kvm s LEU 29 CO -0.07 -3.01 0.69 0.68 -1.89 0.00 0.00 176.35 172.76 2kvm s VAL 30 N 10.96 4.73 -0.42 1.68 -7.23 -0.31 0.13 120.40 129.94 2kvm s VAL 30 Ca 0.71 1.48 -0.21 0.00 -1.81 0.00 0.00 61.98 62.15 2kvm s VAL 30 Cb -0.05 -4.04 0.02 0.00 0.56 0.00 0.00 36.38 32.87 2kvm s VAL 30 CO 0.05 0.42 0.68 -0.75 -0.31 0.00 0.00 175.10 175.19 2kvm s LYS 31 N -0.37 3.42 0.21 4.82 2.20 -0.01 -2.64 119.74 127.37 2kvm s LYS 31 Ca 0.35 -0.19 -0.30 0.00 -0.36 0.00 0.00 55.97 55.47 2kvm s LYS 31 Cb -0.20 -3.91 -0.10 0.00 -1.51 0.00 0.00 37.83 32.12 2kvm s LYS 31 CO 0.21 -0.96 1.43 -1.58 -0.36 0.00 0.00 175.35 174.09 2kvm s TRP 32 N 2.91 3.10 0.27 4.03 0.52 -1.26 0.30 118.94 128.81 2kvm s TRP 32 Ca 0.25 0.98 -0.30 0.00 0.02 0.00 0.00 56.10 57.05 2kvm s TRP 32 Cb -0.14 -3.78 -0.11 0.00 -1.15 0.00 0.00 33.47 28.30 2kvm s TRP 32 CO 0.19 -2.61 1.50 0.21 0.02 0.00 0.00 176.95 176.25 2kvm s LYS 33 N 0.15 4.21 0.00 4.98 2.20 -0.60 -1.84 119.74 128.83 2kvm s LYS 33 Ca 0.61 2.41 0.00 0.00 -0.36 0.00 0.00 55.97 58.64 2kvm s LYS 33 Cb -0.40 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 32.84 2kvm s LYS 33 CO 0.38 -0.50 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 2kvm n GLY 34 N 2.10 2.80 3.88 5.54 0.00 -1.26 -4.88 105.19 113.37 2kvm n GLY 34 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.76 3.43 0.57 1.61 0.52 -0.77 -5.09 118.94 118.46 2kvm s TRP 35 Ca 0.00 0.82 -0.13 0.00 0.02 0.00 0.00 56.10 56.81 2kvm s TRP 35 Cb 0.00 -2.22 -0.06 0.00 -1.15 0.00 0.00 33.47 30.04 2kvm s TRP 35 CO 0.00 0.28 1.00 -1.25 0.02 0.00 0.00 176.95 177.00 2kvm s PRO 36 N -2.84 3.75 0.58 4.98 0.04 -1.26 -4.64 135.00 135.60 2kvm s PRO 36 Ca 0.46 0.82 0.27 0.00 0.04 0.00 0.00 61.00 62.59 2kvm s PRO 36 Cb -0.11 -2.12 1.45 0.00 0.04 0.00 0.00 34.50 33.76 2kvm s PRO 36 CO 0.22 -0.42 1.79 -1.35 0.04 0.00 0.00 177.00 177.28 2kvm h PRO 37 N 0.26 0.00 0.00 0.56 0.11 -1.98 -0.29 132.00 130.65 2kvm h PRO 37 Ca -0.45 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 2kvm h PRO 37 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2kvm h PRO 37 CO 0.62 0.00 -0.21 0.87 -0.21 0.00 0.00 178.00 179.06 2kvm h LYS 38 N 0.00 0.00 -0.31 1.05 1.57 -2.01 -2.70 116.57 114.16 2kvm h LYS 38 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kvm h LYS 38 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 2kvm h LYS 38 CO 0.00 0.21 0.00 0.66 -0.57 0.00 0.00 179.45 179.75 2kvm n TYR 39 N -3.56 0.39 -1.29 -1.35 4.02 -0.12 -4.99 117.16 110.26 2kvm n TYR 39 Ca -0.01 -0.20 -0.37 0.00 -0.01 0.00 0.00 57.90 57.31 2kvm n TYR 39 Cb 0.36 -0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.74 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 1.40 -1.35 -4.06 7.72 7.64 -1.02 -4.87 113.62 119.07 2kvm n SER 40 Ca 0.18 0.61 -0.12 0.00 1.01 0.00 0.00 58.87 60.55 2kvm n SER 40 Cb 0.59 -1.19 -0.11 0.00 -1.01 0.00 0.00 64.21 62.49 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 -1.89 0.45 -0.58 0.44 -4.23 -1.08 -4.98 115.64 103.77 2kvm s THR 41 Ca 0.65 -1.20 -0.20 0.00 -1.18 0.00 0.00 61.69 59.76 2kvm s THR 41 Cb -0.36 -0.73 0.08 0.00 1.34 0.00 0.00 72.50 72.83 2kvm s THR 41 CO 0.58 -0.50 0.78 0.26 -0.54 0.00 0.00 174.62 175.19 2kvm s TRP 42 N -1.83 2.90 -0.30 3.99 0.52 -1.26 -1.16 118.94 121.81 2kvm s TRP 42 Ca -0.07 -0.66 -0.07 0.00 0.02 0.00 0.00 56.10 55.31 2kvm s TRP 42 Cb -0.07 -3.98 0.01 0.00 -1.15 0.00 0.00 33.47 28.28 2kvm s TRP 42 CO -0.01 -1.33 0.09 -1.21 0.02 0.00 0.00 176.95 174.51 2kvm s GLU 43 N 3.15 3.15 0.48 4.98 0.41 -0.80 -4.77 118.70 125.30 2kvm s GLU 43 Ca 0.17 -0.82 -0.21 0.00 -0.41 0.00 0.00 54.97 53.70 2kvm s GLU 43 Cb -0.20 -3.40 -0.11 0.00 -1.78 0.00 0.00 34.13 28.64 2kvm s GLU 43 CO 0.10 -0.43 0.54 -0.35 -0.49 0.00 0.00 175.26 174.63 2kvm n PRO 44 N 4.89 0.58 0.24 0.39 -0.04 -1.26 -1.55 135.00 138.25 2kvm n PRO 44 Ca -0.14 0.22 0.10 0.00 -0.04 0.00 0.00 63.50 63.64 2kvm n PRO 44 Cb 0.48 -1.60 0.55 0.00 -0.04 0.00 0.00 33.50 32.90 2kvm n PRO 44 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2kvm h GLU 45 N 0.61 0.00 0.14 0.54 4.22 -1.41 0.33 114.58 119.02 2kvm h GLU 45 Ca -0.43 0.00 -0.32 0.00 0.08 0.00 0.00 59.36 58.70 2kvm h GLU 45 Cb 1.40 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.65 2kvm h GLU 45 CO 0.50 0.00 -1.57 0.93 -2.18 0.00 0.00 179.01 176.69 2kvm h GLU 46 N 0.00 0.30 0.00 1.92 5.08 -1.86 -3.35 114.58 116.68 2kvm h GLU 46 Ca 0.00 -0.51 -0.21 0.00 -1.00 0.00 0.00 59.36 57.64 2kvm h GLU 46 Cb 0.66 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 2kvm h GLU 46 CO 0.00 1.18 -0.91 0.45 -1.00 0.00 0.00 179.01 178.73 2kvm h HIS 47 N 0.08 0.43 -1.03 4.33 3.86 -0.69 -3.43 115.15 118.71 2kvm h HIS 47 Ca -0.26 -0.24 -0.48 0.00 -1.16 0.00 0.00 60.37 58.23 2kvm h HIS 47 Cb 2.04 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 30.44 2kvm h HIS 47 CO 0.08 1.06 1.68 -0.89 0.86 0.00 0.00 177.93 180.71 2kvm n ILE 48 N -3.69 -0.05 0.47 2.45 2.08 -0.68 -4.72 119.36 115.21 2kvm n ILE 48 Ca -0.05 -0.51 0.03 0.00 0.56 0.00 0.00 62.75 62.78 2kvm n ILE 48 Cb 0.82 -1.97 0.17 0.00 -0.75 0.00 0.00 39.64 37.91 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 13.89 0.00 -3.53 1.39 4.77 -1.26 -4.36 117.00 127.90 2kvm n LEU 49 Ca 0.47 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 56.24 2kvm n LEU 49 Cb 0.36 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.31 2kvm n LEU 49 CO 0.79 0.00 -0.25 -0.62 -1.33 0.00 0.00 177.39 175.98 2kvm s ASP 50 N -1.95 1.78 0.40 -1.43 2.15 -1.26 -4.98 116.67 111.38 2kvm s ASP 50 Ca 0.09 -0.41 0.28 0.00 0.43 0.00 0.00 52.55 52.94 2kvm s ASP 50 Cb 0.04 0.16 1.36 0.00 -0.30 0.00 0.00 42.92 44.18 2kvm s ASP 50 CO 0.07 -0.34 1.86 -0.65 -0.17 0.00 0.00 175.17 175.93 2kvm h PRO 51 N 8.35 0.00 -0.27 4.34 0.11 -1.96 -1.44 132.00 141.14 2kvm h PRO 51 Ca -0.16 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.89 2kvm h PRO 51 Cb 1.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2kvm h PRO 51 CO 0.29 0.00 -0.10 0.00 -0.21 0.00 0.00 178.00 177.99 2kvm h ARG 52 N 0.00 0.44 -0.40 1.05 -0.00 -1.95 0.29 114.38 113.80 2kvm h ARG 52 Ca 0.00 -0.11 -0.05 0.00 -0.50 0.00 0.00 59.98 59.32 2kvm h ARG 52 Cb 0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 29.97 30.12 2kvm h ARG 52 CO 0.00 0.54 0.07 -0.07 0.00 0.00 0.00 179.97 180.51 2kvm h LEU 53 N 0.41 0.64 0.50 3.04 3.38 -1.68 0.38 115.31 121.99 2kvm h LEU 53 Ca 0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2kvm h LEU 53 Cb 0.42 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2kvm h LEU 53 CO 0.02 0.73 -0.24 0.58 0.09 0.00 0.00 178.44 179.62 2kvm h VAL 54 N 0.52 0.48 -0.22 1.22 2.07 -1.39 -1.19 116.25 117.73 2kvm h VAL 54 Ca 0.12 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.48 2kvm h VAL 54 Cb 0.36 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2kvm h VAL 54 CO 0.01 0.04 -0.12 -0.03 0.02 0.00 0.00 177.57 177.48 2kvm h MET 55 N -0.81 -0.10 -0.94 1.57 1.85 -0.45 0.21 114.93 116.26 2kvm h MET 55 Ca -0.07 0.01 0.19 0.00 -0.61 0.00 0.00 59.70 59.22 2kvm h MET 55 Cb 0.58 0.02 -0.08 0.00 0.43 0.00 0.00 31.60 32.55 2kvm h MET 55 CO 0.11 -0.06 0.60 0.00 -0.40 0.00 0.00 176.91 177.16 2kvm h ALA 56 N 1.08 1.95 -0.01 0.39 0.00 -0.85 0.22 119.26 122.04 2kvm h ALA 56 Ca 0.12 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2kvm h ALA 56 Cb 0.28 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2kvm h ALA 56 CO -0.29 -0.26 0.00 -0.92 0.00 0.00 0.00 179.25 177.78 2kvm h TYR 57 N 0.59 0.01 0.00 0.00 3.20 0.28 -1.46 116.97 119.59 2kvm h TYR 57 Ca 0.51 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.38 2kvm h TYR 57 Cb 1.00 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.27 2kvm h TYR 57 CO -0.00 0.19 0.00 0.39 -1.64 0.00 0.00 178.16 177.10 2kvm n GLU 58 N -5.00 0.10 0.08 1.82 -0.58 -0.04 -1.60 120.64 115.42 2kvm n GLU 58 Ca -0.07 0.44 -0.15 0.00 -0.42 0.00 0.00 57.16 56.96 2kvm n GLU 58 Cb 0.11 -1.74 -0.14 0.00 -0.57 0.00 0.00 31.44 29.10 2kvm n GLU 58 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 2kvm h GLU 59 N 0.00 0.23 -0.35 3.49 4.81 0.35 -2.23 114.58 120.88 2kvm h GLU 59 Ca 0.00 -0.39 -0.12 0.00 -0.13 0.00 0.00 59.36 58.73 2kvm h GLU 59 Cb 0.20 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2kvm h GLU 59 CO 0.00 1.13 -0.24 0.87 -0.73 0.00 0.00 179.01 180.05 2kvm h LYS 60 N 0.06 0.78 -0.13 1.92 1.79 -0.52 -1.74 116.57 118.73 2kvm h LYS 60 Ca -0.17 -0.37 -0.04 0.00 -2.18 0.00 0.00 60.65 57.90 2kvm h LYS 60 Cb 1.97 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 32.61 2kvm h LYS 60 CO 0.18 0.99 -0.06 0.93 -1.08 0.00 0.00 179.45 180.41 2kvm h GLU 61 N 0.56 0.28 -0.32 3.15 5.08 -1.59 -2.49 114.58 119.25 2kvm h GLU 61 Ca 0.07 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2kvm h GLU 61 Cb 0.80 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 2kvm h GLU 61 CO 0.06 0.61 0.08 1.05 -1.00 0.00 0.00 179.01 179.81 2kvm h GLU 62 N -0.06 0.47 0.17 2.33 4.11 -1.42 0.35 114.58 120.52 2kvm h GLU 62 Ca 0.03 -0.07 -0.01 0.00 0.07 0.00 0.00 59.36 59.38 2kvm h GLU 62 Cb 0.52 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2kvm h GLU 62 CO 0.02 0.43 -0.08 0.00 0.07 0.00 0.00 179.01 179.45 2kvm h ARG 63 N 0.46 -0.22 0.06 1.06 2.47 -1.20 -0.91 114.38 116.10 2kvm h ARG 63 Ca 0.11 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.84 2kvm h ARG 63 Cb 0.18 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.55 2kvm h ARG 63 CO -0.00 0.01 -0.03 0.22 0.56 0.00 0.00 179.97 180.73 2kvm h ASP 64 N -0.42 -0.07 0.12 7.04 3.58 -1.21 -3.38 116.42 122.07 2kvm h ASP 64 Ca -0.02 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.44 2kvm h ASP 64 Cb 0.33 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.35 2kvm h ASP 64 CO 0.04 0.21 -0.52 0.03 -2.88 0.00 0.00 179.24 176.11 2kvm h ARG 65 N -0.60 -0.72 -0.86 0.28 3.08 -0.47 -3.45 114.38 111.64 2kvm h ARG 65 Ca -0.01 0.05 -0.15 0.00 0.07 0.00 0.00 59.98 59.94 2kvm h ARG 65 Cb 0.06 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.22 2kvm h ARG 65 CO 0.01 -0.48 -0.14 0.00 -1.07 0.00 0.00 179.97 178.29 2kvm n ALA 66 N -2.93 -0.11 0.09 0.04 0.00 -0.35 -3.88 120.51 113.38 2kvm n ALA 66 Ca -0.08 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2kvm n ALA 66 Cb 0.41 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 0.04 -1.66 0.00 0.00 2.88 -1.26 -5.04 113.62 108.59 2kvm n SER 67 Ca -0.07 0.50 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2kvm n SER 67 Cb 0.35 1.77 0.00 0.00 -0.75 0.00 0.00 64.21 65.58 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 -1.28 0.07 3.85 0.46 0.00 -1.25 -5.15 105.19 101.88 2kvm n GLY 68 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 3.51 0.00 1.61 5.04 -1.26 -5.02 117.35 121.23 2kvm s TYR 69 Ca 0.00 1.11 0.00 0.00 -2.44 0.00 0.00 57.07 55.74 2kvm s TYR 69 Cb 0.00 -2.43 0.00 0.00 0.35 0.00 0.00 41.96 39.88 2kvm s TYR 69 CO 0.00 0.29 0.00 -2.13 -1.34 0.00 0.00 175.55 172.37 2kvm n ARG 70 N 0.28 2.83 0.00 4.97 0.63 -1.26 -4.18 116.66 119.92 2kvm n ARG 70 Ca -0.01 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.06 2kvm n ARG 70 Cb 0.52 0.00 0.48 0.00 0.45 0.00 0.00 32.46 33.91 2kvm n ARG 70 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29