#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvm s GLU 2 N 0.00 3.56 -0.12 0.03 2.02 -1.26 -5.00 118.70 117.94 2kvm s GLU 2 Ca 0.00 -0.37 0.03 0.00 0.02 0.00 0.00 54.97 54.64 2kvm s GLU 2 Cb 0.00 -3.03 -0.24 0.00 0.10 0.00 0.00 34.13 30.96 2kvm s GLU 2 CO 0.00 0.45 0.36 1.28 0.02 0.00 0.00 175.26 177.37 2kvm n LEU 3 N 2.94 1.89 0.00 1.80 4.77 -1.26 -5.05 117.00 122.09 2kvm n LEU 3 Ca -0.18 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2kvm n LEU 3 Cb 0.53 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2kvm n LEU 3 CO 0.32 0.69 0.00 -1.54 -1.33 0.00 0.00 177.39 175.53 2kvm n SER 4 N -3.25 0.00 -0.13 -1.43 3.41 -1.26 -5.04 113.62 105.91 2kvm n SER 4 Ca -0.29 -0.73 -0.05 0.00 -0.26 0.00 0.00 58.87 57.55 2kvm n SER 4 Cb 1.05 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 65.04 2kvm n SER 4 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kvm h ALA 5 N 1.97 0.51 -0.61 7.33 0.00 -2.05 -3.44 119.26 122.98 2kvm h ALA 5 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2kvm h ALA 5 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2kvm h ALA 5 CO 0.00 -0.24 0.00 -0.89 0.00 0.00 0.00 179.25 178.12 2kvm n ILE 6 N -5.01 0.00 0.00 0.00 5.41 -1.26 -4.68 119.36 113.82 2kvm n ILE 6 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.78 2kvm n ILE 6 Cb 0.16 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.09 2kvm n ILE 6 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kvm n GLY 7 N 0.00 2.62 1.23 7.39 0.00 -1.26 -5.12 105.19 110.04 2kvm n GLY 7 Ca 0.00 -0.39 0.14 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 -2.86 0.00 1.61 1.02 -1.26 -5.04 120.64 114.11 2kvm n GLU 8 Ca 0.00 2.34 0.00 0.00 -0.02 0.00 0.00 57.16 59.48 2kvm n GLU 8 Cb 0.00 -3.31 0.00 0.00 -0.02 0.00 0.00 31.44 28.11 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 -3.93 0.00 -1.35 3.49 -0.00 -1.26 -5.16 117.38 109.17 2kvm n GLN 9 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.92 2kvm n GLN 9 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.82 2kvm n GLN 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 2kvm n VAL 10 N -0.75 -4.61 -3.73 -0.39 0.31 -1.26 -5.10 118.33 102.80 2kvm n VAL 10 Ca 0.00 2.01 0.00 0.00 -0.01 0.00 0.00 64.34 66.34 2kvm n VAL 10 Cb 0.00 -2.78 0.00 0.00 -0.91 0.00 0.00 33.84 30.15 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 -0.61 -0.18 -3.75 3.52 3.72 -1.26 -5.15 117.46 113.75 2kvm n PHE 11 Ca 0.00 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.05 2kvm n PHE 11 Cb 0.00 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.45 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 -1.80 3.63 -0.19 4.37 0.00 -1.26 -5.09 121.76 121.43 2kvm s ALA 12 Ca 0.00 -0.75 -0.06 0.00 0.00 0.00 0.00 51.96 51.15 2kvm s ALA 12 Cb 0.00 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.91 2kvm s ALA 12 CO 0.00 0.07 0.03 0.08 0.00 0.00 0.00 175.76 175.94 2kvm s VAL 13 N 0.54 4.40 0.15 0.00 1.01 -1.26 -2.39 120.40 122.85 2kvm s VAL 13 Ca 0.07 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.74 2kvm s VAL 13 Cb -0.12 -2.98 0.03 0.00 0.00 0.00 0.00 36.38 33.31 2kvm s VAL 13 CO -0.00 0.45 1.71 -0.08 0.00 0.00 0.00 175.10 177.17 2kvm h GLU 14 N 7.00 0.71 0.00 2.72 4.57 -0.34 -3.43 114.58 125.81 2kvm h GLU 14 Ca -0.35 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2kvm h GLU 14 Cb 1.18 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.65 2kvm h GLU 14 CO 0.65 0.63 0.00 0.43 -1.18 0.00 0.00 179.01 179.54 2kvm n SER 15 N -4.59 0.00 -4.66 1.04 7.64 -1.07 -4.96 113.62 107.02 2kvm n SER 15 Ca 0.01 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.49 2kvm n SER 15 Cb 0.14 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.36 2kvm n SER 15 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2kvm n ILE 16 N -1.05 2.76 -0.09 0.44 5.41 -1.26 -2.14 119.36 123.43 2kvm n ILE 16 Ca 0.00 -0.50 -0.15 0.00 1.00 0.00 0.00 62.75 63.10 2kvm n ILE 16 Cb 0.00 -1.35 -0.07 0.00 -0.71 0.00 0.00 39.64 37.51 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 -0.14 0.40 -4.34 0.38 1.74 0.24 -4.78 116.66 110.15 2kvm n ARG 17 Ca 0.09 0.13 -0.20 0.00 -0.77 0.00 0.00 57.85 57.10 2kvm n ARG 17 Cb 0.41 -1.24 -0.09 0.00 -1.02 0.00 0.00 32.46 30.52 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 -2.33 1.71 -0.11 5.56 1.02 -1.09 -4.92 119.74 119.59 2kvm s LYS 18 Ca -0.24 -2.00 -0.05 0.00 0.02 0.00 0.00 55.97 53.71 2kvm s LYS 18 Cb 0.08 -0.01 0.05 0.00 -0.52 0.00 0.00 37.83 37.43 2kvm s LYS 18 CO 0.35 -0.54 0.24 0.21 -0.92 0.00 0.00 175.35 174.70 2kvm s LYS 19 N -3.67 0.17 -0.04 1.68 2.20 -1.26 -0.81 119.74 118.02 2kvm s LYS 19 Ca 0.35 0.60 0.03 0.00 -0.36 0.00 0.00 55.97 56.59 2kvm s LYS 19 Cb 0.03 -0.10 0.00 0.00 -1.51 0.00 0.00 37.83 36.25 2kvm s LYS 19 CO 0.21 -0.21 -0.12 -0.98 -0.36 0.00 0.00 175.35 173.88 2kvm s ARG 20 N 1.68 1.33 0.13 4.03 1.70 -0.33 -4.94 118.95 122.56 2kvm s ARG 20 Ca -0.05 -0.43 0.11 0.00 -0.47 0.00 0.00 55.73 54.89 2kvm s ARG 20 Cb -0.11 -1.19 -0.04 0.00 -0.57 0.00 0.00 34.95 33.04 2kvm s ARG 20 CO -0.08 0.15 -0.26 0.08 -1.08 0.00 0.00 175.30 174.11 2kvm s VAL 21 N 0.19 2.33 -0.33 4.99 1.01 -1.25 0.13 120.40 127.46 2kvm s VAL 21 Ca -0.04 -1.74 -0.00 0.00 0.00 0.00 0.00 61.98 60.19 2kvm s VAL 21 Cb -0.10 -2.04 0.11 0.00 0.00 0.00 0.00 36.38 34.35 2kvm s VAL 21 CO 0.01 0.08 0.13 -0.60 0.00 0.00 0.00 175.10 174.72 2kvm s ARG 22 N -2.09 0.81 0.00 2.72 3.52 0.62 -4.76 118.95 119.76 2kvm s ARG 22 Ca 0.15 -1.25 0.00 0.00 -0.13 0.00 0.00 55.73 54.49 2kvm s ARG 22 Cb -0.10 -2.02 0.00 0.00 -1.56 0.00 0.00 34.95 31.27 2kvm s ARG 22 CO 0.07 -1.03 0.00 1.63 -0.81 0.00 0.00 175.30 175.16 2kvm n LYS 23 N 4.58 -0.67 0.00 5.12 5.02 -1.26 -0.65 118.16 130.30 2kvm n LYS 23 Ca 0.01 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2kvm n LYS 23 Cb 0.40 -4.51 0.00 0.00 -0.02 0.00 0.00 35.03 30.91 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 -1.03 1.25 3.57 0.72 0.00 -1.26 -5.08 105.19 103.36 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 2.93 0.40 1.61 1.02 0.17 -4.97 119.74 120.90 2kvm s LYS 25 Ca 0.00 0.74 -0.22 0.00 0.02 0.00 0.00 55.97 56.51 2kvm s LYS 25 Cb 0.00 -4.29 -0.11 0.00 -0.52 0.00 0.00 37.83 32.91 2kvm s LYS 25 CO 0.00 -2.37 0.94 0.08 -0.92 0.00 0.00 175.35 173.08 2kvm s VAL 26 N 7.94 4.35 0.04 3.17 1.01 -1.26 -0.28 120.40 135.38 2kvm s VAL 26 Ca 0.66 1.56 -0.01 0.00 0.00 0.00 0.00 61.98 64.19 2kvm s VAL 26 Cb -0.14 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2kvm s VAL 26 CO 0.24 -0.19 -0.02 -1.61 0.00 0.00 0.00 175.10 173.53 2kvm s GLU 27 N -2.86 0.56 -0.12 2.72 0.41 0.35 -1.45 118.70 118.31 2kvm s GLU 27 Ca 0.58 -1.07 -0.04 0.00 -0.41 0.00 0.00 54.97 54.04 2kvm s GLU 27 Cb -0.12 0.19 0.05 0.00 -1.78 0.00 0.00 34.13 32.48 2kvm s GLU 27 CO 0.16 -0.10 0.10 0.71 -0.49 0.00 0.00 175.26 175.64 2kvm s TYR 28 N -3.37 0.06 -1.02 1.61 2.02 -0.09 -1.19 117.35 115.37 2kvm s TYR 28 Ca 0.02 0.05 -0.25 0.00 -0.37 0.00 0.00 57.07 56.52 2kvm s TYR 28 Cb 0.04 -0.53 -0.13 0.00 -0.40 0.00 0.00 41.96 40.94 2kvm s TYR 28 CO -0.08 -0.38 2.08 -1.17 -1.57 0.00 0.00 175.55 174.43 2kvm s LEU 29 N 2.19 2.84 0.05 -1.29 1.98 0.01 -2.26 118.68 122.20 2kvm s LEU 29 Ca 0.04 -0.92 -0.31 0.00 -2.89 0.00 0.00 54.13 50.05 2kvm s LEU 29 Cb -0.14 -2.58 -0.06 0.00 0.66 0.00 0.00 46.19 44.07 2kvm s LEU 29 CO -0.07 -3.66 1.25 0.68 -1.89 0.00 0.00 176.35 172.67 2kvm s VAL 30 N 13.30 3.89 -0.46 1.68 -7.23 0.38 0.81 120.40 132.77 2kvm s VAL 30 Ca 0.77 1.34 -0.20 0.00 -1.81 0.00 0.00 61.98 62.08 2kvm s VAL 30 Cb -0.06 -3.86 0.04 0.00 0.56 0.00 0.00 36.38 33.06 2kvm s VAL 30 CO 0.11 0.08 0.62 -0.75 -0.31 0.00 0.00 175.10 174.85 2kvm s LYS 31 N 1.29 3.20 0.23 4.82 2.20 -0.91 -2.65 119.74 127.92 2kvm s LYS 31 Ca 0.60 -0.60 -0.30 0.00 -0.36 0.00 0.00 55.97 55.31 2kvm s LYS 31 Cb -0.31 -4.00 -0.09 0.00 -1.51 0.00 0.00 37.83 31.92 2kvm s LYS 31 CO 0.28 -1.07 1.37 -1.58 -0.36 0.00 0.00 175.35 173.99 2kvm s TRP 32 N 2.70 3.14 0.00 4.03 0.52 -1.26 0.34 118.94 128.41 2kvm s TRP 32 Ca 0.19 1.13 0.00 0.00 0.02 0.00 0.00 56.10 57.44 2kvm s TRP 32 Cb -0.16 -3.71 0.00 0.00 -1.15 0.00 0.00 33.47 28.45 2kvm s TRP 32 CO 0.16 -2.25 0.29 1.63 0.02 0.00 0.00 176.95 176.80 2kvm n LYS 33 N 2.45 0.00 -0.39 4.98 5.02 -1.01 -2.12 118.16 127.09 2kvm n LYS 33 Ca 0.06 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.59 2kvm n LYS 33 Cb 0.42 -0.79 0.00 0.00 -0.02 0.00 0.00 35.03 34.64 2kvm n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kvm n GLY 34 N -0.52 2.11 3.03 0.72 0.00 -1.26 -4.77 105.19 104.49 2kvm n GLY 34 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 0.36 0.17 0.62 1.61 0.52 -0.90 -5.17 118.94 116.15 2kvm s TRP 35 Ca 0.00 -0.36 -0.10 0.00 0.02 0.00 0.00 56.10 55.67 2kvm s TRP 35 Cb 0.00 -0.13 -0.02 0.00 -1.15 0.00 0.00 33.47 32.17 2kvm s TRP 35 CO 0.00 -0.22 1.00 -1.25 0.02 0.00 0.00 176.95 176.50 2kvm s PRO 36 N -1.39 3.32 0.52 4.98 0.04 -1.26 -4.56 135.00 136.65 2kvm s PRO 36 Ca -0.15 0.52 0.28 0.00 0.04 0.00 0.00 61.00 61.69 2kvm s PRO 36 Cb -0.09 -2.12 1.51 0.00 0.04 0.00 0.00 34.50 33.84 2kvm s PRO 36 CO 0.00 -0.66 1.83 -1.00 0.04 0.00 0.00 177.00 177.21 2kvm h PRO 37 N -0.32 0.00 0.00 0.56 0.13 -1.99 -0.80 132.00 129.58 2kvm h PRO 37 Ca -0.45 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 2kvm h PRO 37 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2kvm h PRO 37 CO 0.62 0.00 -0.28 0.87 -0.23 0.00 0.00 178.00 178.99 2kvm h LYS 38 N 0.00 0.00 -0.27 0.86 1.57 -2.01 -2.69 116.57 114.02 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 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2kvm h LYS 38 CO 0.00 0.28 0.00 0.66 -0.57 0.00 0.00 179.45 179.82 2kvm n TYR 39 N -3.73 0.34 -1.02 -1.35 4.02 -0.31 -5.00 117.16 110.11 2kvm n TYR 39 Ca -0.01 -0.18 -0.35 0.00 -0.01 0.00 0.00 57.90 57.35 2kvm n TYR 39 Cb 0.38 -0.00 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 1.33 -2.06 -4.05 7.72 7.64 -1.02 -4.91 113.62 118.28 2kvm n SER 40 Ca 0.17 0.43 -0.08 0.00 1.01 0.00 0.00 58.87 60.40 2kvm n SER 40 Cb 0.57 -1.17 -0.10 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 -2.15 0.23 -0.54 0.44 -4.23 -1.09 -4.98 115.64 103.33 2kvm s THR 41 Ca 0.59 -1.43 -0.17 0.00 -1.18 0.00 0.00 61.69 59.49 2kvm s THR 41 Cb -0.27 -1.00 0.10 0.00 1.34 0.00 0.00 72.50 72.67 2kvm s THR 41 CO 0.65 -0.76 0.57 0.26 -0.54 0.00 0.00 174.62 174.80 2kvm s TRP 42 N -2.81 3.13 -0.19 3.99 0.52 -1.26 -0.47 118.94 121.84 2kvm s TRP 42 Ca -0.02 -0.99 -0.06 0.00 0.02 0.00 0.00 56.10 55.05 2kvm s TRP 42 Cb -0.00 -3.72 -0.03 0.00 -1.15 0.00 0.00 33.47 28.57 2kvm s TRP 42 CO -0.06 -1.08 0.02 -1.21 0.02 0.00 0.00 176.95 174.64 2kvm s GLU 43 N 2.16 3.73 0.63 4.98 0.41 -0.96 -4.79 118.70 124.85 2kvm s GLU 43 Ca 0.08 -0.47 -0.17 0.00 -0.41 0.00 0.00 54.97 54.00 2kvm s GLU 43 Cb -0.25 -3.11 -0.06 0.00 -1.78 0.00 0.00 34.13 28.94 2kvm s GLU 43 CO 0.06 0.11 0.70 -2.30 -0.49 0.00 0.00 175.26 173.34 2kvm n PRO 44 N 3.97 0.58 0.26 0.39 -0.02 -1.26 -0.92 135.00 138.01 2kvm n PRO 44 Ca -0.17 0.24 0.15 0.00 -2.02 0.00 0.00 63.50 61.70 2kvm n PRO 44 Cb 0.52 -1.92 0.82 0.00 -0.02 0.00 0.00 33.50 32.90 2kvm n PRO 44 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2kvm h GLU 45 N 0.14 0.00 0.02 -0.52 4.22 -1.56 0.13 114.58 117.01 2kvm h GLU 45 Ca -0.47 0.00 -0.27 0.00 0.08 0.00 0.00 59.36 58.71 2kvm h GLU 45 Cb 1.37 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.59 2kvm h GLU 45 CO 0.47 0.00 -1.46 0.93 -2.18 0.00 0.00 179.01 176.77 2kvm h GLU 46 N 0.00 0.03 0.00 1.92 5.08 -1.87 -3.33 114.58 116.41 2kvm h GLU 46 Ca 0.00 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 2kvm h GLU 46 Cb 0.23 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2kvm h GLU 46 CO 0.00 0.75 -0.64 0.45 -1.00 0.00 0.00 179.01 178.57 2kvm h HIS 47 N 0.01 0.00 -1.28 4.33 3.86 -1.08 -3.43 115.15 117.56 2kvm h HIS 47 Ca -0.19 0.00 -0.40 0.00 -1.16 0.00 0.00 60.37 58.61 2kvm h HIS 47 Cb 1.93 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 30.40 2kvm h HIS 47 CO 0.01 0.64 1.45 -0.89 0.86 0.00 0.00 177.93 180.00 2kvm n ILE 48 N -3.38 -0.07 0.49 2.45 2.08 -0.85 -4.73 119.36 115.35 2kvm n ILE 48 Ca 0.01 -0.69 0.03 0.00 0.56 0.00 0.00 62.75 62.65 2kvm n ILE 48 Cb 0.74 -2.46 0.18 0.00 -0.75 0.00 0.00 39.64 37.35 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 15.72 0.00 -3.55 1.39 4.77 -1.26 -4.29 117.00 129.78 2kvm n LEU 49 Ca 0.41 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 56.16 2kvm n LEU 49 Cb 0.48 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.42 2kvm n LEU 49 CO 0.71 0.00 -0.28 -0.62 -1.33 0.00 0.00 177.39 175.88 2kvm s ASP 50 N -1.94 2.13 0.54 -1.43 2.15 -1.26 -5.00 116.67 111.86 2kvm s ASP 50 Ca 0.09 -0.58 0.29 0.00 0.43 0.00 0.00 52.55 52.78 2kvm s ASP 50 Cb 0.04 0.01 1.56 0.00 -0.30 0.00 0.00 42.92 44.23 2kvm s ASP 50 CO 0.07 -0.36 2.11 -0.65 -0.17 0.00 0.00 175.17 176.18 2kvm h PRO 51 N 8.37 0.00 -0.90 4.34 0.11 -1.96 -1.81 132.00 140.15 2kvm h PRO 51 Ca -0.16 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.03 2kvm h PRO 51 Cb 1.13 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.17 2kvm h PRO 51 CO 0.31 0.09 0.58 0.00 -0.21 0.00 0.00 178.00 178.77 2kvm h ARG 52 N 0.00 0.92 -0.88 1.05 2.47 -1.95 0.86 114.38 116.85 2kvm h ARG 52 Ca -0.00 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2kvm h ARG 52 Cb 0.27 -0.21 -0.04 0.00 -1.65 0.00 0.00 29.97 28.34 2kvm h ARG 52 CO 0.01 0.61 0.49 -0.07 0.56 0.00 0.00 179.97 181.58 2kvm h LEU 53 N 0.95 1.09 0.17 3.04 3.38 -1.74 -0.30 115.31 121.90 2kvm h LEU 53 Ca 0.41 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 2kvm h LEU 53 Cb 0.32 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2kvm h LEU 53 CO -0.17 0.87 -0.08 0.58 0.09 0.00 0.00 178.44 179.74 2kvm h VAL 54 N 1.23 0.00 -0.78 1.22 2.07 -0.75 -2.18 116.25 117.07 2kvm h VAL 54 Ca 0.31 -0.25 0.16 0.00 0.82 0.00 0.00 66.70 67.74 2kvm h VAL 54 Cb 0.01 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.64 2kvm h VAL 54 CO -0.05 0.00 -0.17 -0.03 0.02 0.00 0.00 177.57 177.34 2kvm h MET 55 N -0.47 0.01 -0.61 1.57 -1.53 0.52 0.53 114.93 114.95 2kvm h MET 55 Ca -0.02 -0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.23 2kvm h MET 55 Cb 0.17 -0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.19 2kvm h MET 55 CO 0.04 0.01 0.35 0.00 0.14 0.00 0.00 176.91 177.45 2kvm h ALA 56 N 1.77 1.47 0.60 0.39 0.00 -1.16 0.22 119.26 122.55 2kvm h ALA 56 Ca 0.38 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 2kvm h ALA 56 Cb 0.59 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.14 2kvm h ALA 56 CO -0.79 0.45 -0.29 -0.92 0.00 0.00 0.00 179.25 177.70 2kvm h TYR 57 N 0.85 -0.75 0.00 0.00 3.20 0.69 0.15 116.97 121.10 2kvm h TYR 57 Ca 0.22 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.07 2kvm h TYR 57 Cb -0.01 0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.51 2kvm h TYR 57 CO 0.00 -0.46 0.00 -0.85 -1.64 0.00 0.00 178.16 175.21 2kvm n GLU 58 N -5.43 0.07 0.06 1.82 0.28 -0.37 -1.89 120.64 115.18 2kvm n GLU 58 Ca -0.13 0.23 -0.18 0.00 -0.16 0.00 0.00 57.16 56.92 2kvm n GLU 58 Cb 0.33 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.56 2kvm n GLU 58 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2kvm h GLU 59 N 0.00 0.27 -0.36 3.44 4.81 0.84 -2.83 114.58 120.75 2kvm h GLU 59 Ca 0.00 -0.46 -0.06 0.00 -0.13 0.00 0.00 59.36 58.71 2kvm h GLU 59 Cb 0.20 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2kvm h GLU 59 CO 0.00 1.13 -0.00 0.87 -0.73 0.00 0.00 179.01 180.28 2kvm h LYS 60 N 0.07 0.63 -0.09 1.92 1.57 -0.05 -2.58 116.57 118.04 2kvm h LYS 60 Ca -0.28 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2kvm h LYS 60 Cb 2.04 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 34.28 2kvm h LYS 60 CO 0.16 0.74 0.05 1.05 -0.57 0.00 0.00 179.45 180.88 2kvm h GLU 61 N 0.44 0.13 -0.13 3.15 4.11 -1.63 -0.48 114.58 120.17 2kvm h GLU 61 Ca 0.10 -0.02 0.02 0.00 0.07 0.00 0.00 59.36 59.53 2kvm h GLU 61 Cb 0.46 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 2kvm h GLU 61 CO 0.02 0.20 -0.23 0.93 0.07 0.00 0.00 179.01 180.00 2kvm h GLU 62 N 0.03 -0.18 -0.09 1.06 5.08 -1.41 1.93 114.58 121.01 2kvm h GLU 62 Ca 0.03 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2kvm h GLU 62 Cb 0.11 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 2kvm h GLU 62 CO -0.00 -0.12 0.09 -0.09 -1.00 0.00 0.00 179.01 177.89 2kvm h ARG 63 N -0.18 0.00 0.00 2.33 2.43 -1.45 -0.35 114.38 117.15 2kvm h ARG 63 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2kvm h ARG 63 Cb 0.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2kvm h ARG 63 CO -0.22 0.00 -0.23 -3.47 -1.51 0.00 0.00 179.97 174.54 2kvm n ASP 64 N -3.93 0.51 -0.05 -3.80 2.03 -0.13 -4.16 116.55 107.02 2kvm n ASP 64 Ca -0.01 0.17 -0.15 0.00 0.52 0.00 0.00 54.79 55.33 2kvm n ASP 64 Cb 0.19 -0.58 -0.07 0.00 -0.72 0.00 0.00 41.12 39.94 2kvm n ASP 64 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 2kvm h ARG 65 N -0.27 0.50 0.00 -0.67 0.11 0.28 -3.08 114.38 111.26 2kvm h ARG 65 Ca 0.00 -0.34 0.00 0.00 0.10 0.00 0.00 59.98 59.74 2kvm h ARG 65 Cb 0.23 0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.35 2kvm h ARG 65 CO 0.00 0.95 0.00 0.00 0.10 0.00 0.00 179.97 181.02 2kvm n ALA 66 N -2.50 2.49 -3.37 0.08 0.00 -0.20 -4.64 120.51 112.37 2kvm n ALA 66 Ca -0.07 -0.15 0.02 0.00 0.00 0.00 0.00 53.44 53.25 2kvm n ALA 66 Cb 0.51 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 2kvm n ALA 66 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2kvm s SER 67 N -1.88 -0.68 0.00 0.00 1.04 -0.82 -4.91 113.70 106.46 2kvm s SER 67 Ca 0.35 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.58 2kvm s SER 67 Cb 0.16 1.72 0.00 0.00 0.10 0.00 0.00 66.02 68.00 2kvm s SER 67 CO 0.27 -0.13 0.09 0.61 0.98 0.00 0.00 173.24 175.06 2kvm n GLY 68 N 5.14 -0.01 3.22 7.32 0.00 -1.24 -3.74 105.19 115.87 2kvm n GLY 68 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.17 3.49 0.00 1.61 6.14 -1.26 -4.90 117.35 122.26 2kvm s TYR 69 Ca 0.00 -2.07 0.00 0.00 0.64 0.00 0.00 57.07 55.64 2kvm s TYR 69 Cb 0.00 -3.52 0.00 0.00 0.42 0.00 0.00 41.96 38.86 2kvm s TYR 69 CO 0.00 -0.96 0.00 -2.13 0.64 0.00 0.00 175.55 173.10 2kvm n ARG 70 N 4.38 0.00 0.00 4.97 3.00 -1.26 -5.26 116.66 122.49 2kvm n ARG 70 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.85 57.92 2kvm n ARG 70 Cb 0.41 0.00 0.05 0.00 0.00 0.00 0.00 32.46 32.93 2kvm n ARG 70 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80