#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 -3.05 -3.17 0.03 1.02 -1.26 -4.95 120.64 109.25 2kvm n GLU 2 Ca 0.00 2.16 -0.11 0.00 -0.02 0.00 0.00 57.16 59.19 2kvm n GLU 2 Cb 0.00 -3.67 0.01 0.00 -0.02 0.00 0.00 31.44 27.76 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 -4.29 -5.83 0.13 -4.62 7.94 -1.26 -4.92 117.00 104.14 2kvm n LEU 3 Ca -0.02 -0.05 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 2kvm n LEU 3 Cb 0.67 -2.87 0.00 0.00 0.53 0.00 0.00 43.42 41.75 2kvm n LEU 3 CO 0.02 -1.11 0.00 -0.24 -1.11 0.00 0.00 177.39 174.95 2kvm n SER 4 N -1.31 -2.23 -0.04 1.96 2.88 -1.26 -4.96 113.62 108.67 2kvm n SER 4 Ca -0.03 0.50 -0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2kvm n SER 4 Cb 0.54 2.27 -0.10 0.00 -0.75 0.00 0.00 64.21 66.18 2kvm n SER 4 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kvm n ALA 5 N -3.04 2.05 -1.68 -1.46 0.00 -1.26 -4.99 120.51 110.13 2kvm n ALA 5 Ca 0.00 -0.58 -0.47 0.00 0.00 0.00 0.00 53.44 52.40 2kvm n ALA 5 Cb 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 19.45 19.21 2kvm n ALA 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2kvm n ILE 6 N -2.23 0.36 -3.92 0.00 5.41 -1.26 -4.95 119.36 112.78 2kvm n ILE 6 Ca -0.12 -0.06 -0.31 0.00 1.00 0.00 0.00 62.75 63.26 2kvm n ILE 6 Cb 0.65 -1.80 -0.13 0.00 -0.71 0.00 0.00 39.64 37.64 2kvm n ILE 6 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2kvm s GLY 7 N 2.82 2.44 0.07 7.39 0.00 -1.26 -4.96 107.32 113.83 2kvm s GLY 7 Ca 0.86 -3.26 -0.37 0.00 0.00 0.00 0.00 44.72 41.96 2kvm s GLY 7 CO 0.45 1.02 1.34 1.18 0.00 0.00 0.00 173.10 177.09 2kvm n GLU 8 N 3.19 1.08 0.15 2.90 1.02 -1.26 -4.80 120.64 122.92 2kvm n GLU 8 Ca 0.05 0.39 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 2kvm n GLU 8 Cb 0.33 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 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 2.55 0.00 -3.51 3.49 10.64 -1.26 -5.17 117.38 124.13 2kvm n GLN 9 Ca 0.19 0.00 -0.11 0.00 -1.83 0.00 0.00 57.00 55.24 2kvm n GLN 9 Cb 0.18 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.54 2kvm n GLN 9 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 2kvm s VAL 10 N -1.84 0.01 0.00 -0.39 1.01 -1.26 -5.03 120.40 112.90 2kvm s VAL 10 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 61.76 2kvm s VAL 10 Cb 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.25 2kvm s VAL 10 CO 0.00 -0.06 0.00 0.33 0.00 0.00 0.00 175.10 175.37 2kvm n PHE 11 N -0.36 0.00 -3.34 5.22 -0.00 -1.26 -5.16 117.46 112.57 2kvm n PHE 11 Ca -0.16 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.22 2kvm n PHE 11 Cb 0.64 0.00 -0.07 0.00 -0.00 0.00 0.00 39.48 40.05 2kvm n PHE 11 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2kvm s ALA 12 N -1.37 -1.24 -0.19 3.13 0.00 -1.26 -5.13 121.76 115.70 2kvm s ALA 12 Ca 0.00 1.05 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 2kvm s ALA 12 Cb 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 2kvm s ALA 12 CO 0.00 -1.25 0.07 0.08 0.00 0.00 0.00 175.76 174.66 2kvm s VAL 13 N 2.59 4.88 0.11 0.00 1.01 -1.26 -1.82 120.40 125.91 2kvm s VAL 13 Ca 0.13 -0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.95 2kvm s VAL 13 Cb -0.15 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 2kvm s VAL 13 CO -0.16 0.45 1.58 -0.33 0.00 0.00 0.00 175.10 176.64 2kvm h GLU 14 N 6.75 0.60 0.00 2.72 4.39 0.08 -3.45 114.58 125.68 2kvm h GLU 14 Ca -0.37 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.15 2kvm h GLU 14 Cb 1.17 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 2kvm h GLU 14 CO 0.71 0.69 0.00 0.45 -1.16 0.00 0.00 179.01 179.69 2kvm n SER 15 N -4.55 0.00 -4.71 1.42 2.88 -1.11 -5.03 113.62 102.52 2kvm n SER 15 Ca -0.01 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.20 2kvm n SER 15 Cb 0.24 0.00 0.12 0.00 -0.75 0.00 0.00 64.21 63.82 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 2.45 0.00 2.46 1.01 -1.26 -1.16 121.20 122.70 2kvm s ILE 16 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.82 2kvm s ILE 16 Cb 0.00 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.97 2kvm s ILE 16 CO 0.00 -0.16 0.00 0.54 0.00 0.00 0.00 174.94 175.32 2kvm n ARG 17 N -3.47 0.00 -4.26 2.79 1.74 0.28 -4.73 116.66 109.01 2kvm n ARG 17 Ca 0.12 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 57.04 2kvm n ARG 17 Cb 0.52 -0.73 -0.09 0.00 -1.02 0.00 0.00 32.46 31.13 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 -1.90 1.43 -0.08 5.56 1.02 -1.08 -4.92 119.74 119.78 2kvm s LYS 18 Ca 0.00 -1.79 -0.06 0.00 0.02 0.00 0.00 55.97 54.14 2kvm s LYS 18 Cb 0.00 0.18 0.03 0.00 -0.52 0.00 0.00 37.83 37.52 2kvm s LYS 18 CO 0.00 -0.46 0.20 0.21 -0.92 0.00 0.00 175.35 174.38 2kvm s LYS 19 N -3.90 0.20 -0.00 1.68 2.20 -1.26 -0.49 119.74 118.16 2kvm s LYS 19 Ca 0.39 0.36 -0.00 0.00 -0.36 0.00 0.00 55.97 56.35 2kvm s LYS 19 Cb 0.05 -0.01 -0.00 0.00 -1.51 0.00 0.00 37.83 36.37 2kvm s LYS 19 CO 0.17 -0.09 0.01 -0.98 -0.36 0.00 0.00 175.35 174.10 2kvm s ARG 20 N 0.62 0.07 0.10 4.03 1.70 -0.65 -4.96 118.95 119.85 2kvm s ARG 20 Ca -0.04 -0.09 0.07 0.00 -0.47 0.00 0.00 55.73 55.20 2kvm s ARG 20 Cb -0.06 0.03 -0.03 0.00 -0.57 0.00 0.00 34.95 34.31 2kvm s ARG 20 CO -0.03 -0.01 -0.18 0.08 -1.08 0.00 0.00 175.30 174.08 2kvm s VAL 21 N -0.24 1.51 -0.33 4.99 1.01 -1.25 0.12 120.40 126.21 2kvm s VAL 21 Ca -0.03 -1.53 -0.01 0.00 0.00 0.00 0.00 61.98 60.42 2kvm s VAL 21 Cb -0.02 -1.44 0.11 0.00 0.00 0.00 0.00 36.38 35.03 2kvm s VAL 21 CO -0.00 -0.17 0.13 -0.60 0.00 0.00 0.00 175.10 174.46 2kvm s ARG 22 N -2.02 0.69 0.00 2.72 3.52 0.39 -4.78 118.95 119.47 2kvm s ARG 22 Ca 0.05 -1.14 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 2kvm s ARG 22 Cb -0.09 -1.83 0.00 0.00 -1.56 0.00 0.00 34.95 31.47 2kvm s ARG 22 CO 0.04 -1.04 0.00 1.63 -0.81 0.00 0.00 175.30 175.12 2kvm n LYS 23 N 4.65 -0.76 0.00 5.12 5.02 -1.26 -0.83 118.16 130.10 2kvm n LYS 23 Ca 0.00 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2kvm n LYS 23 Cb 0.40 -4.56 0.00 0.00 -0.02 0.00 0.00 35.03 30.85 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 -0.88 1.24 3.57 0.72 0.00 -1.26 -5.08 105.19 103.49 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 2.79 0.40 1.61 1.02 -0.01 -4.96 119.74 120.59 2kvm s LYS 25 Ca 0.00 0.98 -0.17 0.00 0.02 0.00 0.00 55.97 56.80 2kvm s LYS 25 Cb 0.00 -4.35 -0.09 0.00 -0.52 0.00 0.00 37.83 32.87 2kvm s LYS 25 CO 0.00 -2.52 0.86 0.08 -0.92 0.00 0.00 175.35 172.84 2kvm s VAL 26 N 8.78 4.56 0.06 3.17 1.01 -1.26 -0.47 120.40 136.26 2kvm s VAL 26 Ca 0.75 1.15 -0.04 0.00 0.00 0.00 0.00 61.98 63.84 2kvm s VAL 26 Cb -0.16 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2kvm s VAL 26 CO 0.25 -0.35 0.05 -1.61 0.00 0.00 0.00 175.10 173.44 2kvm s GLU 27 N -3.32 0.69 -0.16 2.72 0.41 0.33 -1.79 118.70 117.57 2kvm s GLU 27 Ca 0.57 -1.11 -0.04 0.00 -0.41 0.00 0.00 54.97 53.99 2kvm s GLU 27 Cb -0.10 0.26 0.07 0.00 -1.78 0.00 0.00 34.13 32.58 2kvm s GLU 27 CO 0.19 -0.17 0.18 0.71 -0.49 0.00 0.00 175.26 175.69 2kvm s TYR 28 N -3.83 -0.15 -0.88 1.61 2.02 0.17 -1.64 117.35 114.64 2kvm s TYR 28 Ca 0.06 0.22 -0.25 0.00 -0.37 0.00 0.00 57.07 56.72 2kvm s TYR 28 Cb 0.06 -0.40 -0.10 0.00 -0.40 0.00 0.00 41.96 41.12 2kvm s TYR 28 CO -0.10 -0.50 2.16 -1.17 -1.57 0.00 0.00 175.55 174.37 2kvm s LEU 29 N 2.28 2.97 0.14 -1.29 1.98 0.35 -2.12 118.68 122.99 2kvm s LEU 29 Ca 0.05 -0.44 -0.30 0.00 -2.89 0.00 0.00 54.13 50.55 2kvm s LEU 29 Cb -0.15 -2.56 -0.07 0.00 0.66 0.00 0.00 46.19 44.08 2kvm s LEU 29 CO -0.10 -3.40 0.98 0.68 -1.89 0.00 0.00 176.35 172.63 2kvm s VAL 30 N 12.67 4.33 -0.39 1.68 -7.23 0.30 1.00 120.40 132.76 2kvm s VAL 30 Ca 0.81 2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 62.80 2kvm s VAL 30 Cb -0.09 -4.27 0.01 0.00 0.56 0.00 0.00 36.38 32.59 2kvm s VAL 30 CO 0.05 0.33 0.46 -0.75 -0.31 0.00 0.00 175.10 174.89 2kvm s LYS 31 N -0.21 3.33 0.38 4.82 2.20 -0.31 -2.67 119.74 127.28 2kvm s LYS 31 Ca 0.47 -0.51 -0.24 0.00 -0.36 0.00 0.00 55.97 55.32 2kvm s LYS 31 Cb -0.25 -3.90 -0.10 0.00 -1.51 0.00 0.00 37.83 32.08 2kvm s LYS 31 CO 0.31 -0.76 0.99 -1.58 -0.36 0.00 0.00 175.35 173.96 2kvm s TRP 32 N 2.25 3.42 0.29 4.03 0.52 -1.26 0.75 118.94 128.94 2kvm s TRP 32 Ca 0.15 1.69 -0.29 0.00 0.02 0.00 0.00 56.10 57.66 2kvm s TRP 32 Cb -0.16 -3.01 -0.10 0.00 -1.15 0.00 0.00 33.47 29.05 2kvm s TRP 32 CO 0.14 -0.24 1.37 0.15 0.02 0.00 0.00 176.95 178.39 2kvm s LYS 33 N -2.46 4.31 0.00 4.98 1.02 -0.75 -2.33 119.74 124.50 2kvm s LYS 33 Ca 0.56 2.26 0.00 0.00 0.02 0.00 0.00 55.97 58.81 2kvm s LYS 33 Cb -0.19 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 34.03 2kvm s LYS 33 CO 0.24 -0.31 0.00 0.41 -0.92 0.00 0.00 175.35 174.77 2kvm n GLY 34 N 1.48 0.53 3.77 -3.33 0.00 -1.26 -4.94 105.19 101.45 2kvm n GLY 34 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.71 3.24 0.72 1.61 0.52 -0.99 -5.11 118.94 117.22 2kvm s TRP 35 Ca 0.00 0.16 -0.11 0.00 0.02 0.00 0.00 56.10 56.17 2kvm s TRP 35 Cb 0.00 -1.70 0.02 0.00 -1.15 0.00 0.00 33.47 30.64 2kvm s TRP 35 CO 0.00 0.53 1.07 -2.14 0.02 0.00 0.00 176.95 176.43 2kvm s PRO 36 N -1.93 2.74 0.46 4.98 0.02 -1.26 -4.60 135.00 135.40 2kvm s PRO 36 Ca 0.25 0.95 0.31 0.00 0.02 0.00 0.00 61.00 62.53 2kvm s PRO 36 Cb -0.12 -1.97 1.62 0.00 0.02 0.00 0.00 34.50 34.05 2kvm s PRO 36 CO 0.16 -1.24 1.95 -1.00 -0.33 0.00 0.00 177.00 176.55 2kvm h PRO 37 N -0.82 0.00 0.00 5.54 0.13 -1.99 -1.05 132.00 133.81 2kvm h PRO 37 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 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 0.56 0.00 -0.28 0.87 -0.23 0.00 0.00 178.00 178.93 2kvm h LYS 38 N 0.00 0.00 -0.49 0.86 1.57 -2.01 -2.71 116.57 113.78 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 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 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 -3.55 0.65 -0.89 -1.35 4.02 -0.40 -4.99 117.16 110.65 2kvm n TYR 39 Ca -0.01 -0.34 -0.33 0.00 -0.01 0.00 0.00 57.90 57.21 2kvm n TYR 39 Cb 0.42 -0.00 0.12 0.00 -0.02 0.00 0.00 39.34 39.86 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 1.47 -1.44 -4.11 7.72 7.64 -1.03 -4.90 113.62 118.97 2kvm n SER 40 Ca 0.20 0.41 -0.10 0.00 1.01 0.00 0.00 58.87 60.39 2kvm n SER 40 Cb 0.59 -1.26 -0.10 0.00 -1.01 0.00 0.00 64.21 62.43 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 -2.31 0.50 -0.56 0.44 -4.23 -1.09 -4.97 115.64 103.42 2kvm s THR 41 Ca 0.61 -1.66 -0.17 0.00 -1.18 0.00 0.00 61.69 59.29 2kvm s THR 41 Cb -0.24 -1.32 0.12 0.00 1.34 0.00 0.00 72.50 72.40 2kvm s THR 41 CO 0.63 -0.78 0.59 0.26 -0.54 0.00 0.00 174.62 174.79 2kvm s TRP 42 N -3.08 3.14 -0.24 3.99 0.52 -1.26 -0.54 118.94 121.46 2kvm s TRP 42 Ca 0.04 -1.15 -0.09 0.00 0.02 0.00 0.00 56.10 54.93 2kvm s TRP 42 Cb 0.02 -3.90 -0.04 0.00 -1.15 0.00 0.00 33.47 28.40 2kvm s TRP 42 CO -0.05 -1.14 0.11 -1.21 0.02 0.00 0.00 176.95 174.68 2kvm s GLU 43 N 2.08 3.86 0.57 4.98 0.41 -0.90 -4.76 118.70 124.93 2kvm s GLU 43 Ca 0.07 -0.38 -0.19 0.00 -0.41 0.00 0.00 54.97 54.06 2kvm s GLU 43 Cb -0.27 -3.41 -0.06 0.00 -1.78 0.00 0.00 34.13 28.60 2kvm s GLU 43 CO 0.04 -0.05 0.89 -2.30 -0.49 0.00 0.00 175.26 173.35 2kvm n PRO 44 N 4.56 0.89 0.22 0.39 -0.02 -1.26 -0.66 135.00 139.12 2kvm n PRO 44 Ca -0.16 0.34 0.11 0.00 -2.02 0.00 0.00 63.50 61.78 2kvm n PRO 44 Cb 0.52 -2.06 0.59 0.00 -0.02 0.00 0.00 33.50 32.53 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 0.61 0.00 0.13 -0.52 4.22 -1.65 0.41 114.58 117.77 2kvm h GLU 45 Ca -0.47 0.00 -0.30 0.00 0.08 0.00 0.00 59.36 58.67 2kvm h GLU 45 Cb 1.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 2kvm h GLU 45 CO 0.51 0.00 -1.46 0.93 -2.18 0.00 0.00 179.01 176.81 2kvm h GLU 46 N 0.00 0.27 -0.08 1.92 5.08 -1.87 -3.33 114.58 116.59 2kvm h GLU 46 Ca 0.00 -0.47 -0.18 0.00 -1.00 0.00 0.00 59.36 57.71 2kvm h GLU 46 Cb 0.42 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2kvm h GLU 46 CO 0.00 1.16 -0.72 0.45 -1.00 0.00 0.00 179.01 178.90 2kvm h HIS 47 N 0.07 0.52 -1.23 4.33 3.86 -0.54 -3.43 115.15 118.75 2kvm h HIS 47 Ca -0.22 -0.23 -0.53 0.00 -1.16 0.00 0.00 60.37 58.22 2kvm h HIS 47 Cb 2.02 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 30.39 2kvm h HIS 47 CO 0.07 0.98 1.59 -0.89 0.86 0.00 0.00 177.93 180.54 2kvm n ILE 48 N -3.84 0.05 1.50 2.45 2.08 -0.69 -4.74 119.36 116.17 2kvm n ILE 48 Ca -0.04 -0.48 0.09 0.00 0.56 0.00 0.00 62.75 62.88 2kvm n ILE 48 Cb 0.70 -2.07 0.54 0.00 -0.75 0.00 0.00 39.64 38.06 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 12.95 0.00 -3.60 1.39 4.77 -1.26 -4.52 117.00 126.74 2kvm n LEU 49 Ca 0.43 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 56.15 2kvm n LEU 49 Cb 0.36 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.29 2kvm n LEU 49 CO 0.76 0.00 -0.32 -0.62 -1.33 0.00 0.00 177.39 175.88 2kvm s ASP 50 N -1.82 2.44 0.58 -1.43 -1.08 -1.26 -4.99 116.67 109.11 2kvm s ASP 50 Ca 0.27 -0.68 0.37 0.00 -0.52 0.00 0.00 52.55 52.00 2kvm s ASP 50 Cb 0.12 -0.22 1.77 0.00 -1.46 0.00 0.00 42.92 43.14 2kvm s ASP 50 CO 0.21 -0.36 2.12 -0.65 0.52 0.00 0.00 175.17 177.01 2kvm h PRO 51 N 8.41 0.00 -0.37 4.34 0.11 -1.97 -1.92 132.00 140.60 2kvm h PRO 51 Ca -0.16 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.95 2kvm h PRO 51 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2kvm h PRO 51 CO 0.31 0.00 0.21 0.00 -0.21 0.00 0.00 178.00 178.31 2kvm h ARG 52 N 0.00 0.49 -0.06 1.05 -0.00 -1.97 0.40 114.38 114.29 2kvm h ARG 52 Ca 0.00 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.98 59.43 2kvm h ARG 52 Cb 0.29 -0.11 -0.00 0.00 0.00 0.00 0.00 29.97 30.15 2kvm h ARG 52 CO 0.00 0.35 -0.00 -0.07 0.00 0.00 0.00 179.97 180.25 2kvm h LEU 53 N 0.50 0.11 0.58 3.04 3.38 -1.77 -1.05 115.31 120.10 2kvm h LEU 53 Ca 0.13 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2kvm h LEU 53 Cb -0.01 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2kvm h LEU 53 CO -0.02 0.41 -0.35 0.58 0.09 0.00 0.00 178.44 179.14 2kvm h VAL 54 N -0.19 0.28 0.03 1.22 2.07 -1.35 -0.31 116.25 118.01 2kvm h VAL 54 Ca 0.02 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.56 2kvm h VAL 54 Cb 0.35 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 2kvm h VAL 54 CO 0.00 0.00 -0.54 -0.03 0.02 0.00 0.00 177.57 177.03 2kvm h MET 55 N -0.88 -0.67 -1.02 1.57 1.85 -0.29 -0.55 114.93 114.94 2kvm h MET 55 Ca -0.07 0.05 0.26 0.00 -0.61 0.00 0.00 59.70 59.33 2kvm h MET 55 Cb 0.71 0.15 -0.12 0.00 0.43 0.00 0.00 31.60 32.77 2kvm h MET 55 CO 0.08 -0.45 0.61 0.00 -0.40 0.00 0.00 176.91 176.74 2kvm h ALA 56 N -0.46 1.89 0.16 0.39 0.00 -1.13 0.97 119.26 121.08 2kvm h ALA 56 Ca 0.01 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2kvm h ALA 56 Cb 0.73 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2kvm h ALA 56 CO -0.34 -0.38 -0.17 -0.92 0.00 0.00 0.00 179.25 177.44 2kvm h TYR 57 N 0.51 -0.44 0.00 0.00 3.20 0.51 0.58 116.97 121.33 2kvm h TYR 57 Ca 0.65 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.53 2kvm h TYR 57 Cb 1.35 0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.79 2kvm h TYR 57 CO -0.01 -0.26 0.00 0.39 -1.64 0.00 0.00 178.16 176.65 2kvm n GLU 58 N -5.29 0.14 0.09 1.82 -0.58 0.12 -2.15 120.64 114.78 2kvm n GLU 58 Ca -0.08 0.47 -0.21 0.00 -0.42 0.00 0.00 57.16 56.92 2kvm n GLU 58 Cb 0.21 -1.82 -0.15 0.00 -0.57 0.00 0.00 31.44 29.11 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 0.37 -0.30 3.49 4.81 0.10 -2.68 114.58 120.37 2kvm h GLU 59 Ca 0.00 -0.64 -0.16 0.00 -0.13 0.00 0.00 59.36 58.44 2kvm h GLU 59 Cb 0.22 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 2kvm h GLU 59 CO 0.00 1.27 -0.42 0.87 -0.73 0.00 0.00 179.01 180.00 2kvm h LYS 60 N 0.10 0.82 -0.07 1.92 1.57 -0.46 -2.24 116.57 118.22 2kvm h LYS 60 Ca -0.28 -0.48 -0.02 0.00 -1.87 0.00 0.00 60.65 58.00 2kvm h LYS 60 Cb 2.08 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 34.43 2kvm h LYS 60 CO 0.20 1.11 -0.04 1.05 -0.57 0.00 0.00 179.45 181.20 2kvm h GLU 61 N 0.59 0.14 -0.90 3.15 4.11 -1.60 -1.95 114.58 118.13 2kvm h GLU 61 Ca 0.03 -0.07 0.02 0.00 0.07 0.00 0.00 59.36 59.41 2kvm h GLU 61 Cb 1.02 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.22 2kvm h GLU 61 CO 0.10 0.53 0.59 1.05 0.07 0.00 0.00 179.01 181.36 2kvm h GLU 62 N -0.25 1.16 -0.30 1.06 4.11 -1.53 0.42 114.58 119.25 2kvm h GLU 62 Ca 0.01 -0.07 -0.05 0.00 0.07 0.00 0.00 59.36 59.32 2kvm h GLU 62 Cb 0.49 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2kvm h GLU 62 CO 0.01 0.76 -0.01 -0.09 0.07 0.00 0.00 179.01 179.75 2kvm h ARG 63 N 1.19 0.54 0.19 1.06 2.43 -1.36 -1.84 114.38 116.60 2kvm h ARG 63 Ca 0.34 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2kvm h ARG 63 Cb -0.10 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 2kvm h ARG 63 CO -0.08 0.69 -0.09 0.22 -1.51 0.00 0.00 179.97 179.20 2kvm h ASP 64 N 0.33 -0.22 -0.50 -3.80 3.58 -0.99 -3.29 116.42 111.54 2kvm h ASP 64 Ca 0.08 0.01 0.14 0.00 0.42 0.00 0.00 57.03 57.69 2kvm h ASP 64 Cb 0.46 0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 2kvm h ASP 64 CO 0.02 0.20 0.58 0.03 -2.88 0.00 0.00 179.24 177.19 2kvm h ARG 65 N -0.98 0.00 -0.56 0.28 3.08 -0.29 -2.20 114.38 113.71 2kvm h ARG 65 Ca -0.03 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.13 2kvm h ARG 65 Cb 0.20 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.14 2kvm h ARG 65 CO 0.04 0.00 -0.27 0.00 -1.07 0.00 0.00 179.97 178.67 2kvm h ALA 66 N 1.31 0.08 0.00 0.04 0.00 -1.39 -3.45 119.26 115.85 2kvm h ALA 66 Ca 0.24 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2kvm h ALA 66 Cb 1.40 0.66 0.00 0.00 0.00 0.00 0.00 17.79 19.85 2kvm h ALA 66 CO -0.00 -0.60 0.00 0.45 0.00 0.00 0.00 179.25 179.10 2kvm n SER 67 N -5.43 -4.12 -3.76 0.00 2.88 -0.83 -5.12 113.62 97.24 2kvm n SER 67 Ca 0.05 0.92 -0.19 0.00 -1.33 0.00 0.00 58.87 58.32 2kvm n SER 67 Cb 0.34 3.84 -0.09 0.00 -0.75 0.00 0.00 64.21 67.56 2kvm n SER 67 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2kvm s GLY 68 N -2.00 2.13 0.70 0.46 0.00 -1.19 -5.08 107.32 102.33 2kvm s GLY 68 Ca 0.00 -1.84 -0.14 0.00 0.00 0.00 0.00 44.72 42.74 2kvm s GLY 68 CO 0.00 -1.53 1.12 -2.52 0.00 0.00 0.00 173.10 170.17 2kvm s TYR 69 N -3.59 2.51 0.00 1.90 1.13 -1.26 -4.36 117.35 113.68 2kvm s TYR 69 Ca 0.37 1.57 0.00 0.00 -1.41 0.00 0.00 57.07 57.60 2kvm s TYR 69 Cb 0.04 -3.19 0.00 0.00 -1.10 0.00 0.00 41.96 37.71 2kvm s TYR 69 CO 0.21 -1.85 0.00 -2.13 -2.51 0.00 0.00 175.55 169.27 2kvm n ARG 70 N -2.70 0.00 0.00 -3.49 0.00 -1.26 -5.03 116.66 104.18 2kvm n ARG 70 Ca 0.11 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 58.06 2kvm n ARG 70 Cb 0.52 0.00 0.09 0.00 0.00 0.00 0.00 32.46 33.06 2kvm n ARG 70 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80