#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 -2.97 -1.65 2.12 4.71 -1.26 -4.74 120.64 116.85 2kvm n GLU 2 Ca 0.00 2.42 -0.49 0.00 -0.01 0.00 0.00 57.16 59.08 2kvm n GLU 2 Cb 0.00 -3.60 -0.05 0.00 -1.01 0.00 0.00 31.44 26.78 2kvm n GLU 2 CO 0.00 0.00 0.00 1.47 0.09 0.00 0.00 177.13 178.69 2kvm n LEU 3 N 1.60 3.17 -3.78 -4.62 -0.00 -1.26 -4.95 117.00 107.16 2kvm n LEU 3 Ca -0.17 0.84 -0.13 0.00 -0.00 0.00 0.00 56.01 56.56 2kvm n LEU 3 Cb 0.33 -1.35 -0.10 0.00 -0.00 0.00 0.00 43.42 42.30 2kvm n LEU 3 CO 0.27 -0.23 -0.04 -0.94 -0.00 0.00 0.00 177.39 176.45 2kvm s SER 4 N 4.86 -0.23 0.00 1.45 1.04 -1.26 -4.88 113.70 114.68 2kvm s SER 4 Ca 0.96 0.34 0.00 0.00 0.48 0.00 0.00 55.95 57.73 2kvm s SER 4 Cb -0.72 0.46 0.00 0.00 0.10 0.00 0.00 66.02 65.87 2kvm s SER 4 CO 0.51 -0.23 0.00 0.00 0.98 0.00 0.00 173.24 174.50 2kvm n ALA 5 N 2.26 0.00 0.12 5.32 0.00 -1.26 -4.78 120.51 122.17 2kvm n ALA 5 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.15 2kvm n ALA 5 Cb 0.57 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.95 2kvm n ALA 5 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2kvm h ILE 6 N 0.00 0.00 0.00 0.00 1.08 -1.98 -3.45 117.51 113.16 2kvm h ILE 6 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2kvm h ILE 6 Cb 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.75 2kvm h ILE 6 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.07 2kvm n GLY 7 N -1.37 2.12 3.47 5.37 0.00 -1.26 -4.82 105.19 108.70 2kvm n GLY 7 Ca -0.07 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 2kvm n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kvm s GLU 8 N 0.00 1.80 0.00 1.61 2.02 -1.26 -5.06 118.70 117.81 2kvm s GLU 8 Ca 0.00 -2.07 0.00 0.00 0.02 0.00 0.00 54.97 52.92 2kvm s GLU 8 Cb 0.00 -0.58 0.00 0.00 0.10 0.00 0.00 34.13 33.65 2kvm s GLU 8 CO 0.00 -0.40 0.00 0.00 0.02 0.00 0.00 175.26 174.88 2kvm n GLN 9 N -0.80 0.00 -1.24 1.61 10.64 -1.26 -5.17 117.38 121.16 2kvm n GLN 9 Ca -0.04 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.13 2kvm n GLN 9 Cb 0.65 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.03 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 -1.57 -3.86 0.00 -0.39 0.31 -1.26 -5.09 118.33 106.46 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 -2.42 0.00 0.00 -0.91 0.00 0.00 33.84 30.51 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 -1.27 0.00 -3.18 3.52 3.72 -1.26 -5.15 117.46 113.83 2kvm n PHE 11 Ca 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 2kvm n PHE 11 Cb 0.09 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.61 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 -3.00 -0.24 4.37 0.00 -1.26 -5.12 121.76 114.51 2kvm s ALA 12 Ca 0.00 1.63 -0.19 0.00 0.00 0.00 0.00 51.96 53.40 2kvm s ALA 12 Cb 0.00 -2.35 -0.02 0.00 0.00 0.00 0.00 23.12 20.75 2kvm s ALA 12 CO 0.00 -1.36 0.58 0.08 0.00 0.00 0.00 175.76 175.05 2kvm s VAL 13 N 2.88 5.03 0.23 0.00 1.01 -1.26 -1.28 120.40 127.00 2kvm s VAL 13 Ca 0.05 1.04 -0.08 0.00 0.00 0.00 0.00 61.98 62.99 2kvm s VAL 13 Cb -0.11 -3.89 0.18 0.00 0.00 0.00 0.00 36.38 32.56 2kvm s VAL 13 CO -0.15 0.08 1.85 -0.08 0.00 0.00 0.00 175.10 176.80 2kvm h GLU 14 N 7.81 0.88 0.00 2.72 4.57 -0.18 -3.43 114.58 126.95 2kvm h GLU 14 Ca -0.29 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 2kvm h GLU 14 Cb 1.14 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 2kvm h GLU 14 CO 0.75 0.58 0.00 -1.13 -1.18 0.00 0.00 179.01 178.03 2kvm n SER 15 N -4.65 0.00 -4.49 1.04 3.41 -1.07 -4.94 113.62 102.91 2kvm n SER 15 Ca 0.10 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.33 2kvm n SER 15 Cb 0.14 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.13 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 -0.93 2.42 -0.05 -1.33 -0.00 -1.26 -1.81 119.36 116.40 2kvm n ILE 16 Ca 0.00 -0.48 -0.09 0.00 -0.00 0.00 0.00 62.75 62.18 2kvm n ILE 16 Cb 0.00 -0.76 -0.04 0.00 -0.00 0.00 0.00 39.64 38.83 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 -0.33 0.24 -4.32 0.38 1.74 0.33 -4.67 116.66 110.03 2kvm n ARG 17 Ca 0.12 0.07 -0.18 0.00 -0.77 0.00 0.00 57.85 57.09 2kvm n ARG 17 Cb 0.48 -1.08 -0.09 0.00 -1.02 0.00 0.00 32.46 30.75 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 -2.20 1.58 -0.15 5.56 1.02 -1.05 -4.92 119.74 119.59 2kvm s LYS 18 Ca -0.14 -1.90 -0.05 0.00 0.02 0.00 0.00 55.97 53.90 2kvm s LYS 18 Cb 0.04 -0.03 0.07 0.00 -0.52 0.00 0.00 37.83 37.40 2kvm s LYS 18 CO 0.22 -0.47 0.30 0.21 -0.92 0.00 0.00 175.35 174.69 2kvm s LYS 19 N -3.81 0.19 -0.04 1.68 2.20 -1.26 -0.86 119.74 117.84 2kvm s LYS 19 Ca 0.36 0.80 0.02 0.00 -0.36 0.00 0.00 55.97 56.80 2kvm s LYS 19 Cb 0.05 0.03 0.01 0.00 -1.51 0.00 0.00 37.83 36.40 2kvm s LYS 19 CO 0.18 -0.29 -0.10 -0.98 -0.36 0.00 0.00 175.35 173.80 2kvm s ARG 20 N 2.46 1.28 0.10 4.03 1.70 -0.18 -4.94 118.95 123.41 2kvm s ARG 20 Ca 0.01 -0.34 0.06 0.00 -0.47 0.00 0.00 55.73 54.99 2kvm s ARG 20 Cb -0.12 -1.13 -0.04 0.00 -0.57 0.00 0.00 34.95 33.09 2kvm s ARG 20 CO -0.10 0.06 -0.06 0.08 -1.08 0.00 0.00 175.30 174.21 2kvm s VAL 21 N 0.46 3.63 -0.29 4.99 1.01 -1.26 0.50 120.40 129.44 2kvm s VAL 21 Ca -0.09 -1.15 -0.01 0.00 0.00 0.00 0.00 61.98 60.73 2kvm s VAL 21 Cb -0.12 -2.71 0.10 0.00 0.00 0.00 0.00 36.38 33.64 2kvm s VAL 21 CO 0.02 0.12 0.09 -0.60 0.00 0.00 0.00 175.10 174.73 2kvm s ARG 22 N -2.23 0.64 0.00 2.72 3.52 0.25 -4.76 118.95 119.09 2kvm s ARG 22 Ca 0.23 -0.93 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 2kvm s ARG 22 Cb -0.11 -1.88 0.00 0.00 -1.56 0.00 0.00 34.95 31.40 2kvm s ARG 22 CO 0.15 -0.95 0.00 1.63 -0.81 0.00 0.00 175.30 175.32 2kvm n LYS 23 N 4.93 -0.44 0.00 5.12 5.02 -1.26 -0.67 118.16 130.86 2kvm n LYS 23 Ca -0.03 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2kvm n LYS 23 Cb 0.43 -4.36 0.00 0.00 -0.02 0.00 0.00 35.03 31.07 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 -1.37 1.29 3.57 0.72 0.00 -1.26 -5.08 105.19 103.06 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 3.01 0.32 1.61 1.02 0.16 -4.97 119.74 120.90 2kvm s LYS 25 Ca 0.00 0.62 -0.27 0.00 0.02 0.00 0.00 55.97 56.34 2kvm s LYS 25 Cb 0.00 -4.25 -0.09 0.00 -0.52 0.00 0.00 37.83 32.97 2kvm s LYS 25 CO 0.00 -2.27 1.00 0.08 -0.92 0.00 0.00 175.35 173.24 2kvm s VAL 26 N 7.43 3.92 0.05 3.17 1.01 -1.26 -0.58 120.40 134.13 2kvm s VAL 26 Ca 0.61 1.67 0.02 0.00 0.00 0.00 0.00 61.98 64.29 2kvm s VAL 26 Cb -0.13 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2kvm s VAL 26 CO 0.24 0.20 -0.08 -1.61 0.00 0.00 0.00 175.10 173.84 2kvm s GLU 27 N -1.92 0.57 -0.16 2.72 2.02 0.18 -1.35 118.70 120.75 2kvm s GLU 27 Ca 0.50 -0.81 -0.02 0.00 0.02 0.00 0.00 54.97 54.66 2kvm s GLU 27 Cb -0.23 -0.34 0.05 0.00 0.10 0.00 0.00 34.13 33.70 2kvm s GLU 27 CO 0.29 0.06 0.01 0.71 0.02 0.00 0.00 175.26 176.36 2kvm s TYR 28 N -1.48 1.09 -1.10 1.61 2.02 -0.56 -1.01 117.35 117.92 2kvm s TYR 28 Ca -0.08 -0.77 -0.24 0.00 -0.37 0.00 0.00 57.07 55.61 2kvm s TYR 28 Cb -0.09 -1.04 -0.11 0.00 -0.40 0.00 0.00 41.96 40.32 2kvm s TYR 28 CO 0.00 -0.56 2.00 -1.17 -1.57 0.00 0.00 175.55 174.25 2kvm s LEU 29 N 1.83 2.92 0.14 -1.29 1.98 -0.04 -1.64 118.68 122.58 2kvm s LEU 29 Ca 0.00 -1.30 -0.31 0.00 -2.89 0.00 0.00 54.13 49.64 2kvm s LEU 29 Cb -0.16 -2.58 -0.08 0.00 0.66 0.00 0.00 46.19 44.03 2kvm s LEU 29 CO -0.07 -3.41 1.31 0.68 -1.89 0.00 0.00 176.35 172.97 2kvm s VAL 30 N 12.27 3.43 -0.56 1.68 -7.23 0.09 0.12 120.40 130.21 2kvm s VAL 30 Ca 0.72 1.09 -0.20 0.00 -1.81 0.00 0.00 61.98 61.78 2kvm s VAL 30 Cb -0.03 -3.70 0.07 0.00 0.56 0.00 0.00 36.38 33.28 2kvm s VAL 30 CO 0.12 0.12 0.75 -0.75 -0.31 0.00 0.00 175.10 175.03 2kvm s LYS 31 N 0.53 3.13 0.15 4.82 2.20 -0.75 -2.64 119.74 127.19 2kvm s LYS 31 Ca 0.60 -0.89 -0.31 0.00 -0.36 0.00 0.00 55.97 55.00 2kvm s LYS 31 Cb -0.35 -4.15 -0.10 0.00 -1.51 0.00 0.00 37.83 31.72 2kvm s LYS 31 CO 0.33 -1.43 1.61 -1.58 -0.36 0.00 0.00 175.35 173.92 2kvm s TRP 32 N 3.07 2.87 0.06 4.03 0.52 -1.26 0.51 118.94 128.74 2kvm s TRP 32 Ca 0.18 0.51 -0.32 0.00 0.02 0.00 0.00 56.10 56.49 2kvm s TRP 32 Cb -0.19 -3.96 -0.17 0.00 -1.15 0.00 0.00 33.47 28.00 2kvm s TRP 32 CO 0.11 -3.65 1.48 -0.22 0.02 0.00 0.00 176.95 174.70 2kvm h LYS 33 N 7.21 -1.04 -0.67 4.98 3.11 -1.46 -2.65 116.57 126.05 2kvm h LYS 33 Ca -0.43 0.07 0.00 0.00 -2.81 0.00 0.00 60.65 57.48 2kvm h LYS 33 Cb 1.20 0.24 0.00 0.00 -1.00 0.00 0.00 32.23 32.67 2kvm h LYS 33 CO 0.92 -0.69 0.00 0.41 -2.81 0.00 0.00 179.45 177.28 2kvm n GLY 34 N -1.55 0.91 3.06 5.01 0.00 -1.26 -4.75 105.19 106.60 2kvm n GLY 34 Ca -0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.13 0.27 0.73 1.61 0.52 -1.00 -5.16 118.94 114.79 2kvm s TRP 35 Ca 0.00 -0.58 -0.13 0.00 0.02 0.00 0.00 56.10 55.41 2kvm s TRP 35 Cb 0.00 -0.20 0.04 0.00 -1.15 0.00 0.00 33.47 32.16 2kvm s TRP 35 CO 0.00 -0.29 1.12 -2.14 0.02 0.00 0.00 176.95 175.66 2kvm s PRO 36 N -2.27 2.33 0.36 4.98 0.02 -1.26 -4.53 135.00 134.63 2kvm s PRO 36 Ca -0.08 1.40 0.25 0.00 0.02 0.00 0.00 61.00 62.59 2kvm s PRO 36 Cb -0.04 -1.89 1.30 0.00 0.02 0.00 0.00 34.50 33.90 2kvm s PRO 36 CO -0.04 -1.62 1.76 -1.00 -0.33 0.00 0.00 177.00 175.78 2kvm h PRO 37 N -0.58 0.00 0.00 5.54 0.13 -1.97 -0.46 132.00 134.66 2kvm h PRO 37 Ca -0.46 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 2kvm h PRO 37 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 2kvm h PRO 37 CO 0.51 0.00 -0.11 0.87 -0.23 0.00 0.00 178.00 179.04 2kvm h LYS 38 N 0.00 0.00 -0.67 0.86 1.57 -1.99 -2.78 116.57 113.56 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 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2kvm h LYS 38 CO 0.00 0.11 0.00 0.66 -0.57 0.00 0.00 179.45 179.65 2kvm n TYR 39 N -3.23 1.05 -1.04 -1.35 4.01 -0.18 -5.00 117.16 111.41 2kvm n TYR 39 Ca 0.01 -0.53 -0.35 0.00 -0.16 0.00 0.00 57.90 56.87 2kvm n TYR 39 Cb 0.39 -0.06 0.09 0.00 -0.31 0.00 0.00 39.34 39.45 2kvm n TYR 39 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2kvm n SER 40 N 1.39 -1.95 -3.97 7.72 7.64 -1.05 -4.88 113.62 118.52 2kvm n SER 40 Ca 0.24 0.45 -0.09 0.00 1.01 0.00 0.00 58.87 60.47 2kvm n SER 40 Cb 0.67 -1.18 -0.10 0.00 -1.01 0.00 0.00 64.21 62.59 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 -2.13 0.12 -0.45 0.44 -4.23 -1.08 -4.98 115.64 103.33 2kvm s THR 41 Ca 0.60 -1.02 -0.22 0.00 -1.18 0.00 0.00 61.69 59.87 2kvm s THR 41 Cb -0.28 -0.57 0.03 0.00 1.34 0.00 0.00 72.50 73.02 2kvm s THR 41 CO 0.64 -0.56 0.72 0.26 -0.54 0.00 0.00 174.62 175.13 2kvm s TRP 42 N -1.97 3.02 -0.23 3.99 0.52 -1.26 -0.73 118.94 122.28 2kvm s TRP 42 Ca -0.11 0.01 -0.00 0.00 0.02 0.00 0.00 56.10 56.02 2kvm s TRP 42 Cb -0.06 -3.52 0.03 0.00 -1.15 0.00 0.00 33.47 28.77 2kvm s TRP 42 CO -0.02 -0.95 -0.10 -1.21 0.02 0.00 0.00 176.95 174.69 2kvm s GLU 43 N 3.06 2.81 0.66 4.98 0.41 -0.65 -4.83 118.70 125.14 2kvm s GLU 43 Ca 0.26 -0.98 -0.17 0.00 -0.41 0.00 0.00 54.97 53.66 2kvm s GLU 43 Cb -0.13 -2.88 -0.10 0.00 -1.78 0.00 0.00 34.13 29.23 2kvm s GLU 43 CO 0.20 -0.37 0.08 -2.30 -0.49 0.00 0.00 175.26 172.38 2kvm n PRO 44 N 4.63 0.17 0.30 0.39 -0.02 -1.26 -1.50 135.00 137.71 2kvm n PRO 44 Ca -0.17 0.07 0.18 0.00 -2.02 0.00 0.00 63.50 61.57 2kvm n PRO 44 Cb 0.47 -1.37 0.98 0.00 -0.02 0.00 0.00 33.50 33.56 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 -0.25 0.00 0.00 -0.52 4.22 -1.52 0.29 114.58 116.79 2kvm h GLU 45 Ca -0.44 0.00 -0.20 0.00 0.08 0.00 0.00 59.36 58.81 2kvm h GLU 45 Cb 1.39 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.60 2kvm h GLU 45 CO 0.40 0.00 -1.18 1.49 -2.18 0.00 0.00 179.01 177.54 2kvm h GLU 46 N 0.00 0.00 0.02 1.92 4.81 -1.87 -3.32 114.58 116.15 2kvm h GLU 46 Ca 0.00 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.03 2kvm h GLU 46 Cb 0.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2kvm h GLU 46 CO 0.00 0.58 -0.94 0.45 -0.73 0.00 0.00 179.01 178.37 2kvm h HIS 47 N 0.00 0.17 -1.27 0.92 3.86 -0.75 -3.43 115.15 114.66 2kvm h HIS 47 Ca -0.12 -0.11 -0.47 0.00 -1.16 0.00 0.00 60.37 58.51 2kvm h HIS 47 Cb 1.70 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 30.14 2kvm h HIS 47 CO 0.00 0.98 1.66 -0.89 0.86 0.00 0.00 177.93 180.54 2kvm n ILE 48 N -3.55 -0.06 0.59 2.45 2.08 -0.80 -4.74 119.36 115.34 2kvm n ILE 48 Ca -0.03 -0.63 0.04 0.00 0.56 0.00 0.00 62.75 62.69 2kvm n ILE 48 Cb 0.86 -2.31 0.21 0.00 -0.75 0.00 0.00 39.64 37.65 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 14.71 0.00 -3.53 1.39 4.77 -1.26 -4.44 117.00 128.63 2kvm n LEU 49 Ca 0.43 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.29 2kvm n LEU 49 Cb 0.44 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.42 2kvm n LEU 49 CO 0.76 0.00 -0.08 -0.62 -1.33 0.00 0.00 177.39 176.12 2kvm s ASP 50 N -1.93 0.33 0.46 -1.43 -1.08 -1.26 -5.02 116.67 106.75 2kvm s ASP 50 Ca 0.11 0.44 0.20 0.00 -0.52 0.00 0.00 52.55 52.78 2kvm s ASP 50 Cb 0.05 0.94 1.12 0.00 -1.46 0.00 0.00 42.92 43.57 2kvm s ASP 50 CO 0.08 -0.27 1.98 -0.65 0.52 0.00 0.00 175.17 176.83 2kvm h PRO 51 N 8.23 0.00 -0.79 4.34 0.11 -1.97 -2.17 132.00 139.74 2kvm h PRO 51 Ca -0.17 0.00 0.19 0.00 0.11 0.00 0.00 66.00 66.13 2kvm h PRO 51 Cb 1.13 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 2kvm h PRO 51 CO 0.20 0.20 0.54 0.00 -0.21 0.00 0.00 178.00 178.73 2kvm h ARG 52 N 0.00 0.27 -0.00 1.05 -0.00 -1.96 0.60 114.38 114.33 2kvm h ARG 52 Ca -0.00 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.98 59.46 2kvm h ARG 52 Cb 0.41 -0.06 -0.00 0.00 0.00 0.00 0.00 29.97 30.32 2kvm h ARG 52 CO 0.03 0.18 -0.00 -0.07 0.00 0.00 0.00 179.97 180.11 2kvm h LEU 53 N 0.28 0.01 0.66 3.04 3.38 -1.82 -1.32 115.31 119.54 2kvm h LEU 53 Ca 0.39 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2kvm h LEU 53 Cb 1.12 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 2kvm h LEU 53 CO -0.10 0.41 -0.38 0.58 0.09 0.00 0.00 178.44 179.03 2kvm h VAL 54 N -0.39 0.23 -0.47 1.22 2.07 -0.80 -1.07 116.25 117.04 2kvm h VAL 54 Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 2kvm h VAL 54 Cb 0.40 0.23 -0.10 0.00 -1.52 0.00 0.00 31.29 30.30 2kvm h VAL 54 CO 0.00 0.00 -0.19 -0.03 0.02 0.00 0.00 177.57 177.37 2kvm h MET 55 N -0.97 -0.08 -0.99 1.57 -1.53 -0.02 0.17 114.93 113.08 2kvm h MET 55 Ca -0.08 0.01 0.16 0.00 -3.44 0.00 0.00 59.70 56.35 2kvm h MET 55 Cb 0.77 0.02 -0.09 0.00 -0.55 0.00 0.00 31.60 31.75 2kvm h MET 55 CO 0.10 -0.06 0.62 0.00 0.14 0.00 0.00 176.91 177.71 2kvm h ALA 56 N 1.28 1.67 0.00 0.39 0.00 -1.04 0.19 119.26 121.75 2kvm h ALA 56 Ca 0.22 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2kvm h ALA 56 Cb 0.43 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2kvm h ALA 56 CO -0.53 0.01 -0.01 -0.92 0.00 0.00 0.00 179.25 177.80 2kvm h TYR 57 N 0.81 -0.03 0.00 0.00 3.20 0.64 -1.10 116.97 120.50 2kvm h TYR 57 Ca 0.54 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.41 2kvm h TYR 57 Cb 0.77 0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.05 2kvm h TYR 57 CO -0.00 -0.02 0.00 0.93 -1.64 0.00 0.00 178.16 177.43 2kvm h GLU 58 N -0.02 0.00 -0.15 1.82 5.08 -0.02 -2.22 114.58 119.07 2kvm h GLU 58 Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 2kvm h GLU 58 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2kvm h GLU 58 CO -0.01 0.00 -0.73 1.49 -1.00 0.00 0.00 179.01 178.76 2kvm h GLU 59 N 0.00 0.67 -0.20 2.33 4.81 0.57 -1.43 114.58 121.34 2kvm h GLU 59 Ca 0.00 -0.53 -0.16 0.00 -0.13 0.00 0.00 59.36 58.55 2kvm h GLU 59 Cb 0.30 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2kvm h GLU 59 CO 0.00 1.14 -0.53 0.87 -0.73 0.00 0.00 179.01 179.76 2kvm h LYS 60 N 0.47 0.57 0.34 1.92 1.57 -0.88 -2.49 116.57 118.07 2kvm h LYS 60 Ca -0.04 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.37 2kvm h LYS 60 Cb 1.33 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2kvm h LYS 60 CO 0.14 0.96 -0.16 0.93 -0.57 0.00 0.00 179.45 180.75 2kvm h GLU 61 N 0.45 -0.44 -0.46 3.15 5.08 -1.42 -2.31 114.58 118.62 2kvm h GLU 61 Ca 0.01 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 2kvm h GLU 61 Cb 1.07 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 2kvm h GLU 61 CO 0.10 -0.16 0.31 1.05 -1.00 0.00 0.00 179.01 179.31 2kvm h GLU 62 N -0.69 0.25 -0.02 2.33 4.11 -1.29 0.68 114.58 119.95 2kvm h GLU 62 Ca -0.05 -0.01 -0.00 0.00 0.07 0.00 0.00 59.36 59.37 2kvm h GLU 62 Cb 0.48 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 2kvm h GLU 62 CO 0.08 0.16 0.01 0.00 0.07 0.00 0.00 179.01 179.33 2kvm h ARG 63 N 0.26 0.04 0.01 1.06 2.47 -1.25 -2.01 114.38 114.95 2kvm h ARG 63 Ca 0.21 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.92 2kvm h ARG 63 Cb 0.49 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 2kvm h ARG 63 CO -0.04 0.25 -0.01 0.22 0.56 0.00 0.00 179.97 180.96 2kvm h ASP 64 N -0.19 -0.02 -0.89 7.04 1.82 -0.77 -3.36 116.42 120.05 2kvm h ASP 64 Ca 0.01 0.00 0.17 0.00 -0.39 0.00 0.00 57.03 56.82 2kvm h ASP 64 Cb 0.23 0.00 -0.16 0.00 0.68 0.00 0.00 39.33 40.08 2kvm h ASP 64 CO 0.00 0.32 -0.25 0.03 -1.61 0.00 0.00 179.24 177.72 2kvm h ARG 65 N -0.67 -0.01 -4.57 0.28 3.08 0.18 -3.44 114.38 109.22 2kvm h ARG 65 Ca -0.00 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 2kvm h ARG 65 Cb 0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 2kvm h ARG 65 CO 0.00 -0.01 -0.40 0.00 -1.07 0.00 0.00 179.97 178.49 2kvm n ALA 66 N -3.45 -0.91 -3.60 0.04 0.00 -0.76 -4.92 120.51 106.92 2kvm n ALA 66 Ca 0.12 0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.44 2kvm n ALA 66 Cb 0.44 -2.04 -0.16 0.00 0.00 0.00 0.00 19.45 17.69 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 -2.33 1.73 0.00 0.00 1.04 -1.26 -4.98 113.70 107.90 2kvm s SER 67 Ca 0.17 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2kvm s SER 67 Cb -0.09 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.02 2kvm s SER 67 CO 0.21 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.72 2kvm n GLY 68 N 5.30 -1.74 0.14 7.32 0.00 -1.26 -4.99 105.19 109.96 2kvm n GLY 68 Ca -0.06 0.78 -0.20 0.00 0.00 0.00 0.00 46.02 46.54 2kvm n GLY 68 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2kvm n TYR 69 N 0.00 0.95 -3.30 1.61 4.02 -1.26 -5.06 117.16 114.12 2kvm n TYR 69 Ca 0.00 0.20 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 2kvm n TYR 69 Cb 0.00 -1.13 0.00 0.00 -0.02 0.00 0.00 39.34 38.19 2kvm n TYR 69 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 2kvm n ARG 70 N -3.42 0.00 0.00 -0.72 0.63 -1.26 -5.28 116.66 106.61 2kvm n ARG 70 Ca -0.35 0.00 0.12 0.00 -0.92 0.00 0.00 57.85 56.70 2kvm n ARG 70 Cb 1.03 0.00 0.20 0.00 0.45 0.00 0.00 32.46 34.14 2kvm n ARG 70 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29