#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cu7 s SER 2 N 0.00 6.78 1.16 1.61 1.04 -1.26 -5.05 113.70 117.97 2cu7 s SER 2 Ca 0.00 -3.38 -0.18 0.00 0.48 0.00 0.00 55.95 52.87 2cu7 s SER 2 Cb 0.00 -2.12 0.27 0.00 0.10 0.00 0.00 66.02 64.26 2cu7 s SER 2 CO 0.00 -0.33 1.12 -0.55 0.98 0.00 0.00 173.24 174.45 2cu7 s SER 3 N 1.15 1.31 -0.83 7.02 0.15 -1.26 -4.77 113.70 116.47 2cu7 s SER 3 Ca 0.26 0.71 -0.29 0.00 0.70 0.00 0.00 55.95 57.33 2cu7 s SER 3 Cb -0.10 -1.01 -0.17 0.00 -1.71 0.00 0.00 66.02 63.02 2cu7 s SER 3 CO -0.09 -3.89 2.60 0.61 1.20 0.00 0.00 173.24 173.67 2cu7 n GLY 4 N -1.11 -0.27 3.16 9.45 0.00 -1.26 -4.85 105.19 110.31 2cu7 n GLY 4 Ca 0.12 0.96 -0.39 0.00 0.00 0.00 0.00 46.02 46.71 2cu7 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cu7 s SER 5 N 9.95 5.76 -0.57 1.61 0.15 -1.26 -4.92 113.70 124.42 2cu7 s SER 5 Ca 1.23 -2.95 -0.02 0.00 0.70 0.00 0.00 55.95 54.91 2cu7 s SER 5 Cb -0.88 -1.96 0.34 0.00 -1.71 0.00 0.00 66.02 61.81 2cu7 s SER 5 CO 0.41 -0.39 2.09 -1.20 1.20 0.00 0.00 173.24 175.35 2cu7 n SER 6 N 3.43 7.24 0.00 5.45 7.64 -1.26 -4.93 113.62 131.19 2cu7 n SER 6 Ca 0.12 -3.54 0.00 0.00 1.01 0.00 0.00 58.87 56.46 2cu7 n SER 6 Cb 0.40 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.57 2cu7 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cu7 n GLY 7 N -0.36 1.13 3.82 0.23 0.00 -1.26 -5.06 105.19 103.69 2cu7 n GLY 7 Ca 0.51 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 2cu7 n GLY 7 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2cu7 s TYR 8 N 0.00 3.58 -0.79 1.61 5.04 -1.26 -5.05 117.35 120.49 2cu7 s TYR 8 Ca 0.00 0.64 0.01 0.00 -2.44 0.00 0.00 57.07 55.28 2cu7 s TYR 8 Cb 0.00 -2.13 0.19 0.00 0.35 0.00 0.00 41.96 40.37 2cu7 s TYR 8 CO 0.00 0.57 0.62 -1.12 -1.34 0.00 0.00 175.55 174.28 2cu7 s SER 9 N -0.60 5.42 -0.49 4.32 0.01 -1.26 -5.04 113.70 116.06 2cu7 s SER 9 Ca 0.17 -3.69 -0.27 0.00 1.31 0.00 0.00 55.95 53.46 2cu7 s SER 9 Cb -0.13 -1.79 -0.14 0.00 0.21 0.00 0.00 66.02 64.17 2cu7 s SER 9 CO 0.06 -0.16 1.67 1.33 0.41 0.00 0.00 173.24 176.54 2cu7 n VAL 10 N 2.30 0.00 -3.40 3.43 0.24 -1.26 -4.88 118.33 114.76 2cu7 n VAL 10 Ca 0.19 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 62.29 2cu7 n VAL 10 Cb 0.36 -0.35 -0.02 0.00 -1.47 0.00 0.00 33.84 32.36 2cu7 n VAL 10 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 2cu7 s LYS 11 N 5.07 2.61 0.19 7.34 0.00 -1.26 -5.13 119.74 128.56 2cu7 s LYS 11 Ca 0.89 -1.46 0.07 0.00 0.00 0.00 0.00 55.97 55.47 2cu7 s LYS 11 Cb -0.99 -2.49 -0.04 0.00 0.00 0.00 0.00 37.83 34.31 2cu7 s LYS 11 CO 0.42 -0.24 0.07 -1.58 0.00 0.00 0.00 175.35 174.02 2cu7 s TRP 12 N -2.45 2.96 0.10 1.78 0.52 -1.26 -5.13 118.94 115.46 2cu7 s TRP 12 Ca 0.50 -0.10 0.08 0.00 0.02 0.00 0.00 56.10 56.60 2cu7 s TRP 12 Cb -0.05 -1.40 -0.04 0.00 -1.15 0.00 0.00 33.47 30.83 2cu7 s TRP 12 CO 0.29 0.53 -0.15 0.95 0.02 0.00 0.00 176.95 178.60 2cu7 s THR 13 N -1.86 3.04 0.29 2.01 -4.23 -1.26 -4.99 115.64 108.64 2cu7 s THR 13 Ca 0.30 -1.36 -0.05 0.00 -1.18 0.00 0.00 61.69 59.40 2cu7 s THR 13 Cb -0.09 -2.39 0.45 0.00 1.34 0.00 0.00 72.50 71.81 2cu7 s THR 13 CO 0.21 0.15 1.55 -0.38 -0.54 0.00 0.00 174.62 175.61 2cu7 n ILE 14 N 0.90 -0.42 -0.06 2.99 2.08 -1.26 -0.13 119.36 123.46 2cu7 n ILE 14 Ca -0.15 2.26 -0.09 0.00 0.56 0.00 0.00 62.75 65.32 2cu7 n ILE 14 Cb 0.52 -3.17 -0.03 0.00 -0.75 0.00 0.00 39.64 36.21 2cu7 n ILE 14 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2cu7 h GLU 15 N 0.00 -0.33 -0.52 0.38 4.57 -2.00 0.06 114.58 116.73 2cu7 h GLU 15 Ca 0.51 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.70 2cu7 h GLU 15 Cb 0.86 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.50 2cu7 h GLU 15 CO -1.00 -0.22 0.28 0.93 -1.18 0.00 0.00 179.01 177.82 2cu7 h GLU 16 N -0.34 0.73 -0.52 1.92 3.07 -0.94 -2.78 114.58 115.72 2cu7 h GLU 16 Ca 0.13 -0.09 0.10 0.00 -0.50 0.00 0.00 59.36 59.00 2cu7 h GLU 16 Cb 0.55 -0.14 -0.08 0.00 -0.84 0.00 0.00 28.75 28.24 2cu7 h GLU 16 CO -0.45 0.57 0.06 0.87 -1.40 0.00 0.00 179.01 178.66 2cu7 h LYS 17 N 0.70 0.18 -0.45 2.33 1.57 0.01 -0.84 116.57 120.08 2cu7 h LYS 17 Ca 0.18 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.99 2cu7 h LYS 17 Cb 0.05 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 2cu7 h LYS 17 CO -0.03 0.12 0.21 0.93 -0.57 0.00 0.00 179.45 180.11 2cu7 h GLU 18 N 0.19 0.41 -0.41 3.15 4.39 -0.77 -2.40 114.58 119.13 2cu7 h GLU 18 Ca 0.27 -0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.97 2cu7 h GLU 18 Cb 0.39 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 2cu7 h GLU 18 CO -0.39 0.27 0.22 -0.07 -1.16 0.00 0.00 179.01 177.89 2cu7 h LEU 19 N 0.42 0.33 -0.73 1.33 3.38 -1.02 -1.71 115.31 117.32 2cu7 h LEU 19 Ca 0.20 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.31 2cu7 h LEU 19 Cb 0.12 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.74 2cu7 h LEU 19 CO -0.15 0.24 0.31 0.15 0.09 0.00 0.00 178.44 179.08 2cu7 h PHE 20 N 0.44 0.54 0.61 1.13 3.04 -0.72 -2.61 116.94 119.38 2cu7 h PHE 20 Ca 0.17 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.13 2cu7 h PHE 20 Cb 0.06 -0.13 0.01 0.00 2.56 0.00 0.00 35.95 38.44 2cu7 h PHE 20 CO -0.09 0.12 -0.29 0.93 -2.02 0.00 0.00 178.31 176.95 2cu7 h GLU 21 N 0.49 -0.79 -0.77 1.11 3.07 -1.00 -0.50 114.58 116.19 2cu7 h GLU 21 Ca 0.39 0.05 0.10 0.00 -0.50 0.00 0.00 59.36 59.40 2cu7 h GLU 21 Cb 0.53 0.18 -0.11 0.00 -0.84 0.00 0.00 28.75 28.51 2cu7 h GLU 21 CO -0.35 -0.48 -0.37 0.94 -1.40 0.00 0.00 179.01 177.35 2cu7 n GLN 22 N -5.37 -0.25 -0.05 2.33 7.27 -0.69 -0.21 117.38 120.41 2cu7 n GLN 22 Ca -0.12 1.17 -0.13 0.00 0.07 0.00 0.00 57.00 57.99 2cu7 n GLN 22 Cb 0.35 -1.73 -0.07 0.00 2.41 0.00 0.00 30.24 31.20 2cu7 n GLN 22 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2cu7 h GLY 23 N 0.00 0.38 -0.70 1.69 0.00 -1.51 -2.94 103.07 99.99 2cu7 h GLY 23 Ca 0.20 -0.37 0.36 0.00 0.00 0.00 0.00 47.33 47.52 2cu7 h GLY 23 CO -0.74 0.34 0.58 -2.00 0.00 0.00 0.00 176.54 174.72 2cu7 h LEU 24 N -0.02 0.44 -0.08 3.11 5.85 0.11 0.87 115.31 125.60 2cu7 h LEU 24 Ca 0.03 0.21 -0.25 0.00 0.84 0.00 0.00 57.88 58.70 2cu7 h LEU 24 Cb 0.64 0.17 0.02 0.00 0.37 0.00 0.00 40.66 41.87 2cu7 h LEU 24 CO 0.03 -0.23 -0.92 0.00 -0.34 0.00 0.00 178.44 176.98 2cu7 h ALA 25 N 1.88 0.21 0.26 1.25 0.00 -1.11 0.41 119.26 122.16 2cu7 h ALA 25 Ca 0.77 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2cu7 h ALA 25 Cb 1.91 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2cu7 h ALA 25 CO -0.64 0.69 -0.13 -0.22 0.00 0.00 0.00 179.25 178.95 2cu7 h LYS 26 N 0.47 -0.34 0.00 0.00 3.64 0.43 -3.33 116.57 117.44 2cu7 h LYS 26 Ca -0.09 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.19 2cu7 h LYS 26 Cb 1.56 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.44 2cu7 h LYS 26 CO 0.19 -0.23 -0.55 0.74 -2.27 0.00 0.00 179.45 177.33 2cu7 h PHE 27 N -0.71 0.00 0.00 1.91 0.04 0.24 -3.49 116.94 114.93 2cu7 h PHE 27 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 2cu7 h PHE 27 Cb 0.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.42 2cu7 h PHE 27 CO 0.04 0.55 0.00 0.41 -0.60 0.00 0.00 178.31 178.70 2cu7 n GLY 28 N 0.05 0.94 0.88 -1.45 0.00 0.14 -4.27 105.19 101.48 2cu7 n GLY 28 Ca -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2cu7 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cu7 n ARG 29 N 0.00 1.94 -3.26 1.61 5.12 -1.26 -4.39 116.66 116.43 2cu7 n ARG 29 Ca 0.00 -3.45 -0.41 0.00 -1.93 0.00 0.00 57.85 52.07 2cu7 n ARG 29 Cb 0.00 -1.74 -0.08 0.00 -1.16 0.00 0.00 32.46 29.48 2cu7 n ARG 29 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2cu7 s ARG 30 N -3.30 3.80 -0.01 5.56 0.52 -1.26 -4.94 118.95 119.31 2cu7 s ARG 30 Ca 0.41 0.00 -0.15 0.00 -0.52 0.00 0.00 55.73 55.47 2cu7 s ARG 30 Cb 0.38 -3.75 -0.33 0.00 0.52 0.00 0.00 34.95 31.77 2cu7 s ARG 30 CO -0.05 -0.52 0.86 -1.49 0.02 0.00 0.00 175.30 174.12 2cu7 h TRP 31 N 8.30 0.85 -0.90 -0.53 -0.00 -1.94 -3.05 115.95 118.68 2cu7 h TRP 31 Ca -0.29 -0.62 0.09 0.00 -0.00 0.00 0.00 58.89 58.08 2cu7 h TRP 31 Cb 1.13 -0.03 -0.07 0.00 -0.00 0.00 0.00 29.16 30.19 2cu7 h TRP 31 CO 0.74 1.59 0.54 1.15 -0.00 0.00 0.00 178.44 182.46 2cu7 h THR 32 N 0.08 0.95 0.33 1.49 2.02 -1.92 -1.35 112.91 114.51 2cu7 h THR 32 Ca -0.29 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.57 2cu7 h THR 32 Cb 2.10 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 2cu7 h THR 32 CO 0.23 0.17 -0.16 0.11 0.37 0.00 0.00 175.52 176.23 2cu7 h LYS 33 N 0.91 -0.43 -0.98 6.66 1.79 -1.99 -3.17 116.57 119.36 2cu7 h LYS 33 Ca 0.42 0.03 0.31 0.00 -2.18 0.00 0.00 60.65 59.23 2cu7 h LYS 33 Cb 0.35 0.10 -0.18 0.00 -1.58 0.00 0.00 32.23 30.92 2cu7 h LYS 33 CO -0.23 -0.29 0.18 0.82 -1.08 0.00 0.00 179.45 178.85 2cu7 h ILE 34 N -0.82 0.04 -0.91 1.86 2.04 -1.45 1.27 117.51 119.54 2cu7 h ILE 34 Ca -0.05 -0.01 0.10 0.00 1.00 0.00 0.00 64.86 65.90 2cu7 h ILE 34 Cb 0.34 0.01 -0.07 0.00 -0.74 0.00 0.00 36.82 36.37 2cu7 h ILE 34 CO 0.07 0.01 0.59 0.28 0.00 0.00 0.00 178.15 179.10 2cu7 h SER 35 N 0.03 0.83 -0.68 1.72 0.02 -1.30 -1.34 113.55 112.82 2cu7 h SER 35 Ca 0.66 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.59 2cu7 h SER 35 Cb 1.48 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.84 2cu7 h SER 35 CO -0.86 0.48 0.27 0.50 -1.14 0.00 0.00 176.83 176.08 2cu7 h LYS 36 N 0.91 1.02 0.33 3.45 1.63 0.16 0.11 116.57 124.18 2cu7 h LYS 36 Ca 0.42 -0.18 -0.01 0.00 -0.85 0.00 0.00 60.65 60.03 2cu7 h LYS 36 Cb 0.40 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.85 2cu7 h LYS 36 CO -0.18 0.85 -0.34 1.25 -3.45 0.00 0.00 179.45 177.57 2cu7 h LEU 37 N 0.96 -0.95 0.49 5.20 5.85 -0.91 -3.21 115.31 122.74 2cu7 h LEU 37 Ca 0.23 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 2cu7 h LEU 37 Cb 0.21 0.31 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2cu7 h LEU 37 CO -0.02 -0.45 -0.24 0.40 -0.34 0.00 0.00 178.44 177.80 2cu7 h ILE 38 N -0.67 0.50 0.00 4.05 2.04 -1.52 -3.46 117.51 118.45 2cu7 h ILE 38 Ca -0.04 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2cu7 h ILE 38 Cb 0.59 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 2cu7 h ILE 38 CO -0.05 0.03 0.00 0.61 0.00 0.00 0.00 178.15 178.74 2cu7 n GLY 39 N -1.12 1.68 0.31 5.37 0.00 0.39 -4.74 105.19 107.08 2cu7 n GLY 39 Ca -0.12 -0.24 -0.05 0.00 0.00 0.00 0.00 46.02 45.61 2cu7 n GLY 39 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2cu7 h SER 40 N 0.00 0.97 -2.46 1.61 0.02 -1.90 -3.44 113.55 108.35 2cu7 h SER 40 Ca 0.00 -0.11 -0.45 0.00 -0.84 0.00 0.00 61.79 60.39 2cu7 h SER 40 Cb 0.00 -0.25 0.06 0.00 0.14 0.00 0.00 62.40 62.36 2cu7 h SER 40 CO 0.00 0.80 0.04 -0.13 -1.14 0.00 0.00 176.83 176.40 2cu7 s ARG 41 N -5.81 2.17 0.25 3.45 1.81 -1.26 -5.12 118.95 114.44 2cu7 s ARG 41 Ca -0.13 -0.88 0.11 0.00 -1.72 0.00 0.00 55.73 53.11 2cu7 s ARG 41 Cb 0.15 -2.40 -0.05 0.00 -0.45 0.00 0.00 34.95 32.20 2cu7 s ARG 41 CO 0.81 -1.05 -0.19 0.95 -0.68 0.00 0.00 175.30 175.14 2cu7 s THR 42 N -2.95 2.25 0.40 0.02 -4.23 -1.26 -4.88 115.64 105.00 2cu7 s THR 42 Ca 0.61 -2.31 0.25 0.00 -1.18 0.00 0.00 61.69 59.06 2cu7 s THR 42 Cb -0.08 -2.20 0.43 0.00 1.34 0.00 0.00 72.50 71.98 2cu7 s THR 42 CO 0.41 -0.43 1.62 0.58 -0.54 0.00 0.00 174.62 176.26 2cu7 h VAL 43 N 2.45 0.11 0.43 2.29 2.07 -1.92 0.05 116.25 121.74 2cu7 h VAL 43 Ca -0.40 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2cu7 h VAL 43 Cb 1.24 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2cu7 h VAL 43 CO 0.59 0.02 -0.21 -0.07 0.02 0.00 0.00 177.57 177.93 2cu7 h LEU 44 N 0.10 -0.49 -0.79 2.57 3.38 -1.95 0.17 115.31 118.30 2cu7 h LEU 44 Ca 0.82 0.02 0.18 0.00 0.09 0.00 0.00 57.88 58.99 2cu7 h LEU 44 Cb 2.36 0.13 -0.12 0.00 0.09 0.00 0.00 40.66 43.11 2cu7 h LEU 44 CO -0.54 -0.28 0.18 1.56 0.09 0.00 0.00 178.44 179.45 2cu7 h GLN 45 N -0.72 0.23 -0.39 1.13 1.08 -1.53 0.50 115.11 115.42 2cu7 h GLN 45 Ca -0.06 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.08 2cu7 h GLN 45 Cb 0.44 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 2cu7 h GLN 45 CO 0.10 0.15 0.06 0.28 -0.95 0.00 0.00 178.83 178.47 2cu7 h VAL 46 N 0.24 1.24 0.10 -0.54 2.07 -1.07 0.17 116.25 118.47 2cu7 h VAL 46 Ca 0.46 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 67.13 2cu7 h VAL 46 Cb 0.83 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 2cu7 h VAL 46 CO -0.57 0.30 -0.25 0.11 0.02 0.00 0.00 177.57 177.18 2cu7 h LYS 47 N 0.49 -0.43 0.20 1.57 1.57 0.14 0.04 116.57 120.16 2cu7 h LYS 47 Ca 0.12 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2cu7 h LYS 47 Cb 0.37 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2cu7 h LYS 47 CO 0.01 -0.29 -0.10 1.03 -0.57 0.00 0.00 179.45 179.53 2cu7 h SER 48 N -0.45 -0.23 -0.64 0.86 0.87 -1.13 -3.12 113.55 109.71 2cu7 h SER 48 Ca 0.03 -0.14 0.13 0.00 -1.23 0.00 0.00 61.79 60.58 2cu7 h SER 48 Cb 0.48 0.06 -0.12 0.00 -0.44 0.00 0.00 62.40 62.38 2cu7 h SER 48 CO -0.15 0.01 -0.13 0.22 -0.53 0.00 0.00 176.83 176.24 2cu7 h TYR 49 N -0.47 -0.29 -1.09 2.24 5.03 -0.83 0.87 116.97 122.43 2cu7 h TYR 49 Ca -0.03 0.06 0.38 0.00 2.58 0.00 0.00 58.73 61.72 2cu7 h TYR 49 Cb 0.36 0.23 -0.12 0.00 1.55 0.00 0.00 36.73 38.75 2cu7 h TYR 49 CO -0.01 -0.26 0.69 0.00 -1.32 0.00 0.00 178.16 177.26 2cu7 n ALA 50 N -3.03 1.08 0.12 1.82 0.00 -0.01 0.22 120.51 120.72 2cu7 n ALA 50 Ca 0.08 0.73 -0.24 0.00 0.00 0.00 0.00 53.44 54.01 2cu7 n ALA 50 Cb 0.34 -0.86 -0.16 0.00 0.00 0.00 0.00 19.45 18.77 2cu7 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cu7 h ARG 51 N 0.00 0.49 -0.98 0.00 3.08 -0.95 -3.32 114.38 112.70 2cu7 h ARG 51 Ca 0.72 -0.84 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2cu7 h ARG 51 Cb 2.26 0.31 -0.05 0.00 0.08 0.00 0.00 29.97 32.57 2cu7 h ARG 51 CO -0.41 1.40 0.62 0.37 -1.07 0.00 0.00 179.97 180.88 2cu7 h GLN 52 N 0.05 1.31 0.22 0.04 4.15 0.29 -2.50 115.11 118.68 2cu7 h GLN 52 Ca -0.25 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2cu7 h GLN 52 Cb 2.08 -0.29 -0.03 0.00 0.21 0.00 0.00 27.48 29.46 2cu7 h GLN 52 CO 0.24 0.89 -0.40 -0.92 -1.93 0.00 0.00 178.83 176.72 2cu7 h TYR 53 N 1.34 -1.14 -0.70 3.99 3.20 -0.95 -1.08 116.97 121.63 2cu7 h TYR 53 Ca 0.36 0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.38 2cu7 h TYR 53 Cb -0.11 0.47 -0.09 0.00 1.54 0.00 0.00 36.73 38.53 2cu7 h TYR 53 CO 0.00 -0.48 0.24 0.74 -1.64 0.00 0.00 178.16 177.02 2cu7 h PHE 54 N -0.66 0.40 -0.68 -3.82 0.04 -1.64 0.90 116.94 111.48 2cu7 h PHE 54 Ca -0.02 0.04 0.11 0.00 2.80 0.00 0.00 57.97 60.90 2cu7 h PHE 54 Cb 0.62 -0.07 -0.08 0.00 2.20 0.00 0.00 35.95 38.62 2cu7 h PHE 54 CO -0.33 0.03 0.27 -0.22 -0.60 0.00 0.00 178.31 177.45 2cu7 h LYS 55 N 0.38 0.43 0.02 1.51 3.64 -0.97 -2.51 116.57 119.06 2cu7 h LYS 55 Ca 0.38 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.73 2cu7 h LYS 55 Cb 0.57 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2cu7 h LYS 55 CO -0.41 0.28 -0.01 -0.91 -2.27 0.00 0.00 179.45 176.14 2cu7 h ASN 56 N 0.44 -0.02 -0.57 4.20 2.35 0.17 -3.32 115.58 118.83 2cu7 h ASN 56 Ca 0.35 -0.50 0.05 0.00 -0.55 0.00 0.00 56.30 55.65 2cu7 h ASN 56 Cb 0.48 0.01 -0.07 0.00 0.05 0.00 0.00 38.32 38.78 2cu7 h ASN 56 CO -0.34 0.50 -0.34 0.29 -1.65 0.00 0.00 177.43 175.89 2cu7 n LYS 57 N -4.85 -0.25 -3.03 0.81 5.02 0.15 -3.84 118.16 112.17 2cu7 n LYS 57 Ca -0.09 1.01 -0.41 0.00 -2.02 0.00 0.00 58.31 56.81 2cu7 n LYS 57 Cb 0.27 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.73 2cu7 n LYS 57 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2cu7 s VAL 58 N -4.88 4.91 -0.52 -0.18 0.11 -1.11 -4.95 120.40 113.79 2cu7 s VAL 58 Ca -0.07 1.19 0.02 0.00 -2.93 0.00 0.00 61.98 60.19 2cu7 s VAL 58 Cb 0.06 -4.02 0.44 0.00 -1.53 0.00 0.00 36.38 31.33 2cu7 s VAL 58 CO 0.36 -0.07 1.64 0.29 -3.33 0.00 0.00 175.10 173.98 2cu7 n LYS 59 N 5.89 3.11 -1.50 1.54 5.02 -1.25 -4.87 118.16 126.11 2cu7 n LYS 59 Ca 0.01 -3.74 -0.43 0.00 -2.02 0.00 0.00 58.31 52.13 2cu7 n LYS 59 Cb 0.48 -2.28 -0.08 0.00 -0.02 0.00 0.00 35.03 33.13 2cu7 n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cu7 n GLY 61 N 6.36 -0.81 3.40 0.00 0.00 -1.26 -5.10 105.19 107.78 2cu7 n GLY 61 Ca 0.47 0.37 0.02 0.00 0.00 0.00 0.00 46.02 46.88 2cu7 n GLY 61 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2cu7 s LEU 62 N 0.00 -0.63 0.02 0.99 0.05 -1.22 -5.08 118.68 112.81 2cu7 s LEU 62 Ca 0.00 0.83 -0.05 0.00 0.05 0.00 0.00 54.13 54.96 2cu7 s LEU 62 Cb 0.00 1.70 -0.02 0.00 -2.05 0.00 0.00 46.19 45.82 2cu7 s LEU 62 CO 0.00 -0.12 -0.10 -0.90 -0.55 0.00 0.00 176.35 174.68 2cu7 n ASP 63 N 5.04 1.30 -4.06 1.48 5.75 -1.26 -5.02 116.55 119.78 2cu7 n ASP 63 Ca -0.09 0.19 -0.33 0.00 -0.01 0.00 0.00 54.79 54.55 2cu7 n ASP 63 Cb 0.52 -0.44 -0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2cu7 n ASP 63 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2cu7 n LYS 64 N -3.74 -4.28 -4.40 0.11 4.81 -1.26 -4.95 118.16 104.45 2cu7 n LYS 64 Ca -0.05 0.48 -0.35 0.00 -0.87 0.00 0.00 58.31 57.53 2cu7 n LYS 64 Cb 0.17 -5.24 -0.10 0.00 0.02 0.00 0.00 35.03 29.88 2cu7 n LYS 64 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2cu7 s GLU 65 N -6.75 3.01 0.43 1.64 2.56 -1.26 -5.08 118.70 113.25 2cu7 s GLU 65 Ca 0.64 -0.43 -0.25 0.00 0.00 0.00 0.00 54.97 54.94 2cu7 s GLU 65 Cb -0.34 -2.78 -0.10 0.00 2.00 0.00 0.00 34.13 32.91 2cu7 s GLU 65 CO 0.88 0.67 1.15 -2.37 -0.56 0.00 0.00 175.26 175.02 2cu7 n THR 66 N 2.25 2.59 -1.15 -1.70 5.66 -1.26 -4.97 114.28 115.69 2cu7 n THR 66 Ca -0.18 -0.50 -0.29 0.00 -3.05 0.00 0.00 64.05 60.03 2cu7 n THR 66 Cb 0.53 -1.37 0.19 0.00 -1.55 0.00 0.00 70.33 68.14 2cu7 n THR 66 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2cu7 s PRO 67 N -2.15 0.11 -0.04 1.09 0.04 -1.26 -5.09 135.00 127.69 2cu7 s PRO 67 Ca 0.63 0.41 -0.17 0.00 0.04 0.00 0.00 61.00 61.90 2cu7 s PRO 67 Cb -0.53 -1.71 0.03 0.00 0.04 0.00 0.00 34.50 32.34 2cu7 s PRO 67 CO 0.57 -2.92 0.38 1.21 0.04 0.00 0.00 177.00 176.28 2cu7 s ASN 68 N -3.51 -0.30 -0.67 6.66 2.47 -1.26 -5.09 114.94 113.23 2cu7 s ASN 68 Ca 0.66 0.31 -0.26 0.00 0.42 0.00 0.00 52.86 54.00 2cu7 s ASN 68 Cb -0.18 0.44 -0.07 0.00 -1.45 0.00 0.00 41.25 40.00 2cu7 s ASN 68 CO 0.57 -0.42 2.20 -1.10 -3.72 0.00 0.00 177.10 174.64 2cu7 s GLN 69 N -1.03 2.17 0.00 0.43 1.11 -1.26 -4.93 119.66 116.15 2cu7 s GLN 69 Ca -0.11 0.68 -0.22 0.00 0.01 0.00 0.00 55.36 55.72 2cu7 s GLN 69 Cb -0.04 -4.68 -0.05 0.00 -1.01 0.00 0.00 33.01 27.23 2cu7 s GLN 69 CO 0.04 -3.48 0.63 0.21 0.01 0.00 0.00 175.29 172.71 2cu7 s LYS 70 N 7.92 4.36 -0.05 2.91 2.36 -1.26 -5.07 119.74 130.91 2cu7 s LYS 70 Ca 0.84 0.81 -0.02 0.00 -2.55 0.00 0.00 55.97 55.05 2cu7 s LYS 70 Cb -0.13 -3.35 0.04 0.00 -1.05 0.00 0.00 37.83 33.33 2cu7 s LYS 70 CO 0.15 0.34 0.10 0.99 1.55 0.00 0.00 175.35 178.47 2cu7 s THR 71 N -0.11 -0.08 0.00 3.43 2.01 -1.26 -5.34 115.64 114.29 2cu7 s THR 71 Ca 0.33 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.56 2cu7 s THR 71 Cb -0.19 -0.18 0.00 0.00 0.01 0.00 0.00 72.50 72.15 2cu7 s THR 71 CO 0.18 0.10 0.21 0.61 -0.69 0.00 0.00 174.62 175.03