#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 0.76 0.49 1.61 1.04 -1.26 -5.15 113.70 111.20 2cu7 s SER 2 Ca 0.00 -0.11 -0.19 0.00 0.48 0.00 0.00 55.95 56.13 2cu7 s SER 2 Cb 0.00 -0.15 -0.08 0.00 0.10 0.00 0.00 66.02 65.89 2cu7 s SER 2 CO 0.00 0.05 1.00 -0.94 0.98 0.00 0.00 173.24 174.33 2cu7 s SER 3 N 0.06 6.54 0.00 7.02 1.04 -1.26 -4.87 113.70 122.24 2cu7 s SER 3 Ca -0.00 1.72 0.00 0.00 0.48 0.00 0.00 55.95 58.15 2cu7 s SER 3 Cb -0.05 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.54 2cu7 s SER 3 CO -0.00 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.19 2cu7 n GLY 4 N -0.91 -3.11 0.06 7.32 0.00 -1.26 -4.95 105.19 102.34 2cu7 n GLY 4 Ca 0.08 -1.03 -0.06 0.00 0.00 0.00 0.00 46.02 45.01 2cu7 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2cu7 h SER 5 N 0.00 0.00 -3.20 1.61 0.02 -2.08 -3.42 113.55 106.48 2cu7 h SER 5 Ca 0.00 -0.43 -0.76 0.00 -0.84 0.00 0.00 61.79 59.77 2cu7 h SER 5 Cb 0.00 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 62.29 2cu7 h SER 5 CO 0.00 0.73 -0.23 -0.44 -1.14 0.00 0.00 176.83 175.75 2cu7 s SER 6 N -5.86 6.14 0.00 3.07 0.01 -1.26 -4.86 113.70 110.94 2cu7 s SER 6 Ca -0.09 -1.90 0.00 0.00 1.31 0.00 0.00 55.95 55.28 2cu7 s SER 6 Cb -0.01 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.05 2cu7 s SER 6 CO 0.30 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.76 2cu7 n GLY 7 N 5.07 -1.63 3.88 3.44 0.00 -1.26 -5.18 105.19 109.50 2cu7 n GLY 7 Ca -0.10 0.84 -0.21 0.00 0.00 0.00 0.00 46.02 46.55 2cu7 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cu7 s TYR 8 N 0.00 3.02 0.14 1.61 -0.85 -1.26 -5.01 117.35 115.00 2cu7 s TYR 8 Ca 0.00 -0.23 0.08 0.00 -0.52 0.00 0.00 57.07 56.40 2cu7 s TYR 8 Cb 0.00 -1.73 -0.04 0.00 0.38 0.00 0.00 41.96 40.57 2cu7 s TYR 8 CO 0.00 0.24 -0.18 -1.54 -1.52 0.00 0.00 175.55 172.55 2cu7 s SER 9 N -3.99 2.50 -0.67 -0.18 1.04 -1.26 -5.05 113.70 106.08 2cu7 s SER 9 Ca 0.39 -0.81 -0.03 0.00 0.48 0.00 0.00 55.95 55.98 2cu7 s SER 9 Cb -0.07 -0.13 0.21 0.00 0.10 0.00 0.00 66.02 66.13 2cu7 s SER 9 CO 0.27 -0.04 2.38 0.52 0.98 0.00 0.00 173.24 177.35 2cu7 n VAL 10 N 0.52 3.52 -1.21 5.02 0.31 -1.26 -5.00 118.33 120.24 2cu7 n VAL 10 Ca -0.15 -3.72 -0.31 0.00 -0.01 0.00 0.00 64.34 60.15 2cu7 n VAL 10 Cb 0.56 -1.42 0.10 0.00 -0.91 0.00 0.00 33.84 32.18 2cu7 n VAL 10 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2cu7 s LYS 11 N -2.96 2.12 0.34 5.55 0.00 -1.26 -4.98 119.74 118.54 2cu7 s LYS 11 Ca 0.55 1.19 0.04 0.00 0.00 0.00 0.00 55.97 57.75 2cu7 s LYS 11 Cb 0.41 -1.88 -0.04 0.00 0.00 0.00 0.00 37.83 36.32 2cu7 s LYS 11 CO -0.32 -1.75 0.14 -1.58 0.00 0.00 0.00 175.35 171.84 2cu7 s TRP 12 N -2.88 1.69 0.06 1.78 0.52 -1.26 -5.17 118.94 113.68 2cu7 s TRP 12 Ca 0.62 -1.31 0.03 0.00 0.02 0.00 0.00 56.10 55.46 2cu7 s TRP 12 Cb -0.18 -0.98 -0.03 0.00 -1.15 0.00 0.00 33.47 31.14 2cu7 s TRP 12 CO 0.56 -0.41 -0.10 0.95 0.02 0.00 0.00 176.95 177.97 2cu7 s THR 13 N -3.46 0.80 0.25 2.01 -4.23 -1.26 -5.04 115.64 104.71 2cu7 s THR 13 Ca 0.33 -1.26 -0.09 0.00 -1.18 0.00 0.00 61.69 59.49 2cu7 s THR 13 Cb 0.05 -0.90 0.35 0.00 1.34 0.00 0.00 72.50 73.33 2cu7 s THR 13 CO 0.17 -0.37 1.60 0.40 -0.54 0.00 0.00 174.62 175.88 2cu7 h ILE 14 N 4.25 0.19 -0.99 2.99 5.03 -2.02 0.27 117.51 127.23 2cu7 h ILE 14 Ca -0.38 -0.01 0.31 0.00 -0.12 0.00 0.00 64.86 64.67 2cu7 h ILE 14 Cb 1.20 0.17 -0.18 0.00 -3.03 0.00 0.00 36.82 34.97 2cu7 h ILE 14 CO 0.43 0.00 0.16 -0.08 -0.68 0.00 0.00 178.15 177.99 2cu7 h GLU 15 N 0.02 0.01 0.00 2.37 4.81 -2.00 0.21 114.58 119.99 2cu7 h GLU 15 Ca 0.42 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.64 2cu7 h GLU 15 Cb 0.67 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.05 2cu7 h GLU 15 CO -0.83 0.01 -0.04 0.93 -0.73 0.00 0.00 179.01 178.35 2cu7 h GLU 16 N 0.01 0.00 -0.78 1.92 3.07 -0.93 -3.21 114.58 114.65 2cu7 h GLU 16 Ca 0.67 0.00 0.30 0.00 -0.50 0.00 0.00 59.36 59.82 2cu7 h GLU 16 Cb 1.50 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 29.26 2cu7 h GLU 16 CO -0.88 0.11 0.30 1.63 -1.40 0.00 0.00 179.01 178.77 2cu7 n LYS 17 N -4.75 -0.05 0.33 2.33 5.02 -0.46 0.06 118.16 120.65 2cu7 n LYS 17 Ca -0.02 1.11 -0.14 0.00 -2.02 0.00 0.00 58.31 57.24 2cu7 n LYS 17 Cb 0.07 -1.92 -0.06 0.00 -0.02 0.00 0.00 35.03 33.10 2cu7 n LYS 17 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2cu7 h GLU 18 N 0.00 -0.86 0.50 1.97 4.39 -1.11 -2.95 114.58 116.52 2cu7 h GLU 18 Ca 0.61 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 60.35 2cu7 h GLU 18 Cb 1.53 0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 30.36 2cu7 h GLU 18 CO -0.64 -0.57 -0.50 -0.07 -1.16 0.00 0.00 179.01 176.06 2cu7 h LEU 19 N -1.21 -1.38 -0.82 1.33 3.38 -0.37 -1.51 115.31 114.73 2cu7 h LEU 19 Ca -0.09 0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.08 2cu7 h LEU 19 Cb 0.68 0.46 -0.11 0.00 0.09 0.00 0.00 40.66 41.78 2cu7 h LEU 19 CO 0.15 -0.66 -0.42 0.33 0.09 0.00 0.00 178.44 177.93 2cu7 n PHE 20 N -5.50 -0.22 0.30 1.13 -0.00 0.90 -0.55 117.46 113.53 2cu7 n PHE 20 Ca -0.12 1.01 -0.17 0.00 -0.00 0.00 0.00 57.45 58.17 2cu7 n PHE 20 Cb 0.46 -0.65 -0.09 0.00 -0.00 0.00 0.00 39.48 39.20 2cu7 n PHE 20 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 2cu7 h GLU 21 N 0.00 -0.87 -0.99 -4.13 5.08 -1.32 0.16 114.58 112.50 2cu7 h GLU 21 Ca 0.19 0.06 0.12 0.00 -1.00 0.00 0.00 59.36 58.72 2cu7 h GLU 21 Cb 0.39 0.20 -0.14 0.00 0.50 0.00 0.00 28.75 29.70 2cu7 h GLU 21 CO -0.78 -0.58 -0.51 0.94 -1.00 0.00 0.00 179.01 177.08 2cu7 n GLN 22 N -5.52 -0.36 -0.07 2.33 7.27 0.29 0.14 117.38 121.47 2cu7 n GLN 22 Ca -0.12 1.51 -0.05 0.00 0.07 0.00 0.00 57.00 58.42 2cu7 n GLN 22 Cb 0.41 -2.23 0.16 0.00 2.41 0.00 0.00 30.24 30.98 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 0.76 0.46 1.69 0.00 -1.01 -1.78 103.07 103.19 2cu7 h GLY 23 Ca 0.23 -0.56 0.14 0.00 0.00 0.00 0.00 47.33 47.14 2cu7 h GLY 23 CO -0.96 0.52 0.60 -2.00 0.00 0.00 0.00 176.54 174.70 2cu7 h LEU 24 N 0.64 0.74 0.21 3.11 5.85 0.27 0.95 115.31 127.08 2cu7 h LEU 24 Ca 0.11 0.05 -0.34 0.00 0.84 0.00 0.00 57.88 58.54 2cu7 h LEU 24 Cb 0.57 -0.10 0.02 0.00 0.37 0.00 0.00 40.66 41.53 2cu7 h LEU 24 CO 0.04 0.37 -1.59 0.00 -0.34 0.00 0.00 178.44 176.91 2cu7 h ALA 25 N 1.59 0.02 0.23 1.25 0.00 -0.95 -0.52 119.26 120.89 2cu7 h ALA 25 Ca 0.48 -1.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 2cu7 h ALA 25 Cb 0.68 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2cu7 h ALA 25 CO -0.24 0.89 -0.11 -0.22 0.00 0.00 0.00 179.25 179.57 2cu7 h LYS 26 N 0.12 -0.30 0.00 0.00 3.64 -0.53 -3.34 116.57 116.16 2cu7 h LYS 26 Ca -0.29 0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.00 2cu7 h LYS 26 Cb 2.12 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.99 2cu7 h LYS 26 CO 0.22 -0.20 -0.55 0.74 -2.27 0.00 0.00 179.45 177.39 2cu7 h PHE 27 N -0.61 0.00 0.00 1.91 0.04 0.70 -3.50 116.94 115.48 2cu7 h PHE 27 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 2cu7 h PHE 27 Cb 0.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.39 2cu7 h PHE 27 CO 0.05 0.55 0.00 0.41 -0.60 0.00 0.00 178.31 178.72 2cu7 n GLY 28 N 0.57 0.70 1.59 -1.45 0.00 -0.20 -4.40 105.19 102.00 2cu7 n GLY 28 Ca -0.00 -1.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.19 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 1.60 -3.07 1.61 1.74 -1.25 -4.08 116.66 113.20 2cu7 n ARG 29 Ca 0.00 -1.43 -0.41 0.00 -0.77 0.00 0.00 57.85 55.24 2cu7 n ARG 29 Cb 0.00 -1.56 -0.06 0.00 -1.02 0.00 0.00 32.46 29.82 2cu7 n ARG 29 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2cu7 s ARG 30 N -1.57 3.91 0.03 5.56 1.81 -1.26 -4.93 118.95 122.51 2cu7 s ARG 30 Ca 0.27 0.37 -0.04 0.00 -1.72 0.00 0.00 55.73 54.61 2cu7 s ARG 30 Cb 0.23 -3.73 -0.28 0.00 -0.45 0.00 0.00 34.95 30.71 2cu7 s ARG 30 CO 0.05 -0.61 0.98 -1.49 -0.68 0.00 0.00 175.30 173.56 2cu7 h TRP 31 N 8.17 0.50 -0.68 -0.53 -0.00 -1.95 -2.81 115.95 118.65 2cu7 h TRP 31 Ca -0.26 -0.36 -0.03 0.00 -0.00 0.00 0.00 58.89 58.24 2cu7 h TRP 31 Cb 1.11 -0.02 -0.03 0.00 -0.00 0.00 0.00 29.16 30.22 2cu7 h TRP 31 CO 0.76 1.35 0.30 1.15 -0.00 0.00 0.00 178.44 182.01 2cu7 h THR 32 N 0.07 1.23 0.00 1.49 2.02 -1.91 0.80 112.91 116.61 2cu7 h THR 32 Ca -0.20 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.29 2cu7 h THR 32 Cb 2.01 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 68.80 2cu7 h THR 32 CO 0.19 0.27 -0.09 0.11 0.37 0.00 0.00 175.52 176.37 2cu7 h LYS 33 N 0.97 0.06 0.22 6.66 1.79 -1.99 -3.27 116.57 121.02 2cu7 h LYS 33 Ca 0.23 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2cu7 h LYS 33 Cb 0.14 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 2cu7 h LYS 33 CO -0.03 0.85 -0.18 0.82 -1.08 0.00 0.00 179.45 179.83 2cu7 h ILE 34 N -0.70 0.61 -0.92 1.86 2.04 -1.41 -2.66 117.51 116.32 2cu7 h ILE 34 Ca -0.01 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.01 2cu7 h ILE 34 Cb 0.88 0.61 -0.16 0.00 -0.74 0.00 0.00 36.82 37.41 2cu7 h ILE 34 CO 0.02 0.00 -0.30 -1.28 0.00 0.00 0.00 178.15 176.58 2cu7 h SER 35 N -0.42 -1.12 -0.48 1.72 0.87 -0.97 0.49 113.55 113.65 2cu7 h SER 35 Ca -0.01 0.29 0.04 0.00 -1.23 0.00 0.00 61.79 60.88 2cu7 h SER 35 Cb 0.38 0.65 -0.04 0.00 -0.44 0.00 0.00 62.40 62.94 2cu7 h SER 35 CO -0.02 -0.30 0.23 0.50 -0.53 0.00 0.00 176.83 176.71 2cu7 h LYS 36 N -0.02 0.44 -0.70 2.24 3.64 -1.55 0.10 116.57 120.73 2cu7 h LYS 36 Ca 0.39 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.75 2cu7 h LYS 36 Cb 0.64 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.32 2cu7 h LYS 36 CO -0.94 0.29 0.46 1.25 -2.27 0.00 0.00 179.45 178.24 2cu7 h LEU 37 N 0.46 0.80 -0.69 5.20 5.85 0.17 -2.47 115.31 124.61 2cu7 h LEU 37 Ca 0.21 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.80 2cu7 h LEU 37 Cb 0.13 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2cu7 h LEU 37 CO -0.16 0.57 -0.16 0.40 -0.34 0.00 0.00 178.44 178.76 2cu7 h ILE 38 N 0.94 1.27 0.00 4.05 2.04 -0.14 -3.46 117.51 122.20 2cu7 h ILE 38 Ca 0.26 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.85 2cu7 h ILE 38 Cb -0.10 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2cu7 h ILE 38 CO -0.06 0.43 0.00 0.61 0.00 0.00 0.00 178.15 179.13 2cu7 n GLY 39 N -0.31 1.38 0.46 5.37 0.00 0.30 -4.39 105.19 108.00 2cu7 n GLY 39 Ca 0.01 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.01 -3.72 1.61 0.02 -1.90 -3.42 113.55 105.13 2cu7 h SER 40 Ca 0.00 0.04 -0.51 0.00 -0.84 0.00 0.00 61.79 60.48 2cu7 h SER 40 Cb 0.00 0.27 0.03 0.00 0.14 0.00 0.00 62.40 62.85 2cu7 h SER 40 CO 0.00 -0.69 0.56 -0.60 -1.14 0.00 0.00 176.83 174.96 2cu7 s ARG 41 N -6.01 4.50 0.13 3.45 6.06 -1.26 -5.03 118.95 120.79 2cu7 s ARG 41 Ca -0.19 1.97 -0.01 0.00 -2.50 0.00 0.00 55.73 55.01 2cu7 s ARG 41 Cb 0.03 -3.16 -0.04 0.00 0.06 0.00 0.00 34.95 31.83 2cu7 s ARG 41 CO 0.61 -0.02 0.30 0.95 -2.50 0.00 0.00 175.30 174.65 2cu7 s THR 42 N -0.80 5.29 0.23 4.11 -4.23 -1.26 -4.70 115.64 114.28 2cu7 s THR 42 Ca 0.49 -0.36 0.08 0.00 -1.18 0.00 0.00 61.69 60.71 2cu7 s THR 42 Cb -0.35 -3.68 0.27 0.00 1.34 0.00 0.00 72.50 70.08 2cu7 s THR 42 CO 0.43 -0.01 1.09 0.52 -0.54 0.00 0.00 174.62 176.11 2cu7 n VAL 43 N -0.17 -0.29 0.30 2.29 0.31 -1.26 0.08 118.33 119.59 2cu7 n VAL 43 Ca -0.05 1.46 -0.12 0.00 -0.01 0.00 0.00 64.34 65.62 2cu7 n VAL 43 Cb 0.52 -2.25 -0.06 0.00 -0.91 0.00 0.00 33.84 31.15 2cu7 n VAL 43 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2cu7 h LEU 44 N 0.00 -0.68 -0.93 7.52 3.38 -1.94 0.74 115.31 123.41 2cu7 h LEU 44 Ca 0.50 0.02 0.21 0.00 0.09 0.00 0.00 57.88 58.71 2cu7 h LEU 44 Cb 1.19 0.17 -0.12 0.00 0.09 0.00 0.00 40.66 42.00 2cu7 h LEU 44 CO -0.59 -0.39 0.47 1.56 0.09 0.00 0.00 178.44 179.59 2cu7 h GLN 45 N -0.99 0.50 0.10 1.13 4.20 -0.73 -1.22 115.11 118.08 2cu7 h GLN 45 Ca -0.08 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 2cu7 h GLN 45 Cb 0.61 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2cu7 h GLN 45 CO 0.13 0.33 -0.05 0.28 -0.67 0.00 0.00 178.83 178.86 2cu7 h VAL 46 N 0.51 1.08 -0.79 -0.54 2.07 -0.70 -2.21 116.25 115.68 2cu7 h VAL 46 Ca 0.57 -0.71 0.14 0.00 0.82 0.00 0.00 66.70 67.52 2cu7 h VAL 46 Cb 1.04 1.54 -0.14 0.00 -1.52 0.00 0.00 31.29 32.20 2cu7 h VAL 46 CO -0.48 0.17 -0.31 0.11 0.02 0.00 0.00 177.57 177.09 2cu7 h LYS 47 N -0.46 -0.06 0.51 1.57 1.57 0.36 0.84 116.57 120.90 2cu7 h LYS 47 Ca -0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2cu7 h LYS 47 Cb 0.38 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2cu7 h LYS 47 CO 0.02 -0.04 -0.24 0.77 -0.57 0.00 0.00 179.45 179.39 2cu7 h SER 48 N -0.06 -0.58 -0.92 0.86 0.02 -1.45 -3.12 113.55 108.30 2cu7 h SER 48 Ca 0.32 0.02 0.29 0.00 -0.84 0.00 0.00 61.79 61.58 2cu7 h SER 48 Cb 0.58 0.15 -0.17 0.00 0.14 0.00 0.00 62.40 63.10 2cu7 h SER 48 CO -0.83 -0.36 0.13 0.00 -1.14 0.00 0.00 176.83 174.62 2cu7 n TYR 49 N -4.11 0.70 -0.32 3.45 9.36 -0.83 -0.26 117.16 125.15 2cu7 n TYR 49 Ca -0.08 1.11 -0.01 0.00 3.32 0.00 0.00 57.90 62.24 2cu7 n TYR 49 Cb 0.27 -1.26 0.04 0.00 -0.63 0.00 0.00 39.34 37.75 2cu7 n TYR 49 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2cu7 n ALA 50 N -3.00 -0.09 0.17 2.98 0.00 0.24 0.22 120.51 121.04 2cu7 n ALA 50 Ca 0.25 0.84 0.04 0.00 0.00 0.00 0.00 53.44 54.57 2cu7 n ALA 50 Cb 0.82 -0.38 0.24 0.00 0.00 0.00 0.00 19.45 20.13 2cu7 n ALA 50 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2cu7 h ARG 51 N 0.00 0.00 -0.15 0.00 0.11 -0.75 -3.09 114.38 110.50 2cu7 h ARG 51 Ca 0.30 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.27 2cu7 h ARG 51 Cb 0.51 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.57 2cu7 h ARG 51 CO -0.83 0.45 -0.37 0.37 0.10 0.00 0.00 179.97 179.69 2cu7 h GLN 52 N 0.00 0.31 0.65 0.08 -0.00 0.31 -1.67 115.11 114.79 2cu7 h GLN 52 Ca -0.00 -0.14 -0.03 0.00 -0.00 0.00 0.00 58.65 58.48 2cu7 h GLN 52 Cb 1.06 -0.01 0.01 0.00 0.00 0.00 0.00 27.48 28.54 2cu7 h GLN 52 CO 0.06 0.64 -0.31 -0.92 0.00 0.00 0.00 178.83 178.30 2cu7 h TYR 53 N 0.26 -0.81 -0.77 3.99 3.20 -0.22 -3.02 116.97 119.62 2cu7 h TYR 53 Ca 0.03 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.93 2cu7 h TYR 53 Cb 0.78 0.27 -0.05 0.00 1.54 0.00 0.00 36.73 39.26 2cu7 h TYR 53 CO 0.02 -0.50 0.47 0.74 -1.64 0.00 0.00 178.16 177.24 2cu7 h PHE 54 N -1.02 0.87 -0.88 -3.82 0.04 -1.62 -2.27 116.94 108.25 2cu7 h PHE 54 Ca -0.09 0.03 0.23 0.00 2.80 0.00 0.00 57.97 60.94 2cu7 h PHE 54 Cb 0.67 -0.28 -0.15 0.00 2.20 0.00 0.00 35.95 38.39 2cu7 h PHE 54 CO 0.04 0.45 0.15 -0.22 -0.60 0.00 0.00 178.31 178.13 2cu7 h LYS 55 N 0.87 0.14 0.45 1.51 3.64 -1.31 -0.50 116.57 121.36 2cu7 h LYS 55 Ca 0.33 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.68 2cu7 h LYS 55 Cb 0.13 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2cu7 h LYS 55 CO -0.16 0.09 -0.21 -0.91 -2.27 0.00 0.00 179.45 175.99 2cu7 h ASN 56 N 0.14 -0.51 -0.31 4.20 2.35 -1.27 -3.26 115.58 116.92 2cu7 h ASN 56 Ca 0.54 -0.05 0.03 0.00 -0.55 0.00 0.00 56.30 56.27 2cu7 h ASN 56 Cb 1.08 0.13 -0.04 0.00 0.05 0.00 0.00 38.32 39.54 2cu7 h ASN 56 CO -0.71 -0.26 -0.18 0.29 -1.65 0.00 0.00 177.43 174.91 2cu7 n LYS 57 N -5.29 -0.14 -5.20 0.81 4.01 -0.21 -4.32 118.16 107.82 2cu7 n LYS 57 Ca -0.11 0.87 -0.32 0.00 -0.51 0.00 0.00 58.31 58.25 2cu7 n LYS 57 Cb 0.28 -1.30 -0.16 0.00 -0.51 0.00 0.00 35.03 33.35 2cu7 n LYS 57 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2cu7 s VAL 58 N -4.02 2.24 0.22 -0.18 1.01 -1.11 -5.13 120.40 113.44 2cu7 s VAL 58 Ca -0.04 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 2cu7 s VAL 58 Cb 0.03 -1.82 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 2cu7 s VAL 58 CO 0.19 0.57 0.59 -0.54 0.00 0.00 0.00 175.10 175.91 2cu7 s LYS 59 N -0.33 3.89 -0.11 2.72 1.02 -1.26 -4.63 119.74 121.04 2cu7 s LYS 59 Ca 0.02 0.41 -0.13 0.00 0.02 0.00 0.00 55.97 56.28 2cu7 s LYS 59 Cb -0.12 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.45 2cu7 s LYS 59 CO 0.02 0.33 -0.26 0.00 -0.92 0.00 0.00 175.35 174.52 2cu7 s GLY 61 N -4.65 1.94 0.17 0.00 0.00 -1.26 -4.99 107.32 98.53 2cu7 s GLY 61 Ca -0.22 -0.73 0.06 0.00 0.00 0.00 0.00 44.72 43.83 2cu7 s GLY 61 CO 0.32 -0.07 1.38 0.17 0.00 0.00 0.00 173.10 174.90 2cu7 h LEU 62 N 6.28 0.09 -8.01 0.66 -0.00 -2.05 -3.39 115.31 108.88 2cu7 h LEU 62 Ca -0.41 -0.08 -0.62 0.00 -0.00 0.00 0.00 57.88 56.77 2cu7 h LEU 62 Cb 1.18 -0.03 -0.09 0.00 -0.00 0.00 0.00 40.66 41.72 2cu7 h LEU 62 CO 0.67 0.93 1.75 -0.62 -0.00 0.00 0.00 178.44 181.17 2cu7 s ASP 63 N -6.83 6.57 0.11 0.17 -1.08 -1.26 -4.95 116.67 109.40 2cu7 s ASP 63 Ca -0.01 -1.83 0.11 0.00 -0.52 0.00 0.00 52.55 50.29 2cu7 s ASP 63 Cb 0.11 -2.57 -0.04 0.00 -1.46 0.00 0.00 42.92 38.95 2cu7 s ASP 63 CO 0.81 -1.44 -0.27 -1.59 0.52 0.00 0.00 175.17 173.21 2cu7 s LYS 64 N 4.76 1.50 0.33 4.34 -2.85 -1.26 -5.14 119.74 121.43 2cu7 s LYS 64 Ca 0.50 -1.28 -0.10 0.00 -1.00 0.00 0.00 55.97 54.09 2cu7 s LYS 64 Cb 0.01 -1.91 -0.07 0.00 -2.06 0.00 0.00 37.83 33.80 2cu7 s LYS 64 CO -0.02 0.46 0.68 -1.83 0.10 0.00 0.00 175.35 174.74 2cu7 s GLU 65 N -1.84 3.80 0.03 1.78 4.04 -1.26 -5.10 118.70 120.15 2cu7 s GLU 65 Ca 0.13 0.39 -0.03 0.00 0.04 0.00 0.00 54.97 55.50 2cu7 s GLU 65 Cb -0.10 -2.50 -0.02 0.00 0.02 0.00 0.00 34.13 31.54 2cu7 s GLU 65 CO 0.05 0.12 0.03 0.95 -1.84 0.00 0.00 175.26 174.57 2cu7 s THR 66 N -2.13 0.13 0.76 1.83 -4.23 -1.26 -5.16 115.64 105.58 2cu7 s THR 66 Ca 0.50 -1.04 -0.11 0.00 -1.18 0.00 0.00 61.69 59.85 2cu7 s THR 66 Cb -0.11 -0.62 0.05 0.00 1.34 0.00 0.00 72.50 73.17 2cu7 s THR 66 CO 0.26 -0.57 1.09 -2.16 -0.54 0.00 0.00 174.62 172.70 2cu7 s PRO 67 N -2.07 2.32 0.10 3.99 0.04 -1.26 -4.97 135.00 133.15 2cu7 s PRO 67 Ca -0.10 1.19 -0.34 0.00 0.04 0.00 0.00 61.00 61.80 2cu7 s PRO 67 Cb -0.05 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.45 2cu7 s PRO 67 CO -0.03 -1.60 1.57 -0.97 0.04 0.00 0.00 177.00 176.01 2cu7 h ASN 68 N -0.99 -1.40 -4.85 6.66 -0.73 -2.08 -3.44 115.58 108.75 2cu7 h ASN 68 Ca -0.44 0.14 -0.23 0.00 1.87 0.00 0.00 56.30 57.64 2cu7 h ASN 68 Cb 1.23 0.50 -0.21 0.00 0.27 0.00 0.00 38.32 40.12 2cu7 h ASN 68 CO 0.52 -0.56 -0.72 -1.58 -0.37 0.00 0.00 177.43 174.72 2cu7 s GLN 69 N -5.86 0.47 0.53 6.67 2.00 -1.26 -5.13 119.66 117.08 2cu7 s GLN 69 Ca -0.17 -0.75 -0.21 0.00 -2.00 0.00 0.00 55.36 52.23 2cu7 s GLN 69 Cb 0.06 -0.12 -0.07 0.00 0.80 0.00 0.00 33.01 33.67 2cu7 s GLN 69 CO 0.62 0.00 0.95 1.63 -0.50 0.00 0.00 175.29 177.99 2cu7 n LYS 70 N 1.38 1.06 -0.35 1.67 4.76 -1.26 -4.87 118.16 120.55 2cu7 n LYS 70 Ca -0.22 0.40 0.05 0.00 -2.87 0.00 0.00 58.31 55.66 2cu7 n LYS 70 Cb 0.55 -2.09 0.22 0.00 -1.84 0.00 0.00 35.03 31.87 2cu7 n LYS 70 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2cu7 h THR 71 N 0.88 1.03 0.00 -0.18 1.03 -2.00 -3.54 112.91 110.13 2cu7 h THR 71 Ca -0.47 -0.37 0.00 0.00 -0.01 0.00 0.00 66.41 65.56 2cu7 h THR 71 Cb 1.36 -0.14 0.00 0.00 -1.07 0.00 0.00 68.15 68.30 2cu7 h THR 71 CO 0.53 0.19 0.00 0.61 -0.01 0.00 0.00 175.52 176.84