#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p62 s ARG 2 N 0.00 4.52 -0.09 2.12 0.52 0.26 -4.91 118.95 121.36 2p62 s ARG 2 Ca 0.00 1.13 0.03 0.00 -0.52 0.00 0.00 55.73 56.37 2p62 s ARG 2 Cb 0.00 -3.38 -0.01 0.00 0.52 0.00 0.00 34.95 32.08 2p62 s ARG 2 CO 0.00 0.22 -0.19 0.42 0.02 0.00 0.00 175.30 175.78 2p62 s ILE 3 N 0.12 2.56 -0.05 1.52 1.01 -1.01 0.57 121.20 125.93 2p62 s ILE 3 Ca 0.41 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 60.24 2p62 s ILE 3 Cb -0.21 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.25 2p62 s ILE 3 CO 0.24 0.55 -0.16 -0.54 0.00 0.00 0.00 174.94 175.03 2p62 s LYS 4 N 0.07 1.78 -0.20 2.79 1.02 -0.08 -1.96 119.74 123.15 2p62 s LYS 4 Ca -0.08 -0.57 -0.09 0.00 0.02 0.00 0.00 55.97 55.26 2p62 s LYS 4 Cb -0.15 -1.52 -0.04 0.00 -0.52 0.00 0.00 37.83 35.60 2p62 s LYS 4 CO 0.05 0.19 0.10 -1.17 -0.92 0.00 0.00 175.35 173.60 2p62 s LEU 5 N 0.18 3.97 -0.21 3.17 2.96 -0.18 -0.60 118.68 127.95 2p62 s LEU 5 Ca -0.06 0.12 -0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2p62 s LEU 5 Cb -0.12 -2.02 0.02 0.00 0.50 0.00 0.00 46.19 44.57 2p62 s LEU 5 CO 0.03 0.15 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.45 2p62 s ILE 6 N 0.53 2.46 -0.24 6.68 1.01 0.84 0.11 121.20 132.59 2p62 s ILE 6 Ca 0.05 -0.99 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 2p62 s ILE 6 Cb -0.12 -2.16 -0.01 0.00 0.01 0.00 0.00 42.46 40.18 2p62 s ILE 6 CO 0.00 0.37 -0.00 -0.63 0.00 0.00 0.00 174.94 174.68 2p62 s ILE 7 N 1.30 3.66 0.42 2.92 1.01 0.16 -0.90 121.20 129.77 2p62 s ILE 7 Ca 0.02 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.28 2p62 s ILE 7 Cb -0.15 -2.71 -0.06 0.00 0.01 0.00 0.00 42.46 39.56 2p62 s ILE 7 CO -0.09 0.36 0.02 0.68 0.00 0.00 0.00 174.94 175.92 2p62 s VAL 8 N 1.51 1.57 -0.10 2.92 -7.23 -0.54 -1.19 120.40 117.34 2p62 s VAL 8 Ca 0.06 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 57.99 2p62 s VAL 8 Cb -0.15 -2.73 -0.28 0.00 0.56 0.00 0.00 36.38 33.79 2p62 s VAL 8 CO -0.01 0.00 0.77 -0.08 -0.31 0.00 0.00 175.10 175.47 2p62 h GLU 9 N 1.73 0.16 0.00 4.82 4.81 -1.85 -3.36 114.58 120.89 2p62 h GLU 9 Ca -0.43 -0.28 -0.17 0.00 -0.13 0.00 0.00 59.36 58.35 2p62 h GLU 9 Cb 1.26 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.70 2p62 h GLU 9 CO 0.76 1.13 -0.15 0.41 -0.73 0.00 0.00 179.01 180.43 2p62 n GLY 10 N 1.64 3.16 0.29 1.92 0.00 -1.26 -1.35 105.19 109.60 2p62 n GLY 10 Ca -0.15 -1.64 -0.01 0.00 0.00 0.00 0.00 46.02 44.22 2p62 n GLY 10 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2p62 h LYS 11 N 0.00 0.83 -0.56 1.61 1.63 -1.96 -1.59 116.57 116.53 2p62 h LYS 11 Ca -0.11 -0.05 0.08 0.00 -0.85 0.00 0.00 60.65 59.72 2p62 h LYS 11 Cb 0.53 -0.19 -0.07 0.00 -0.60 0.00 0.00 32.23 31.91 2p62 h LYS 11 CO 0.16 0.55 0.21 1.79 -3.45 0.00 0.00 179.45 178.70 2p62 h THR 12 N 0.85 0.80 -0.23 1.00 1.35 -1.96 0.51 112.91 115.23 2p62 h THR 12 Ca 0.33 -0.13 -0.10 0.00 -0.55 0.00 0.00 66.41 65.96 2p62 h THR 12 Cb 0.16 0.38 -0.01 0.00 -1.73 0.00 0.00 68.15 66.94 2p62 h THR 12 CO -0.17 0.07 -0.31 0.44 -0.25 0.00 0.00 175.52 175.31 2p62 h ASP 13 N 0.39 0.47 -0.45 5.36 5.19 -1.84 -2.29 116.42 123.25 2p62 h ASP 13 Ca 0.28 -0.18 -0.13 0.00 -0.62 0.00 0.00 57.03 56.38 2p62 h ASP 13 Cb 0.32 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.68 2p62 h ASP 13 CO -0.28 0.76 -0.24 -0.08 -3.12 0.00 0.00 179.24 176.29 2p62 h GLU 14 N 0.40 0.97 -0.28 3.56 4.81 -0.28 -2.74 114.58 121.02 2p62 h GLU 14 Ca 0.05 -0.42 -0.04 0.00 -0.13 0.00 0.00 59.36 58.82 2p62 h GLU 14 Cb 0.74 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2p62 h GLU 14 CO 0.06 1.09 -0.00 0.77 -0.73 0.00 0.00 179.01 180.20 2p62 h SER 15 N 0.83 0.48 -0.16 1.04 0.02 -0.80 -0.63 113.55 114.32 2p62 h SER 15 Ca 0.10 -0.31 0.05 0.00 -0.84 0.00 0.00 61.79 60.79 2p62 h SER 15 Cb 0.81 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.17 2p62 h SER 15 CO 0.07 0.67 -0.18 0.15 -1.14 0.00 0.00 176.83 176.40 2p62 h PHE 16 N 0.28 -0.46 -0.38 3.45 3.04 -1.41 0.34 116.94 121.80 2p62 h PHE 16 Ca 0.08 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 61.93 2p62 h PHE 16 Cb 0.43 0.23 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 2p62 h PHE 16 CO 0.04 -0.25 -0.27 0.74 -2.02 0.00 0.00 178.31 176.55 2p62 h PHE 17 N -0.21 0.90 -0.49 0.41 0.04 -1.45 -3.02 116.94 113.12 2p62 h PHE 17 Ca 0.11 -0.22 -0.03 0.00 2.80 0.00 0.00 57.97 60.63 2p62 h PHE 17 Cb 0.37 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 2p62 h PHE 17 CO -0.31 0.96 0.21 -0.22 -0.60 0.00 0.00 178.31 178.36 2p62 h LYS 18 N 0.67 0.73 -0.40 1.51 3.11 -0.60 0.44 116.57 122.03 2p62 h LYS 18 Ca 0.08 -0.13 -0.10 0.00 -2.81 0.00 0.00 60.65 57.70 2p62 h LYS 18 Cb 0.79 -0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 31.88 2p62 h LYS 18 CO 0.07 0.64 -0.17 -0.24 -2.81 0.00 0.00 179.45 176.94 2p62 h VAL 19 N 0.65 1.26 -0.15 2.00 3.04 -0.94 -0.61 116.25 121.51 2p62 h VAL 19 Ca 0.17 -1.25 -0.05 0.00 -1.01 0.00 0.00 66.70 64.56 2p62 h VAL 19 Cb 0.18 1.14 -0.00 0.00 -2.01 0.00 0.00 31.29 30.59 2p62 h VAL 19 CO -0.02 0.42 -0.12 -0.07 -1.01 0.00 0.00 177.57 176.78 2p62 h LEU 20 N 0.67 0.36 -1.44 3.16 3.38 -1.38 -0.19 115.31 119.87 2p62 h LEU 20 Ca 0.10 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 2p62 h LEU 20 Cb 0.66 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2p62 h LEU 20 CO 0.05 0.74 -0.14 -0.07 0.09 0.00 0.00 178.44 179.10 2p62 h LEU 21 N -0.02 0.18 0.00 1.67 3.38 -0.79 -0.24 115.31 119.50 2p62 h LEU 21 Ca 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2p62 h LEU 21 Cb 0.62 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2p62 h LEU 21 CO 0.03 0.35 -0.21 -0.33 0.09 0.00 0.00 178.44 178.37 2p62 h GLU 22 N 0.18 0.00 0.00 1.13 5.08 -1.10 -0.82 114.58 119.05 2p62 h GLU 22 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2p62 h GLU 22 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2p62 h GLU 22 CO 0.02 0.00 0.00 0.87 -1.00 0.00 0.00 179.01 178.90 2p62 h LYS 23 N -0.63 0.00 0.00 2.33 1.79 -1.13 -1.92 116.57 117.00 2p62 h LYS 23 Ca 0.00 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.25 2p62 h LYS 23 Cb 0.21 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.82 2p62 h LYS 23 CO 0.00 0.00 -1.82 -0.11 -1.08 0.00 0.00 179.45 176.44 2p62 n LEU 24 N -2.97 1.69 -0.72 2.94 7.94 -0.14 -4.72 117.00 121.03 2p62 n LEU 24 Ca 0.01 -0.05 0.06 0.00 -1.11 0.00 0.00 56.01 54.93 2p62 n LEU 24 Cb 0.31 -0.17 0.17 0.00 0.53 0.00 0.00 43.42 44.25 2p62 n LEU 24 CO 0.27 0.55 0.63 -1.22 -1.11 0.00 0.00 177.39 176.51 2p62 n TYR 25 N -2.71 0.49 -0.99 1.96 4.02 -0.97 -4.99 117.16 113.96 2p62 n TYR 25 Ca -0.23 -0.45 0.00 0.00 -0.01 0.00 0.00 57.90 57.21 2p62 n TYR 25 Cb 0.82 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 40.12 2p62 n TYR 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2p62 n GLY 26 N 0.68 0.39 3.78 2.72 0.00 -0.72 -4.94 105.19 107.10 2p62 n GLY 26 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 2p62 n GLY 26 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2p62 s PHE 27 N -1.82 3.14 0.09 1.61 0.08 -0.32 -4.83 117.98 115.93 2p62 s PHE 27 Ca 0.00 1.60 0.09 0.00 0.12 0.00 0.00 56.93 58.74 2p62 s PHE 27 Cb 0.00 -3.24 -0.03 0.00 -0.57 0.00 0.00 43.02 39.18 2p62 s PHE 27 CO 0.00 -0.97 -0.24 0.50 -0.10 0.00 0.00 175.22 174.41 2p62 s ARG 28 N -2.48 1.41 0.22 0.44 6.06 0.55 -4.18 118.95 120.97 2p62 s ARG 28 Ca 0.59 -1.17 -0.30 0.00 -2.50 0.00 0.00 55.73 52.35 2p62 s ARG 28 Cb -0.25 -1.70 -0.09 0.00 0.06 0.00 0.00 34.95 32.97 2p62 s ARG 28 CO 0.32 0.42 1.20 -2.00 -2.50 0.00 0.00 175.30 172.74 2p62 s GLU 29 N -1.67 4.49 0.41 5.12 2.12 -1.26 0.11 118.70 128.02 2p62 s GLU 29 Ca 0.10 1.93 -0.22 0.00 0.36 0.00 0.00 54.97 57.13 2p62 s GLU 29 Cb -0.10 -3.20 -0.13 0.00 0.26 0.00 0.00 34.13 30.96 2p62 s GLU 29 CO 0.04 -0.06 0.49 0.00 -0.54 0.00 0.00 175.26 175.20 2p62 n ALA 30 N 2.03 -1.71 -0.73 6.30 0.00 0.19 -4.86 120.51 121.73 2p62 n ALA 30 Ca 0.03 0.17 -0.06 0.00 0.00 0.00 0.00 53.44 53.58 2p62 n ALA 30 Cb 0.44 -1.73 0.09 0.00 0.00 0.00 0.00 19.45 18.25 2p62 n ALA 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2p62 n LYS 31 N 0.70 -1.92 0.01 0.00 5.02 -1.26 -4.73 118.16 115.98 2p62 n LYS 31 Ca 0.12 -0.46 0.22 0.00 -2.02 0.00 0.00 58.31 56.17 2p62 n LYS 31 Cb 0.39 -0.71 0.73 0.00 -0.02 0.00 0.00 35.03 35.42 2p62 n LYS 31 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2p62 h LYS 32 N 0.00 0.00 -6.03 1.97 1.79 -2.04 -3.41 116.57 108.85 2p62 h LYS 32 Ca -0.12 0.00 -0.74 0.00 -2.18 0.00 0.00 60.65 57.61 2p62 h LYS 32 Cb 0.42 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2p62 h LYS 32 CO 0.07 0.00 1.20 -0.11 -1.08 0.00 0.00 179.45 179.53 2p62 n LEU 33 N -3.97 1.70 -3.77 2.94 7.94 -1.26 -4.88 117.00 115.69 2p62 n LEU 33 Ca 0.10 0.73 -0.30 0.00 -1.11 0.00 0.00 56.01 55.43 2p62 n LEU 33 Cb 0.70 -1.09 -0.09 0.00 0.53 0.00 0.00 43.42 43.47 2p62 n LEU 33 CO 0.32 -0.67 0.13 0.41 -1.11 0.00 0.00 177.39 176.47 2p62 n THR 34 N 6.07 2.32 -1.80 1.96 -1.04 -1.26 -4.97 114.28 115.56 2p62 n THR 34 Ca 0.41 -5.10 -0.36 0.00 -2.04 0.00 0.00 64.05 56.96 2p62 n THR 34 Cb 0.10 -2.18 -0.03 0.00 -1.82 0.00 0.00 70.33 66.39 2p62 n THR 34 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2p62 s PRO 35 N -1.89 2.33 -0.58 -2.82 0.04 -1.26 -4.88 135.00 125.94 2p62 s PRO 35 Ca 0.31 0.93 -0.33 0.00 0.04 0.00 0.00 61.00 61.95 2p62 s PRO 35 Cb 0.03 -4.53 -0.14 0.00 0.04 0.00 0.00 34.50 29.90 2p62 s PRO 35 CO -0.09 -3.09 2.38 0.39 0.04 0.00 0.00 177.00 176.62 2p62 n GLU 36 N 9.08 0.65 -1.74 4.56 -0.58 -1.26 -4.82 120.64 126.53 2p62 n GLU 36 Ca 0.30 0.11 -0.42 0.00 -0.42 0.00 0.00 57.16 56.73 2p62 n GLU 36 Cb 0.53 -2.30 -0.03 0.00 -0.57 0.00 0.00 31.44 29.07 2p62 n GLU 36 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 2p62 s PHE 37 N 8.71 1.37 -0.32 -0.32 0.40 -1.26 -4.88 117.98 121.68 2p62 s PHE 37 Ca 1.16 0.65 -0.27 0.00 -0.60 0.00 0.00 56.93 57.87 2p62 s PHE 37 Cb -0.89 -3.97 -0.06 0.00 0.51 0.00 0.00 43.02 38.61 2p62 s PHE 37 CO 0.46 -3.56 2.29 -1.25 0.70 0.00 0.00 175.22 173.86 2p62 s PRO 38 N 6.30 2.75 0.37 0.24 0.04 -1.26 -4.83 135.00 138.61 2p62 s PRO 38 Ca 0.93 1.80 0.18 0.00 0.04 0.00 0.00 61.00 63.95 2p62 s PRO 38 Cb -0.28 -4.45 1.14 0.00 0.04 0.00 0.00 34.50 30.95 2p62 s PRO 38 CO 0.34 -2.54 1.69 0.97 0.04 0.00 0.00 177.00 177.49 2p62 h ILE 39 N 7.36 0.34 -0.22 0.56 2.10 -1.90 0.60 117.51 126.35 2p62 h ILE 39 Ca -0.35 -0.11 0.06 0.00 1.08 0.00 0.00 64.86 65.54 2p62 h ILE 39 Cb 1.25 -0.01 -0.01 0.00 -1.09 0.00 0.00 36.82 36.96 2p62 h ILE 39 CO 1.03 0.06 0.30 1.23 -1.08 0.00 0.00 178.15 179.69 2p62 h GLY 40 N 0.32 0.00 0.00 8.18 0.00 -1.93 0.50 103.07 110.15 2p62 h GLY 40 Ca 0.71 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.76 2p62 h GLY 40 CO -0.48 0.00 -2.06 0.28 0.00 0.00 0.00 176.54 174.27 2p62 n LYS 41 N -3.55 0.76 -0.03 4.80 5.02 0.20 -4.71 118.16 120.65 2p62 n LYS 41 Ca 0.03 0.08 -0.03 0.00 -2.02 0.00 0.00 58.31 56.36 2p62 n LYS 41 Cb 0.43 -1.38 -0.13 0.00 -0.02 0.00 0.00 35.03 33.92 2p62 n LYS 41 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2p62 n TRP 42 N -2.93 0.51 -1.08 2.13 7.02 -0.81 -3.24 117.44 119.05 2p62 n TRP 42 Ca -0.31 0.17 -0.03 0.00 -1.02 0.00 0.00 57.50 56.31 2p62 n TRP 42 Cb 0.89 -0.99 -0.01 0.00 -2.42 0.00 0.00 31.31 28.77 2p62 n TRP 42 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2p62 n GLY 43 N 1.53 0.60 3.84 6.99 0.00 0.18 -4.28 105.19 114.04 2p62 n GLY 43 Ca -0.18 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 2p62 n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2p62 s PHE 44 N -2.09 3.03 0.72 1.61 2.99 -1.26 -4.41 117.98 118.57 2p62 s PHE 44 Ca 0.00 1.12 -0.11 0.00 0.00 0.00 0.00 56.93 57.94 2p62 s PHE 44 Cb 0.00 -3.09 0.02 0.00 0.00 0.00 0.00 43.02 39.95 2p62 s PHE 44 CO 0.00 -1.52 1.07 -0.98 -0.00 0.00 0.00 175.22 173.79 2p62 s ARG 45 N -5.23 2.72 0.00 0.44 1.70 -1.26 -4.79 118.95 112.52 2p62 s ARG 45 Ca 0.60 0.78 0.00 0.00 -0.47 0.00 0.00 55.73 56.64 2p62 s ARG 45 Cb -0.13 -1.98 0.00 0.00 -0.57 0.00 0.00 34.95 32.27 2p62 s ARG 45 CO 0.53 -1.21 0.14 0.44 -1.08 0.00 0.00 175.30 174.12 2p62 n ILE 46 N -3.18 0.00 -2.54 4.99 -6.64 -1.26 -3.10 119.36 107.63 2p62 n ILE 46 Ca 0.07 0.39 -0.41 0.00 -1.77 0.00 0.00 62.75 61.03 2p62 n ILE 46 Cb 0.55 -0.64 0.01 0.00 -1.44 0.00 0.00 39.64 38.13 2p62 n ILE 46 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2p62 n GLY 47 N -0.43 5.92 3.64 3.28 0.00 -1.26 -4.98 105.19 111.37 2p62 n GLY 47 Ca 0.00 -2.48 -0.35 0.00 0.00 0.00 0.00 46.02 43.19 2p62 n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2p62 s GLU 48 N -3.64 3.88 -0.54 1.61 2.12 -1.18 -5.06 118.70 115.88 2p62 s GLU 48 Ca 0.41 -0.34 0.00 0.00 0.36 0.00 0.00 54.97 55.40 2p62 s GLU 48 Cb 0.18 -3.17 0.14 0.00 0.26 0.00 0.00 34.13 31.54 2p62 s GLU 48 CO -0.11 0.33 0.32 -1.01 -0.54 0.00 0.00 175.26 174.24 2p62 s HIS 49 N 0.21 3.39 0.62 5.30 3.76 -1.26 -4.88 115.29 122.42 2p62 s HIS 49 Ca 0.04 -2.86 -0.17 0.00 -0.15 0.00 0.00 55.06 51.92 2p62 s HIS 49 Cb -0.12 -3.05 -0.02 0.00 1.11 0.00 0.00 32.58 30.49 2p62 s HIS 49 CO 0.00 -0.83 1.15 -1.25 -0.85 0.00 0.00 174.74 172.96 2p62 s PRO 50 N 0.09 2.94 -0.05 8.40 0.04 -1.26 -4.98 135.00 140.18 2p62 s PRO 50 Ca 0.15 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 2p62 s PRO 50 Cb -0.22 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 2p62 s PRO 50 CO -0.03 -1.18 0.99 -1.17 0.04 0.00 0.00 177.00 175.65 2p62 s LEU 51 N -4.37 4.31 -0.26 -3.56 2.96 -0.47 -4.89 118.68 112.41 2p62 s LEU 51 Ca 0.72 1.59 -0.01 0.00 -0.22 0.00 0.00 54.13 56.21 2p62 s LEU 51 Cb -0.25 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 42.92 2p62 s LEU 51 CO 0.35 -0.34 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.29 2p62 s VAL 52 N 1.46 2.84 -0.10 1.68 1.01 -1.26 -0.51 120.40 125.53 2p62 s VAL 52 Ca 0.50 -1.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 2p62 s VAL 52 Cb -0.20 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 2p62 s VAL 52 CO 0.23 0.15 -0.06 -0.76 0.00 0.00 0.00 175.10 174.66 2p62 s LEU 53 N 1.30 3.18 0.08 3.92 1.43 -0.30 0.56 118.68 128.85 2p62 s LEU 53 Ca -0.01 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 2p62 s LEU 53 Cb -0.17 -1.72 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 2p62 s LEU 53 CO -0.04 0.29 -0.10 -1.61 0.23 0.00 0.00 176.35 175.12 2p62 s GLU 54 N -0.40 0.74 -0.29 1.70 2.02 0.31 -0.04 118.70 122.75 2p62 s GLU 54 Ca 0.06 -1.01 -0.16 0.00 0.02 0.00 0.00 54.97 53.88 2p62 s GLU 54 Cb -0.12 -0.49 0.12 0.00 0.10 0.00 0.00 34.13 33.74 2p62 s GLU 54 CO 0.02 0.08 0.88 0.21 0.02 0.00 0.00 175.26 176.47 2p62 s LYS 55 N -2.30 0.49 5.70 1.61 2.20 -0.88 -0.33 119.74 126.22 2p62 s LYS 55 Ca -0.00 0.86 0.00 0.00 -0.36 0.00 0.00 55.97 56.46 2p62 s LYS 55 Cb -0.06 0.10 0.00 0.00 -1.51 0.00 0.00 37.83 36.37 2p62 s LYS 55 CO 0.00 -0.10 0.00 -0.25 -0.36 0.00 0.00 175.35 174.64 2p62 n ASP 56 N 3.93 0.00 -1.13 1.43 8.00 -1.26 -1.16 116.55 126.36 2p62 n ASP 56 Ca -0.19 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.38 2p62 n ASP 56 Cb 0.58 0.00 0.28 0.00 -0.02 0.00 0.00 41.12 41.96 2p62 n ASP 56 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2p62 n ASN 57 N 6.78 4.18 -4.33 -2.24 2.04 -1.26 -4.96 115.26 115.47 2p62 n ASN 57 Ca 0.00 -3.05 -0.33 0.00 -0.44 0.00 0.00 54.58 50.76 2p62 n ASN 57 Cb 0.00 -0.58 -0.15 0.00 -2.53 0.00 0.00 39.78 36.52 2p62 n ASN 57 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 2p62 s ILE 58 N -2.85 2.90 -0.16 1.53 1.01 -0.31 -0.57 121.20 122.74 2p62 s ILE 58 Ca 0.45 -0.71 -0.01 0.00 0.00 0.00 0.00 60.65 60.38 2p62 s ILE 58 Cb 0.36 -2.21 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 2p62 s ILE 58 CO 0.10 0.52 -0.12 0.00 0.00 0.00 0.00 174.94 175.44 2p62 s ALA 59 N 0.50 2.64 -0.26 9.38 0.00 0.19 -2.08 121.76 132.12 2p62 s ALA 59 Ca -0.10 -1.00 -0.06 0.00 0.00 0.00 0.00 51.96 50.80 2p62 s ALA 59 Cb -0.16 -1.34 -0.01 0.00 0.00 0.00 0.00 23.12 21.61 2p62 s ALA 59 CO 0.04 0.00 0.05 -0.51 0.00 0.00 0.00 175.76 175.35 2p62 s LEU 60 N 0.75 3.50 -0.37 0.00 1.43 0.94 -0.90 118.68 124.04 2p62 s LEU 60 Ca -0.05 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.47 2p62 s LEU 60 Cb -0.15 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2p62 s LEU 60 CO 0.01 -0.10 0.23 -0.69 0.23 0.00 0.00 176.35 176.04 2p62 s VAL 61 N 1.54 4.93 -0.18 -1.59 1.01 0.23 -1.15 120.40 125.19 2p62 s VAL 61 Ca 0.05 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 2p62 s VAL 61 Cb -0.16 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2p62 s VAL 61 CO 0.02 -0.17 0.02 -0.63 0.00 0.00 0.00 175.10 174.34 2p62 s ILE 62 N 1.63 4.35 0.09 2.22 1.01 0.33 -0.11 121.20 130.72 2p62 s ILE 62 Ca 0.04 -0.19 0.06 0.00 0.00 0.00 0.00 60.65 60.56 2p62 s ILE 62 Cb -0.18 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.31 2p62 s ILE 62 CO 0.08 0.46 -0.16 0.27 0.00 0.00 0.00 174.94 175.60 2p62 s ILE 63 N 0.49 1.29 0.30 2.92 -4.36 -0.08 -1.36 121.20 120.39 2p62 s ILE 63 Ca 0.00 -1.42 -0.02 0.00 -0.26 0.00 0.00 60.65 58.94 2p62 s ILE 63 Cb -0.13 -1.26 -0.01 0.00 1.25 0.00 0.00 42.46 42.31 2p62 s ILE 63 CO 0.02 -0.21 0.38 -1.38 0.24 0.00 0.00 174.94 173.99 2p62 s HIS 64 N -1.38 1.07 -1.54 1.37 -3.43 -1.26 -1.47 115.29 108.66 2p62 s HIS 64 Ca 0.02 -1.27 -0.16 0.00 -0.80 0.00 0.00 55.06 52.85 2p62 s HIS 64 Cb -0.09 -0.22 0.13 0.00 -1.43 0.00 0.00 32.58 30.97 2p62 s HIS 64 CO 0.03 -0.98 0.70 0.00 -2.00 0.00 0.00 174.74 172.48 2p62 n ALA 65 N -0.49 -1.19 0.12 -1.38 0.00 -0.45 -4.84 120.51 112.28 2p62 n ALA 65 Ca 0.02 0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.27 2p62 n ALA 65 Cb 0.63 -3.27 -0.14 0.00 0.00 0.00 0.00 19.45 16.66 2p62 n ALA 65 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2p62 h GLU 66 N -1.32 0.49 0.00 0.00 4.57 -1.84 -3.50 114.58 112.97 2p62 h GLU 66 Ca -0.53 -0.76 0.00 0.00 -1.18 0.00 0.00 59.36 56.89 2p62 h GLU 66 Cb 1.35 0.27 0.00 0.00 -0.16 0.00 0.00 28.75 30.21 2p62 h GLU 66 CO 0.69 1.35 0.00 0.41 -1.18 0.00 0.00 179.01 180.28 2p62 n GLY 67 N 1.54 3.88 0.34 1.92 0.00 -1.26 -4.51 105.19 107.09 2p62 n GLY 67 Ca -0.13 -1.35 0.21 0.00 0.00 0.00 0.00 46.02 44.75 2p62 n GLY 67 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2p62 h LYS 68 N 0.00 0.00 -0.01 1.61 1.63 -1.99 -0.45 116.57 117.36 2p62 h LYS 68 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2p62 h LYS 68 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2p62 h LYS 68 CO 0.00 0.00 -0.45 0.94 -3.45 0.00 0.00 179.45 176.49 2p62 n GLN 69 N -3.09 1.56 -0.01 1.90 7.27 -1.26 -4.43 117.38 119.32 2p62 n GLN 69 Ca -0.03 -0.69 0.10 0.00 0.07 0.00 0.00 57.00 56.46 2p62 n GLN 69 Cb 0.14 -1.32 -0.15 0.00 2.41 0.00 0.00 30.24 31.32 2p62 n GLN 69 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2p62 n ARG 70 N -0.36 0.60 -0.12 3.69 0.63 -0.22 -4.46 116.66 116.42 2p62 n ARG 70 Ca 0.06 -0.16 -0.05 0.00 -0.92 0.00 0.00 57.85 56.79 2p62 n ARG 70 Cb 0.35 -1.48 0.02 0.00 0.45 0.00 0.00 32.46 31.80 2p62 n ARG 70 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2p62 h ILE 71 N 0.00 0.56 -0.20 5.15 1.08 -1.67 0.25 117.51 122.69 2p62 h ILE 71 Ca 0.00 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.41 2p62 h ILE 71 Cb 0.87 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 35.16 2p62 h ILE 71 CO 0.00 0.00 -0.13 1.55 -0.69 0.00 0.00 178.15 178.88 2p62 h PRO 72 N -0.02 0.32 -0.67 2.37 0.13 -1.87 -0.69 132.00 131.58 2p62 h PRO 72 Ca 0.20 -0.08 -0.07 0.00 -0.87 0.00 0.00 66.00 65.18 2p62 h PRO 72 Cb 0.32 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.39 2p62 h PRO 72 CO -0.43 0.46 0.14 -0.22 -0.23 0.00 0.00 178.00 177.71 2p62 h LYS 73 N 0.30 1.09 -0.43 0.86 3.11 -1.29 -0.74 116.57 119.47 2p62 h LYS 73 Ca 0.06 -0.28 -0.12 0.00 -2.81 0.00 0.00 60.65 57.50 2p62 h LYS 73 Cb 0.42 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.50 2p62 h LYS 73 CO 0.02 0.98 -0.21 0.28 -2.81 0.00 0.00 179.45 177.72 2p62 h VAL 74 N 1.01 1.28 -0.60 2.00 2.07 0.11 -2.69 116.25 119.43 2p62 h VAL 74 Ca 0.21 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.31 2p62 h VAL 74 Cb 0.40 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2p62 h VAL 74 CO 0.01 0.46 0.14 -0.07 0.02 0.00 0.00 177.57 178.13 2p62 h LEU 75 N 0.72 0.91 0.03 2.57 3.38 -0.92 -1.89 115.31 120.10 2p62 h LEU 75 Ca 0.09 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2p62 h LEU 75 Cb 0.78 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2p62 h LEU 75 CO 0.06 0.91 -0.01 0.50 0.09 0.00 0.00 178.44 179.99 2p62 h LYS 76 N 0.87 -0.04 0.51 1.13 3.64 -1.11 -0.26 116.57 121.31 2p62 h LYS 76 Ca 0.19 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 2p62 h LYS 76 Cb 0.36 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 2p62 h LYS 76 CO 0.00 0.06 -0.46 0.77 -2.27 0.00 0.00 179.45 177.55 2p62 h SER 77 N -0.12 -1.25 -0.38 4.20 0.02 -1.39 0.15 113.55 114.76 2p62 h SER 77 Ca -0.00 0.10 0.08 0.00 -0.84 0.00 0.00 61.79 61.12 2p62 h SER 77 Cb 0.11 0.41 -0.08 0.00 0.14 0.00 0.00 62.40 62.98 2p62 h SER 77 CO 0.01 -0.62 -0.11 0.58 -1.14 0.00 0.00 176.83 175.54 2p62 h VAL 78 N -0.95 0.58 -0.57 2.27 2.07 -1.32 0.25 116.25 118.58 2p62 h VAL 78 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2p62 h VAL 78 Cb 0.81 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 2p62 h VAL 78 CO -0.03 0.00 0.33 -0.07 0.02 0.00 0.00 177.57 177.81 2p62 h LEU 79 N -0.03 0.51 -0.46 2.57 4.07 -0.89 0.14 115.31 121.23 2p62 h LEU 79 Ca 0.19 0.01 -0.07 0.00 0.08 0.00 0.00 57.88 58.09 2p62 h LEU 79 Cb 0.31 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.94 2p62 h LEU 79 CO -0.41 0.35 0.02 0.44 -1.08 0.00 0.00 178.44 177.76 2p62 h ASP 80 N 0.64 0.77 -0.84 -0.43 3.45 0.10 -0.60 116.42 119.51 2p62 h ASP 80 Ca 0.24 -0.30 0.01 0.00 0.43 0.00 0.00 57.03 57.41 2p62 h ASP 80 Cb 0.08 -0.21 -0.04 0.00 -0.56 0.00 0.00 39.33 38.60 2p62 h ASP 80 CO -0.13 0.88 0.55 0.28 -1.57 0.00 0.00 179.24 179.25 2p62 h SER 81 N 0.64 0.98 -0.45 6.45 0.02 0.04 -0.44 113.55 120.78 2p62 h SER 81 Ca 0.13 -0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.93 2p62 h SER 81 Cb 0.47 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 2p62 h SER 81 CO 0.02 0.72 -0.17 0.58 -1.14 0.00 0.00 176.83 176.84 2p62 h VAL 82 N 1.14 1.27 -0.74 2.27 2.07 -0.37 0.19 116.25 122.09 2p62 h VAL 82 Ca 0.31 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.52 2p62 h VAL 82 Cb -0.11 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 2p62 h VAL 82 CO -0.06 0.45 0.46 0.50 0.02 0.00 0.00 177.57 178.93 2p62 h LYS 83 N 0.74 1.00 0.00 1.57 3.64 -0.38 -1.59 116.57 121.56 2p62 h LYS 83 Ca 0.11 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2p62 h LYS 83 Cb 0.73 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2p62 h LYS 83 CO 0.06 0.70 0.00 -0.07 -2.27 0.00 0.00 179.45 177.86 2p62 h LEU 84 N 1.01 0.00 -0.10 5.20 3.38 -0.91 -3.47 115.31 120.42 2p62 h LEU 84 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2p62 h LEU 84 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2p62 h LEU 84 CO -0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.09 2p62 n GLY 85 N 0.55 0.58 0.01 0.83 0.00 -0.00 -4.97 105.19 102.19 2p62 n GLY 85 Ca 0.03 -0.78 0.09 0.00 0.00 0.00 0.00 46.02 45.36 2p62 n GLY 85 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2p62 n LEU 86 N -0.05 0.91 -3.92 0.99 4.77 0.45 -4.95 117.00 115.21 2p62 n LEU 86 Ca 0.00 -0.51 -0.15 0.00 -0.03 0.00 0.00 56.01 55.32 2p62 n LEU 86 Cb 0.45 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.39 2p62 n LEU 86 CO 0.00 0.22 -0.39 -0.76 -1.33 0.00 0.00 177.39 175.14 2p62 s LEU 87 N -2.87 1.93 -0.84 2.23 1.43 -1.22 -4.98 118.68 114.37 2p62 s LEU 87 Ca 0.07 -0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.09 2p62 s LEU 87 Cb 0.14 -0.18 0.26 0.00 0.03 0.00 0.00 46.19 46.44 2p62 s LEU 87 CO 0.76 0.03 2.18 -3.20 0.23 0.00 0.00 176.35 176.35 2p62 n ASN 88 N 3.10 7.32 -4.71 2.29 4.05 -1.26 -4.50 115.26 121.55 2p62 n ASN 88 Ca -0.14 -3.61 -0.37 0.00 0.45 0.00 0.00 54.58 50.91 2p62 n ASN 88 Cb 0.58 -1.15 -0.07 0.00 1.23 0.00 0.00 39.78 40.37 2p62 n ASN 88 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2p62 s VAL 89 N -3.96 5.24 -0.01 3.44 1.01 -1.26 -2.39 120.40 122.47 2p62 s VAL 89 Ca 0.51 0.69 0.05 0.00 0.00 0.00 0.00 61.98 63.23 2p62 s VAL 89 Cb 0.35 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 2p62 s VAL 89 CO -0.29 0.33 0.10 -1.84 0.00 0.00 0.00 175.10 173.40 2p62 n GLU 90 N 3.92 0.31 -3.87 2.72 0.28 -0.83 -4.83 120.64 118.34 2p62 n GLU 90 Ca -0.10 -0.04 -0.11 0.00 -0.16 0.00 0.00 57.16 56.75 2p62 n GLU 90 Cb 0.52 -1.12 -0.11 0.00 1.43 0.00 0.00 31.44 32.16 2p62 n GLU 90 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2p62 s GLU 91 N -2.33 0.33 -0.06 3.44 2.02 -1.26 -1.72 118.70 119.12 2p62 s GLU 91 Ca -0.02 -0.19 0.01 0.00 0.02 0.00 0.00 54.97 54.78 2p62 s GLU 91 Cb 0.03 0.14 0.02 0.00 0.10 0.00 0.00 34.13 34.42 2p62 s GLU 91 CO 0.20 -0.07 -0.04 0.08 0.02 0.00 0.00 175.26 175.45 2p62 s VAL 92 N -0.81 0.58 -0.14 2.63 1.01 -0.18 -1.02 120.40 122.48 2p62 s VAL 92 Ca -0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2p62 s VAL 92 Cb -0.05 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 2p62 s VAL 92 CO 0.01 0.25 -0.05 -0.31 0.00 0.00 0.00 175.10 175.00 2p62 s TYR 93 N 1.16 2.99 -0.25 5.22 1.51 0.12 0.37 117.35 128.47 2p62 s TYR 93 Ca -0.07 -0.27 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 2p62 s TYR 93 Cb -0.14 -1.90 0.06 0.00 -0.11 0.00 0.00 41.96 39.87 2p62 s TYR 93 CO -0.01 0.02 -0.08 0.08 -1.11 0.00 0.00 175.55 174.44 2p62 s VAL 94 N 0.14 1.90 -0.17 0.71 1.01 -0.21 -0.67 120.40 123.12 2p62 s VAL 94 Ca -0.02 -1.48 -0.05 0.00 0.00 0.00 0.00 61.98 60.43 2p62 s VAL 94 Cb -0.14 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 2p62 s VAL 94 CO 0.03 -0.08 -0.01 -0.69 0.00 0.00 0.00 175.10 174.36 2p62 s VAL 95 N 1.22 4.11 -0.05 2.92 1.01 -0.34 -0.68 120.40 128.60 2p62 s VAL 95 Ca -0.07 -0.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 2p62 s VAL 95 Cb -0.20 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.38 2p62 s VAL 95 CO -0.06 0.47 0.28 -0.60 0.00 0.00 0.00 175.10 175.20 2p62 s ARG 96 N 0.47 0.52 0.64 2.72 3.52 -0.75 -4.09 118.95 121.97 2p62 s ARG 96 Ca -0.02 0.01 -0.18 0.00 -0.13 0.00 0.00 55.73 55.41 2p62 s ARG 96 Cb -0.14 0.23 -0.02 0.00 -1.56 0.00 0.00 34.95 33.47 2p62 s ARG 96 CO 0.02 -0.12 1.20 -0.25 -0.81 0.00 0.00 175.30 175.34 2p62 n ASP 97 N 1.93 1.68 -0.10 -2.12 8.00 -1.26 -0.65 116.55 124.03 2p62 n ASP 97 Ca -0.18 0.81 -0.05 0.00 0.71 0.00 0.00 54.79 56.08 2p62 n ASP 97 Cb 0.57 -1.51 0.14 0.00 -0.02 0.00 0.00 41.12 40.29 2p62 n ASP 97 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2p62 h VAL 98 N 0.46 1.25 -0.70 2.53 2.07 -1.25 -3.22 116.25 117.39 2p62 h VAL 98 Ca -0.50 -1.10 0.13 0.00 0.82 0.00 0.00 66.70 66.05 2p62 h VAL 98 Cb 1.35 0.97 -0.09 0.00 -1.52 0.00 0.00 31.29 31.99 2p62 h VAL 98 CO 0.52 0.38 0.24 0.44 0.02 0.00 0.00 177.57 179.17 2p62 h ASP 99 N 0.72 0.18 -3.93 0.57 3.45 -1.57 -3.43 116.42 112.40 2p62 h ASP 99 Ca 0.13 0.11 -0.51 0.00 0.43 0.00 0.00 57.03 57.19 2p62 h ASP 99 Cb 0.53 0.11 0.05 0.00 -0.56 0.00 0.00 39.33 39.47 2p62 h ASP 99 CO 0.03 0.07 0.52 -1.61 -1.57 0.00 0.00 179.24 176.67 2p62 s GLU 100 N -6.05 4.11 0.53 3.56 2.02 -1.22 -4.89 118.70 116.76 2p62 s GLU 100 Ca -0.13 1.87 0.00 0.00 0.02 0.00 0.00 54.97 56.74 2p62 s GLU 100 Cb 0.20 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.69 2p62 s GLU 100 CO 0.76 -0.28 0.00 0.41 0.02 0.00 0.00 175.26 176.16 2p62 n GLY 101 N 0.67 1.04 0.00 -1.39 0.00 -1.26 -4.80 105.19 99.46 2p62 n GLY 101 Ca 0.04 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2p62 n GLY 101 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2p62 n ASN 102 N -3.19 0.00 -4.71 1.61 3.02 -1.26 -5.01 115.26 105.72 2p62 n ASN 102 Ca 0.00 -0.38 -0.43 0.00 -0.03 0.00 0.00 54.58 53.73 2p62 n ASN 102 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 2p62 n ASN 102 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2p62 n ASP 103 N -1.15 3.67 -0.12 6.41 -0.08 -1.26 -4.83 116.55 119.19 2p62 n ASP 103 Ca 0.00 1.09 0.13 0.00 -1.51 0.00 0.00 54.79 54.50 2p62 n ASP 103 Cb 0.00 -1.53 0.50 0.00 2.34 0.00 0.00 41.12 42.43 2p62 n ASP 103 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 2p62 h VAL 104 N 3.63 0.86 -0.07 5.18 3.04 -1.92 -0.91 116.25 126.05 2p62 h VAL 104 Ca -0.44 -0.14 -0.00 0.00 -1.01 0.00 0.00 66.70 65.10 2p62 h VAL 104 Cb 1.22 0.40 -0.00 0.00 -2.01 0.00 0.00 31.29 30.90 2p62 h VAL 104 CO 0.90 0.08 0.04 0.15 -1.01 0.00 0.00 177.57 177.73 2p62 h PHE 105 N 0.42 0.10 -0.76 3.17 3.04 -1.89 -0.93 116.94 120.08 2p62 h PHE 105 Ca 0.32 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.21 2p62 h PHE 105 Cb 0.67 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.12 2p62 h PHE 105 CO -0.00 0.13 0.28 0.93 -2.02 0.00 0.00 178.31 177.63 2p62 h GLU 106 N 0.03 1.16 -0.08 1.11 5.08 -1.74 -0.92 114.58 119.23 2p62 h GLU 106 Ca 0.03 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2p62 h GLU 106 Cb 0.07 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 2p62 h GLU 106 CO -0.00 0.96 -0.15 2.35 -1.00 0.00 0.00 179.01 181.17 2p62 h TRP 107 N 1.12 -0.38 -0.18 4.33 7.01 -0.83 -0.36 115.95 126.66 2p62 h TRP 107 Ca 0.25 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.25 2p62 h TRP 107 Cb 0.26 0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.49 2p62 h TRP 107 CO 0.02 -0.22 0.04 0.28 -2.79 0.00 0.00 178.44 175.77 2p62 h VAL 108 N -0.21 1.21 -0.95 2.65 2.07 -1.06 -2.97 116.25 117.00 2p62 h VAL 108 Ca 0.08 -0.68 0.17 0.00 0.82 0.00 0.00 66.70 67.09 2p62 h VAL 108 Cb 0.32 1.32 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 2p62 h VAL 108 CO -0.20 0.21 0.60 0.25 0.02 0.00 0.00 177.57 178.45 2p62 h LEU 109 N 0.10 0.67 -0.19 2.57 5.85 -0.83 0.16 115.31 123.63 2p62 h LEU 109 Ca 0.06 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2p62 h LEU 109 Cb 0.28 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2p62 h LEU 109 CO 0.00 0.29 0.00 -1.54 -0.34 0.00 0.00 178.44 176.85 2p62 n SER 110 N -4.62 0.12 0.06 1.25 3.41 -0.17 -1.65 113.62 112.01 2p62 n SER 110 Ca 0.20 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.47 2p62 n SER 110 Cb 0.56 -0.56 0.04 0.00 -0.26 0.00 0.00 64.21 63.99 2p62 n SER 110 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2p62 n PHE 111 N -1.64 0.53 -2.57 7.33 0.99 0.56 -4.55 117.46 118.10 2p62 n PHE 111 Ca 0.02 0.15 -0.41 0.00 -0.00 0.00 0.00 57.45 57.21 2p62 n PHE 111 Cb 0.11 -0.65 0.02 0.00 -1.00 0.00 0.00 39.48 37.96 2p62 n PHE 111 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2p62 n LEU 112 N -2.23 7.42 -4.82 4.37 4.77 -0.66 -4.92 117.00 120.94 2p62 n LEU 112 Ca 0.01 -5.33 -0.35 0.00 -0.03 0.00 0.00 56.01 50.31 2p62 n LEU 112 Cb 0.48 -1.18 -0.06 0.00 -2.33 0.00 0.00 43.42 40.33 2p62 n LEU 112 CO 0.40 2.04 0.51 -0.60 -1.33 0.00 0.00 177.39 178.41 2p62 s ARG 113 N -4.11 4.25 -1.38 3.23 3.00 -1.26 -3.79 118.95 118.88 2p62 s ARG 113 Ca 0.41 0.96 0.00 0.00 -1.00 0.00 0.00 55.73 56.09 2p62 s ARG 113 Cb 0.20 -2.60 0.00 0.00 0.00 0.00 0.00 34.95 32.55 2p62 s ARG 113 CO -0.14 0.22 0.00 0.39 0.00 0.00 0.00 175.30 175.77 2p62 n GLU 114 N 0.11 -1.24 -5.10 5.12 -0.58 -1.26 -5.00 120.64 112.69 2p62 n GLU 114 Ca 0.02 0.79 -0.29 0.00 -0.42 0.00 0.00 57.16 57.27 2p62 n GLU 114 Cb 0.52 -5.15 -0.16 0.00 -0.57 0.00 0.00 31.44 26.09 2p62 n GLU 114 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2p62 s ARG 115 N -4.64 1.84 -0.06 3.49 1.81 -1.25 -5.10 118.95 115.04 2p62 s ARG 115 Ca 0.00 -0.85 -0.30 0.00 -1.72 0.00 0.00 55.73 52.86 2p62 s ARG 115 Cb 0.00 -1.80 -0.02 0.00 -0.45 0.00 0.00 34.95 32.68 2p62 s ARG 115 CO 0.00 0.49 0.99 -1.21 -0.68 0.00 0.00 175.30 174.89 2p62 s GLU 116 N -0.63 4.48 0.17 3.54 0.41 -1.26 -5.02 118.70 120.39 2p62 s GLU 116 Ca 0.09 1.39 0.08 0.00 -0.41 0.00 0.00 54.97 56.13 2p62 s GLU 116 Cb -0.09 -3.50 -0.04 0.00 -1.78 0.00 0.00 34.13 28.71 2p62 s GLU 116 CO -0.01 -0.19 -0.18 0.54 -0.49 0.00 0.00 175.26 174.94 2p62 s VAL 117 N 1.55 1.82 -0.21 2.63 0.11 -1.26 -4.42 120.40 120.63 2p62 s VAL 117 Ca 0.50 -1.96 -0.14 0.00 -2.93 0.00 0.00 61.98 57.44 2p62 s VAL 117 Cb -0.19 -1.88 0.06 0.00 -1.53 0.00 0.00 36.38 32.84 2p62 s VAL 117 CO 0.22 -0.35 0.53 -0.60 -3.33 0.00 0.00 175.10 171.57 2p62 s ARG 118 N -2.92 0.55 -0.17 1.54 3.52 -0.75 -4.98 118.95 115.74 2p62 s ARG 118 Ca 0.17 0.90 -0.12 0.00 -0.13 0.00 0.00 55.73 56.55 2p62 s ARG 118 Cb -0.05 0.12 -0.05 0.00 -1.56 0.00 0.00 34.95 33.41 2p62 s ARG 118 CO 0.07 -0.13 0.22 0.08 -0.81 0.00 0.00 175.30 174.73 2p62 s VAL 119 N 1.13 5.35 -0.07 7.11 1.01 -1.26 0.06 120.40 133.73 2p62 s VAL 119 Ca -0.07 0.39 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 2p62 s VAL 119 Cb -0.06 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.81 2p62 s VAL 119 CO -0.11 0.43 0.13 -0.62 0.00 0.00 0.00 175.10 174.93 2p62 s ASP 120 N 0.32 0.84 -1.37 3.32 3.68 -0.21 -4.87 116.67 118.37 2p62 s ASP 120 Ca 0.13 0.26 -0.05 0.00 2.13 0.00 0.00 52.55 55.02 2p62 s ASP 120 Cb -0.12 0.16 0.03 0.00 -1.45 0.00 0.00 42.92 41.53 2p62 s ASP 120 CO 0.02 -0.24 0.85 0.59 0.13 0.00 0.00 175.17 176.52 2p62 n ASN 121 N 5.29 -2.81 0.00 -0.34 5.03 -1.26 -0.86 115.26 120.30 2p62 n ASN 121 Ca -0.05 -0.77 0.00 0.00 0.87 0.00 0.00 54.58 54.64 2p62 n ASN 121 Cb 0.50 -4.18 0.00 0.00 -1.02 0.00 0.00 39.78 35.08 2p62 n ASN 121 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2p62 n GLY 122 N -1.61 0.29 3.73 7.41 0.00 -1.26 -4.99 105.19 108.75 2p62 n GLY 122 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2p62 n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p62 s ALA 123 N -1.69 3.39 -0.32 4.61 0.00 -0.04 -4.63 121.76 123.07 2p62 s ALA 123 Ca 0.00 -1.24 -0.13 0.00 0.00 0.00 0.00 51.96 50.59 2p62 s ALA 123 Cb 0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 2p62 s ALA 123 CO 0.00 0.55 0.27 0.42 0.00 0.00 0.00 175.76 177.00 2p62 s ILE 124 N -1.65 5.25 -0.22 0.00 1.01 0.47 -1.05 121.20 125.02 2p62 s ILE 124 Ca 0.29 -0.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.84 2p62 s ILE 124 Cb -0.10 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 2p62 s ILE 124 CO 0.21 0.03 0.07 -0.69 0.00 0.00 0.00 174.94 174.56 2p62 s VAL 125 N 1.83 4.54 -0.16 2.92 1.01 0.11 0.03 120.40 130.68 2p62 s VAL 125 Ca 0.08 -0.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.80 2p62 s VAL 125 Cb -0.17 -3.09 0.04 0.00 0.00 0.00 0.00 36.38 33.17 2p62 s VAL 125 CO 0.11 0.39 0.44 0.28 0.00 0.00 0.00 175.10 176.32 2p62 s THR 126 N 1.07 0.00 -1.78 3.92 -1.32 -0.96 -1.81 115.64 114.76 2p62 s THR 126 Ca 0.04 -0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.51 2p62 s THR 126 Cb -0.14 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.23 2p62 s THR 126 CO 0.03 -0.01 0.00 -0.62 -2.21 0.00 0.00 174.62 171.81 2p62 n GLU 127 N 2.76 -1.66 -0.96 7.08 4.71 -1.26 -0.41 120.64 130.90 2p62 n GLU 127 Ca -0.14 1.00 0.00 0.00 -0.01 0.00 0.00 57.16 58.02 2p62 n GLU 127 Cb 0.57 -5.56 0.00 0.00 -1.01 0.00 0.00 31.44 25.44 2p62 n GLU 127 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2p62 n GLY 128 N -0.76 0.45 3.56 0.62 0.00 -1.26 -4.74 105.19 103.06 2p62 n GLY 128 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 2p62 n GLY 128 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p62 s VAL 129 N -2.11 4.42 -0.41 1.61 1.01 0.46 -4.91 120.40 120.46 2p62 s VAL 129 Ca 0.00 -0.16 -0.26 0.00 0.00 0.00 0.00 61.98 61.56 2p62 s VAL 129 Cb 0.00 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.41 2p62 s VAL 129 CO 0.00 0.45 0.95 -0.54 0.00 0.00 0.00 175.10 175.96 2p62 s LYS 130 N 0.60 3.72 -0.28 2.72 1.02 -0.70 -2.25 119.74 124.57 2p62 s LYS 130 Ca 0.01 0.44 -0.11 0.00 0.02 0.00 0.00 55.97 56.33 2p62 s LYS 130 Cb -0.13 -3.86 -0.05 0.00 -0.52 0.00 0.00 37.83 33.27 2p62 s LYS 130 CO 0.02 -1.10 0.18 0.42 -0.92 0.00 0.00 175.35 173.95 2p62 s ILE 131 N 3.69 5.23 -0.42 2.17 1.01 0.11 -1.01 121.20 131.97 2p62 s ILE 131 Ca 0.39 0.14 -0.09 0.00 0.00 0.00 0.00 60.65 61.09 2p62 s ILE 131 Cb -0.11 -3.49 0.09 0.00 0.01 0.00 0.00 42.46 38.96 2p62 s ILE 131 CO 0.23 0.26 0.27 -0.31 0.00 0.00 0.00 174.94 175.38 2p62 s TYR 132 N 1.75 3.37 -0.11 3.97 2.02 0.16 -0.39 117.35 128.11 2p62 s TYR 132 Ca 0.07 -1.65 -0.25 0.00 -0.37 0.00 0.00 57.07 54.87 2p62 s TYR 132 Cb -0.16 -3.05 -0.02 0.00 -0.40 0.00 0.00 41.96 38.32 2p62 s TYR 132 CO 0.10 -0.88 0.79 -1.25 -1.57 0.00 0.00 175.55 172.74 2p62 s PRO 133 N 1.39 4.37 -0.05 -1.71 0.04 -1.26 -1.04 135.00 136.74 2p62 s PRO 133 Ca 0.04 0.99 0.02 0.00 0.04 0.00 0.00 61.00 62.08 2p62 s PRO 133 Cb -0.23 -3.51 0.02 0.00 0.04 0.00 0.00 34.50 30.81 2p62 s PRO 133 CO 0.01 -0.15 -0.08 -0.47 0.04 0.00 0.00 177.00 176.35 2p62 s TYR 134 N 1.51 1.05 -0.23 0.56 6.14 0.15 -4.79 117.35 121.74 2p62 s TYR 134 Ca 0.39 -0.35 -0.14 0.00 0.64 0.00 0.00 57.07 57.61 2p62 s TYR 134 Cb -0.17 -0.83 -0.04 0.00 0.42 0.00 0.00 41.96 41.33 2p62 s TYR 134 CO 0.16 -0.22 0.32 0.20 0.64 0.00 0.00 175.55 176.65 2p62 s GLY 135 N 0.77 2.01 0.12 8.97 0.00 -1.26 -1.81 107.32 116.12 2p62 s GLY 135 Ca -0.13 -0.70 -0.19 0.00 0.00 0.00 0.00 44.72 43.70 2p62 s GLY 135 CO 0.02 0.73 0.61 -0.29 0.00 0.00 0.00 173.10 174.17 2p62 s MET 136 N 1.41 4.20 0.00 2.90 1.75 0.18 -4.33 119.30 125.41 2p62 s MET 136 Ca 0.15 0.75 0.00 0.00 -1.25 0.00 0.00 55.69 55.33 2p62 s MET 136 Cb -0.15 -3.11 0.00 0.00 2.84 0.00 0.00 34.83 34.41 2p62 s MET 136 CO 0.07 0.56 0.00 0.41 -0.65 0.00 0.00 175.02 175.41 2p62 n GLY 137 N 1.34 1.17 3.50 2.11 0.00 -1.26 -2.11 105.19 109.95 2p62 n GLY 137 Ca -0.07 -0.35 -0.44 0.00 0.00 0.00 0.00 46.02 45.16 2p62 n GLY 137 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2p62 s ASN 138 N -2.36 6.97 0.38 1.61 0.01 -1.26 -4.07 114.94 116.21 2p62 s ASN 138 Ca 0.00 -2.75 -0.15 0.00 -0.71 0.00 0.00 52.86 49.24 2p62 s ASN 138 Cb 0.00 -2.46 0.06 0.00 0.41 0.00 0.00 41.25 39.26 2p62 s ASN 138 CO 0.00 -0.91 0.82 0.00 -1.51 0.00 0.00 177.10 175.49 2p62 n LEU 139 N 6.64 0.00 -4.00 0.60 -0.00 -1.26 -4.87 117.00 114.11 2p62 n LEU 139 Ca 0.40 -2.49 -0.30 0.00 -0.00 0.00 0.00 56.01 53.61 2p62 n LEU 139 Cb 0.44 3.76 -0.16 0.00 -0.00 0.00 0.00 43.42 47.46 2p62 n LEU 139 CO 0.67 -0.83 -0.47 -0.89 -0.00 0.00 0.00 177.39 175.87 2p62 s THR 140 N -2.09 1.62 -0.49 1.47 2.01 -1.26 -4.96 115.64 111.94 2p62 s THR 140 Ca 0.17 -0.91 -0.18 0.00 0.31 0.00 0.00 61.69 61.07 2p62 s THR 140 Cb -0.05 -1.65 0.06 0.00 0.01 0.00 0.00 72.50 70.87 2p62 s THR 140 CO 0.11 0.24 0.56 -0.22 -0.69 0.00 0.00 174.62 174.63 2p62 s LEU 141 N 1.42 5.05 -1.29 4.42 1.98 -1.26 -4.99 118.68 124.02 2p62 s LEU 141 Ca 0.00 -0.94 -0.14 0.00 -2.89 0.00 0.00 54.13 50.16 2p62 s LEU 141 Cb -0.15 -2.41 0.12 0.00 0.66 0.00 0.00 46.19 44.41 2p62 s LEU 141 CO -0.09 -0.81 1.72 0.59 -1.89 0.00 0.00 176.35 175.87 2p62 n ASN 142 N 5.94 4.93 -3.95 3.68 3.02 -1.26 -4.90 115.26 122.71 2p62 n ASN 142 Ca -0.07 -2.96 -0.29 0.00 -0.03 0.00 0.00 54.58 51.22 2p62 n ASN 142 Cb 0.45 -1.63 -0.16 0.00 -0.61 0.00 0.00 39.78 37.83 2p62 n ASN 142 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2p62 s GLU 143 N 2.46 1.83 0.63 3.52 0.41 -1.26 -5.03 118.70 121.27 2p62 s GLU 143 Ca 0.47 -0.60 0.30 0.00 -0.41 0.00 0.00 54.97 54.73 2p62 s GLU 143 Cb 0.04 -2.11 1.61 0.00 -1.78 0.00 0.00 34.13 31.90 2p62 s GLU 143 CO 0.02 -0.37 1.95 -1.00 -0.49 0.00 0.00 175.26 175.38 2p62 h PRO 144 N 8.06 0.00 -0.46 0.39 0.13 -2.03 -1.56 132.00 136.53 2p62 h PRO 144 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2p62 h PRO 144 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2p62 h PRO 144 CO 0.45 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.41 2p62 n PHE 145 N -3.29 0.66 -4.87 1.56 3.72 -1.26 -4.94 117.46 109.03 2p62 n PHE 145 Ca 0.02 -0.52 -0.31 0.00 -0.05 0.00 0.00 57.45 56.59 2p62 n PHE 145 Cb 0.45 -0.04 -0.17 0.00 -0.94 0.00 0.00 39.48 38.79 2p62 n PHE 145 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2p62 s VAL 146 N -1.09 1.86 0.58 -4.37 1.01 -0.59 0.01 120.40 117.81 2p62 s VAL 146 Ca 0.32 -0.88 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 2p62 s VAL 146 Cb 0.17 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 2p62 s VAL 146 CO 0.21 0.51 1.22 -0.54 0.00 0.00 0.00 175.10 176.50 2p62 s LYS 147 N 0.61 3.06 -1.30 2.72 1.02 0.43 -4.72 119.74 121.57 2p62 s LYS 147 Ca -0.13 1.86 -0.11 0.00 0.02 0.00 0.00 55.97 57.61 2p62 s LYS 147 Cb -0.17 -2.00 0.14 0.00 -0.52 0.00 0.00 37.83 35.28 2p62 s LYS 147 CO 0.04 -1.14 1.86 -1.91 -0.92 0.00 0.00 175.35 173.27 2p62 n GLU 148 N -1.43 3.44 -3.60 1.68 4.07 -1.26 -4.52 120.64 119.03 2p62 n GLU 148 Ca 0.13 -3.42 -0.40 0.00 -0.06 0.00 0.00 57.16 53.41 2p62 n GLU 148 Cb 0.49 -3.03 -0.11 0.00 -0.06 0.00 0.00 31.44 28.73 2p62 n GLU 148 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2p62 s LYS 149 N 1.18 3.29 -0.51 5.31 1.02 -1.26 -5.04 119.74 123.73 2p62 s LYS 149 Ca 0.42 -0.77 -0.28 0.00 0.02 0.00 0.00 55.97 55.36 2p62 s LYS 149 Cb 0.08 -3.69 0.01 0.00 -0.52 0.00 0.00 37.83 33.71 2p62 s LYS 149 CO -0.01 -0.49 1.39 0.15 -0.92 0.00 0.00 175.35 175.47 2p62 s LYS 150 N 1.64 3.42 0.16 1.68 1.02 -1.26 -4.40 119.74 122.00 2p62 s LYS 150 Ca 0.05 0.61 -0.24 0.00 0.02 0.00 0.00 55.97 56.41 2p62 s LYS 150 Cb -0.18 -4.07 0.07 0.00 -0.52 0.00 0.00 37.83 33.13 2p62 s LYS 150 CO 0.08 -1.78 1.02 -1.83 -0.92 0.00 0.00 175.35 171.92 2p62 s GLU 151 N 5.24 1.22 0.32 1.68 -1.05 -1.21 -1.56 118.70 123.33 2p62 s GLU 151 Ca 0.55 -0.74 0.09 0.00 -0.15 0.00 0.00 54.97 54.72 2p62 s GLU 151 Cb -0.11 0.38 0.88 0.00 -0.44 0.00 0.00 34.13 34.83 2p62 s GLU 151 CO 0.28 -0.57 1.71 1.25 0.95 0.00 0.00 175.26 178.88 2p62 h LEU 152 N 2.00 0.57 -1.02 1.83 7.12 -1.91 -0.14 115.31 123.76 2p62 h LEU 152 Ca -0.26 0.15 -0.10 0.00 0.13 0.00 0.00 57.88 57.80 2p62 h LEU 152 Cb 1.22 0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 41.41 2p62 h LEU 152 CO 0.31 0.04 -0.35 -0.33 -0.13 0.00 0.00 178.44 177.98 2p62 h GLU 153 N 0.50 0.25 -0.72 1.25 3.07 -1.92 -2.08 114.58 114.94 2p62 h GLU 153 Ca 0.64 -0.11 -0.02 0.00 -0.50 0.00 0.00 59.36 59.37 2p62 h GLU 153 Cb 1.25 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 29.12 2p62 h GLU 153 CO -0.51 0.58 0.36 1.25 -1.40 0.00 0.00 179.01 179.29 2p62 h LEU 154 N 0.22 0.93 -0.49 1.33 5.85 -1.22 0.47 115.31 122.40 2p62 h LEU 154 Ca 0.03 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 2p62 h LEU 154 Cb 0.73 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 2p62 h LEU 154 CO 0.06 0.79 -0.06 0.28 -0.34 0.00 0.00 178.44 179.17 2p62 h SER 155 N 1.01 0.90 -0.65 1.25 0.02 -1.36 -1.39 113.55 113.33 2p62 h SER 155 Ca 0.25 -0.34 -0.03 0.00 -0.84 0.00 0.00 61.79 60.83 2p62 h SER 155 Cb 0.10 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 2p62 h SER 155 CO -0.03 1.02 0.29 -0.07 -1.14 0.00 0.00 176.83 176.89 2p62 h LEU 156 N 0.76 0.89 -1.11 5.07 -0.00 -0.75 -1.19 115.31 118.99 2p62 h LEU 156 Ca 0.13 -0.11 -0.07 0.00 -0.00 0.00 0.00 57.88 57.82 2p62 h LEU 156 Cb 0.60 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 41.01 2p62 h LEU 156 CO 0.04 0.78 -0.16 0.00 -0.00 0.00 0.00 178.44 179.10 2p62 h ALA 157 N 1.35 1.25 -0.18 1.53 0.00 0.25 -1.64 119.26 121.82 2p62 h ALA 157 Ca 0.23 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 2p62 h ALA 157 Cb 0.16 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2p62 h ALA 157 CO -0.02 0.49 -0.52 -0.92 0.00 0.00 0.00 179.25 178.28 2p62 h TYR 158 N 0.40 0.62 -0.57 0.00 5.03 -0.21 -1.29 116.97 120.94 2p62 h TYR 158 Ca 0.07 -0.21 -0.10 0.00 2.58 0.00 0.00 58.73 61.08 2p62 h TYR 158 Cb 0.52 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.66 2p62 h TYR 158 CO 0.02 0.91 -0.01 1.25 -1.32 0.00 0.00 178.16 179.00 2p62 h LEU 159 N 0.39 1.01 -0.89 2.82 5.85 -0.93 -1.31 115.31 122.24 2p62 h LEU 159 Ca 0.01 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 2p62 h LEU 159 Cb 1.04 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 2p62 h LEU 159 CO 0.09 1.08 0.52 0.00 -0.34 0.00 0.00 178.44 179.79 2p62 h ALA 160 N 0.97 1.14 0.68 1.25 0.00 -1.02 -1.48 119.26 120.79 2p62 h ALA 160 Ca 0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2p62 h ALA 160 Cb 0.57 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.01 2p62 h ALA 160 CO 0.03 0.62 -0.32 -0.22 0.00 0.00 0.00 179.25 179.36 2p62 h LYS 161 N 1.24 -0.87 -0.74 0.00 3.64 -0.80 -0.87 116.57 118.16 2p62 h LYS 161 Ca 0.32 0.06 0.16 0.00 -1.27 0.00 0.00 60.65 59.92 2p62 h LYS 161 Cb -0.01 0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.96 2p62 h LYS 161 CO -0.06 -0.58 0.50 -0.07 -2.27 0.00 0.00 179.45 176.97 2p62 h LEU 162 N -0.91 0.30 0.00 5.20 3.38 -1.01 0.65 115.31 122.92 2p62 h LEU 162 Ca -0.09 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2p62 h LEU 162 Cb 0.70 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2p62 h LEU 162 CO 0.15 0.15 0.00 -0.67 0.09 0.00 0.00 178.44 178.16 2p62 n ASP 163 N -4.45 0.00 0.00 -0.43 4.64 -0.58 -4.88 116.55 110.85 2p62 n ASP 163 Ca 0.14 -0.34 0.00 0.00 -1.38 0.00 0.00 54.79 53.21 2p62 n ASP 163 Cb 0.59 -0.18 0.00 0.00 -1.04 0.00 0.00 41.12 40.49 2p62 n ASP 163 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2p62 n GLY 164 N 0.77 0.64 0.14 0.27 0.00 0.23 -4.94 105.19 102.30 2p62 n GLY 164 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 2p62 n GLY 164 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2p62 h ILE 165 N 0.00 0.92 0.00 -0.61 1.08 -1.33 -1.82 117.51 115.75 2p62 h ILE 165 Ca 0.00 -0.59 -0.00 0.00 -0.39 0.00 0.00 64.86 63.88 2p62 h ILE 165 Cb 0.05 1.27 -0.00 0.00 -3.07 0.00 0.00 36.82 35.07 2p62 h ILE 165 CO 0.00 0.13 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.52 2p62 h LEU 166 N -0.54 0.00 0.01 1.44 3.38 -1.83 -1.52 115.31 116.24 2p62 h LEU 166 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2p62 h LEU 166 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2p62 h LEU 166 CO 0.04 0.01 -0.00 -0.08 0.09 0.00 0.00 178.44 178.50 2p62 h GLU 167 N 0.00 -0.01 -0.26 1.13 4.57 -1.85 -2.48 114.58 115.69 2p62 h GLU 167 Ca -0.00 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 2p62 h GLU 167 Cb 0.07 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 2p62 h GLU 167 CO 0.00 0.85 0.40 -0.22 -1.18 0.00 0.00 179.01 178.86 2p62 h LYS 168 N -0.93 0.00 0.00 1.92 3.64 -0.41 -3.37 116.57 117.41 2p62 h LYS 168 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2p62 h LYS 168 Cb 0.86 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 2p62 h LYS 168 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 2p62 n TYR 169 N -3.43 0.00 0.00 1.91 4.02 -0.82 -4.84 117.16 114.00 2p62 n TYR 169 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 2p62 n TYR 169 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 2p62 n TYR 169 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 2p62 n ARG 170 N 0.00 0.00 -0.16 -0.72 0.63 -0.94 -4.19 116.66 111.28 2p62 n ARG 170 Ca 0.00 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 57.02 2p62 n ARG 170 Cb 0.00 0.00 0.40 0.00 0.45 0.00 0.00 32.46 33.31 2p62 n ARG 170 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2p62 h GLY 171 N 0.00 0.88 1.01 5.14 0.00 -1.88 0.56 103.07 108.78 2p62 h GLY 171 Ca 0.00 -0.27 -0.17 0.00 0.00 0.00 0.00 47.33 46.90 2p62 h GLY 171 CO 0.00 0.17 -0.55 1.76 0.00 0.00 0.00 176.54 177.92 2p62 h SER 172 N 0.65 0.78 -0.96 0.19 0.02 -1.94 -2.39 113.55 109.90 2p62 h SER 172 Ca 0.32 -0.60 0.03 0.00 -0.84 0.00 0.00 61.79 60.70 2p62 h SER 172 Cb 0.39 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 2p62 h SER 172 CO -0.11 1.24 0.63 0.24 -1.14 0.00 0.00 176.83 177.69 2p62 h MET 173 N 0.36 1.20 -0.05 3.45 2.07 -1.23 0.50 114.93 121.24 2p62 h MET 173 Ca -0.02 -0.07 -0.00 0.00 -2.07 0.00 0.00 59.70 57.54 2p62 h MET 173 Cb 1.17 -0.27 -0.00 0.00 -1.87 0.00 0.00 31.60 30.63 2p62 h MET 173 CO 0.12 0.80 0.02 -0.09 1.07 0.00 0.00 176.91 178.83 2p62 h ARG 174 N 1.24 0.07 -0.35 1.72 2.43 0.03 -0.59 114.38 118.93 2p62 h ARG 174 Ca 0.37 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.51 2p62 h ARG 174 Cb -0.04 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2p62 h ARG 174 CO -0.11 0.16 0.13 0.00 -1.51 0.00 0.00 179.97 178.65 2p62 h ALA 175 N 0.90 0.46 -0.80 2.80 0.00 -0.86 -1.15 119.26 120.60 2p62 h ALA 175 Ca 0.02 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.83 2p62 h ALA 175 Cb 0.12 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2p62 h ALA 175 CO -0.00 0.07 0.51 -0.07 0.00 0.00 0.00 179.25 179.76 2p62 h LEU 176 N 0.42 0.83 0.20 0.00 -0.00 0.13 -1.58 115.31 115.30 2p62 h LEU 176 Ca 0.12 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.99 2p62 h LEU 176 Cb 0.20 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 40.69 2p62 h LEU 176 CO -0.01 0.56 -0.09 -1.28 -0.00 0.00 0.00 178.44 177.62 2p62 h SER 177 N 0.98 -0.22 -0.37 -0.43 0.87 -0.85 -0.93 113.55 112.59 2p62 h SER 177 Ca 0.33 -0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.91 2p62 h SER 177 Cb 0.05 0.06 -0.07 0.00 -0.44 0.00 0.00 62.40 62.00 2p62 h SER 177 CO -0.13 -0.09 -0.08 1.56 -0.53 0.00 0.00 176.83 177.56 2p62 h GLN 178 N -0.34 0.01 -0.11 2.24 4.20 -0.82 0.17 115.11 120.46 2p62 h GLN 178 Ca -0.03 -0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.58 2p62 h GLN 178 Cb 0.26 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2p62 h GLN 178 CO 0.04 0.01 -0.39 -0.44 -0.67 0.00 0.00 178.83 177.38 2p62 h ASP 179 N 0.01 0.25 1.16 1.46 3.32 -1.24 -2.88 116.42 118.50 2p62 h ASP 179 Ca 0.18 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.02 2p62 h ASP 179 Cb 0.27 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2p62 h ASP 179 CO -0.37 0.62 -0.53 0.50 -1.72 0.00 0.00 179.24 177.73 2p62 h LYS 180 N 0.20 0.00 -0.64 3.56 3.64 -0.55 -3.48 116.57 119.31 2p62 h LYS 180 Ca 0.02 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 2p62 h LYS 180 Cb 0.78 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 2p62 h LYS 180 CO 0.06 0.53 -0.08 0.41 -2.27 0.00 0.00 179.45 178.10 2p62 n GLY 181 N 0.85 0.33 3.57 5.01 0.00 0.53 -5.01 105.19 110.47 2p62 n GLY 181 Ca 0.01 -0.73 0.03 0.00 0.00 0.00 0.00 46.02 45.33 2p62 n GLY 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2p62 s ASP 182 N -2.90 -0.02 0.67 1.61 3.68 -1.13 -5.07 116.67 113.52 2p62 s ASP 182 Ca 0.01 -0.03 -0.14 0.00 2.13 0.00 0.00 52.55 54.52 2p62 s ASP 182 Cb -0.01 0.04 0.01 0.00 -1.45 0.00 0.00 42.92 41.51 2p62 s ASP 182 CO 0.02 -0.08 1.10 -0.54 0.13 0.00 0.00 175.17 175.80 2p62 s LYS 183 N -2.11 2.78 0.23 4.34 1.02 -1.26 -4.49 119.74 120.24 2p62 s LYS 183 Ca 0.15 1.31 -0.30 0.00 0.02 0.00 0.00 55.97 57.15 2p62 s LYS 183 Cb 0.07 -1.95 -0.09 0.00 -0.52 0.00 0.00 37.83 35.34 2p62 s LYS 183 CO -0.06 -1.26 0.96 -0.51 -0.92 0.00 0.00 175.35 173.57 2p62 s LEU 184 N -5.02 4.62 0.59 3.17 1.02 0.10 -4.77 118.68 118.39 2p62 s LEU 184 Ca 0.65 1.97 -0.08 0.00 0.02 0.00 0.00 54.13 56.68 2p62 s LEU 184 Cb -0.19 -3.61 -0.02 0.00 0.02 0.00 0.00 46.19 42.39 2p62 s LEU 184 CO 0.44 0.09 0.95 0.42 0.02 0.00 0.00 176.35 178.27 2p62 s THR 185 N -1.02 4.32 0.42 5.49 -4.23 -1.26 -0.43 115.64 118.93 2p62 s THR 185 Ca 0.42 0.44 0.10 0.00 -1.18 0.00 0.00 61.69 61.47 2p62 s THR 185 Cb -0.26 -3.71 0.29 0.00 1.34 0.00 0.00 72.50 70.15 2p62 s THR 185 CO 0.33 -0.83 2.03 1.55 -0.54 0.00 0.00 174.62 177.16 2p62 h PRO 186 N -0.21 0.48 0.00 3.99 0.13 -1.90 0.59 132.00 135.08 2p62 h PRO 186 Ca -0.45 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 2p62 h PRO 186 Cb 1.22 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2p62 h PRO 186 CO 0.62 0.32 -0.31 0.87 -0.23 0.00 0.00 178.00 179.27 2p62 h LYS 187 N 0.49 0.00 -0.36 0.86 1.57 -1.92 -2.30 116.57 114.91 2p62 h LYS 187 Ca 0.19 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.89 2p62 h LYS 187 Cb 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2p62 h LYS 187 CO -0.05 0.31 -0.10 -0.44 -0.57 0.00 0.00 179.45 178.60 2p62 h ASP 188 N 0.00 0.72 -0.16 0.86 3.45 -1.25 -2.76 116.42 117.28 2p62 h ASP 188 Ca -0.00 -0.37 0.00 0.00 0.43 0.00 0.00 57.03 57.09 2p62 h ASP 188 Cb 0.65 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.22 2p62 h ASP 188 CO 0.04 0.93 0.10 0.58 -1.57 0.00 0.00 179.24 179.32 2p62 h VAL 189 N 0.51 1.05 -0.39 -1.35 2.07 -0.89 -0.48 116.25 116.76 2p62 h VAL 189 Ca 0.09 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2p62 h VAL 189 Cb 0.62 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2p62 h VAL 189 CO 0.04 0.05 0.20 -0.03 0.02 0.00 0.00 177.57 177.85 2p62 h MET 190 N 0.23 0.53 0.00 1.57 4.05 -1.14 -0.03 114.93 120.13 2p62 h MET 190 Ca 0.06 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 59.33 2p62 h MET 190 Cb -0.02 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.66 2p62 h MET 190 CO -0.01 0.40 -0.50 0.45 0.23 0.00 0.00 176.91 177.48 2p62 h HIS 191 N 0.53 0.00 -0.15 1.39 -0.00 -1.07 -2.37 115.15 113.48 2p62 h HIS 191 Ca 0.14 0.00 -0.17 0.00 -0.00 0.00 0.00 60.37 60.33 2p62 h HIS 191 Cb 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.44 2p62 h HIS 191 CO 0.00 0.50 -0.63 0.82 -0.00 0.00 0.00 177.93 178.63 2p62 h ILE 192 N 0.00 1.33 -0.69 2.45 2.04 -1.01 -2.80 117.51 118.83 2p62 h ILE 192 Ca -0.00 -1.91 -0.02 0.00 1.00 0.00 0.00 64.86 63.93 2p62 h ILE 192 Cb 1.15 1.89 -0.03 0.00 -0.74 0.00 0.00 36.82 39.08 2p62 h ILE 192 CO 0.06 0.59 0.36 0.25 0.00 0.00 0.00 178.15 179.42 2p62 h LEU 193 N 0.40 0.86 -0.95 1.44 5.85 -0.78 0.13 115.31 122.27 2p62 h LEU 193 Ca -0.01 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 2p62 h LEU 193 Cb 1.19 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 2p62 h LEU 193 CO 0.12 0.71 0.52 0.28 -0.34 0.00 0.00 178.44 179.72 2p62 h SER 194 N 0.97 1.11 -0.17 1.25 0.02 -1.17 -0.88 113.55 114.67 2p62 h SER 194 Ca 0.24 -0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 60.98 2p62 h SER 194 Cb 0.05 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.31 2p62 h SER 194 CO -0.04 0.88 -0.41 0.40 -1.14 0.00 0.00 176.83 176.52 2p62 h ILE 195 N 1.26 1.34 0.00 3.27 2.04 -1.21 0.50 117.51 124.71 2p62 h ILE 195 Ca 0.32 -1.66 -0.02 0.00 1.00 0.00 0.00 64.86 64.50 2p62 h ILE 195 Cb -0.01 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.02 2p62 h ILE 195 CO -0.06 0.51 -0.11 0.00 0.00 0.00 0.00 178.15 178.49 2p62 h ALA 196 N 0.57 1.34 -0.35 1.87 0.00 -0.42 -2.03 119.26 120.23 2p62 h ALA 196 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2p62 h ALA 196 Cb 1.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2p62 h ALA 196 CO 0.09 0.14 0.00 0.09 0.00 0.00 0.00 179.25 179.57 2p62 n ASN 197 N -3.71 2.98 -3.80 0.00 5.03 -0.37 -4.98 115.26 110.41 2p62 n ASN 197 Ca -0.02 -1.91 -0.24 0.00 0.87 0.00 0.00 54.58 53.29 2p62 n ASN 197 Cb 0.22 -0.23 0.01 0.00 -1.02 0.00 0.00 39.78 38.76 2p62 n ASN 197 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2p62 n ASP 198 N 0.83 -1.20 -4.68 6.41 4.64 -0.52 -4.90 116.55 117.13 2p62 n ASP 198 Ca 0.14 -0.92 -0.43 0.00 -1.38 0.00 0.00 54.79 52.20 2p62 n ASP 198 Cb 0.45 -3.59 -0.02 0.00 -1.04 0.00 0.00 41.12 36.93 2p62 n ASP 198 CO 0.00 0.00 0.00 -0.47 -0.82 0.00 0.00 177.20 175.91 2p62 s TYR 199 N -3.78 3.38 -1.06 -0.67 5.04 0.17 -4.92 117.35 115.50 2p62 s TYR 199 Ca 0.05 1.48 0.20 0.00 -2.44 0.00 0.00 57.07 56.36 2p62 s TYR 199 Cb -0.02 -3.26 -0.20 0.00 0.35 0.00 0.00 41.96 38.83 2p62 s TYR 199 CO 0.85 -0.51 0.89 0.25 -1.34 0.00 0.00 175.55 175.68 2p62 n THR 200 N 4.88 0.00 -0.76 4.34 -2.24 -1.26 -4.83 114.28 114.40 2p62 n THR 200 Ca 0.10 -0.04 -0.28 0.00 -2.27 0.00 0.00 64.05 61.56 2p62 n THR 200 Cb 0.47 1.03 0.23 0.00 -2.10 0.00 0.00 70.33 69.96 2p62 n THR 200 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2p62 s GLY 201 N -2.88 1.54 -0.02 3.38 0.00 -1.26 -4.98 107.32 103.10 2p62 s GLY 201 Ca 0.09 -0.30 -0.14 0.00 0.00 0.00 0.00 44.72 44.36 2p62 s GLY 201 CO 0.81 0.42 0.82 -1.80 0.00 0.00 0.00 173.10 173.35 2p62 h ASP 202 N -2.46 0.69 -3.33 1.64 3.58 -2.02 -3.47 116.42 111.05 2p62 h ASP 202 Ca -0.59 -0.93 -0.67 0.00 0.42 0.00 0.00 57.03 55.26 2p62 h ASP 202 Cb 1.34 -0.22 -0.14 0.00 1.72 0.00 0.00 39.33 42.02 2p62 h ASP 202 CO 0.52 1.71 -0.63 0.00 -2.88 0.00 0.00 179.24 177.97 2p62 h LEU 204 N 4.72 0.18 -1.17 0.00 3.38 -2.00 -2.04 115.31 118.39 2p62 h LEU 204 Ca -0.50 -0.04 0.08 0.00 0.09 0.00 0.00 57.88 57.51 2p62 h LEU 204 Cb 1.18 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.82 2p62 h LEU 204 CO 0.56 0.39 0.58 0.77 0.09 0.00 0.00 178.44 180.83 2p62 h SER 205 N 0.18 0.85 0.34 -0.43 4.64 -1.91 0.98 113.55 118.20 2p62 h SER 205 Ca 0.03 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.29 2p62 h SER 205 Cb 0.44 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 2p62 h SER 205 CO 0.03 0.52 -0.37 1.23 -0.87 0.00 0.00 176.83 177.38 2p62 h GLY 206 N 0.96 0.05 1.17 -0.77 0.00 -1.77 -2.85 103.07 99.86 2p62 h GLY 206 Ca 0.40 -0.04 -0.15 0.00 0.00 0.00 0.00 47.33 47.54 2p62 h GLY 206 CO -0.16 0.04 -0.35 -2.00 0.00 0.00 0.00 176.54 174.06 2p62 h LEU 207 N 0.04 0.97 -0.47 3.11 5.85 -0.76 -2.31 115.31 121.74 2p62 h LEU 207 Ca 0.00 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.29 2p62 h LEU 207 Cb 0.67 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2p62 h LEU 207 CO 0.05 1.22 0.29 1.88 -0.34 0.00 0.00 178.44 181.53 2p62 h TYR 208 N 0.76 0.62 -0.07 1.25 0.99 -1.08 0.32 116.97 119.76 2p62 h TYR 208 Ca 0.07 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.80 2p62 h TYR 208 Cb 0.93 -0.20 -0.00 0.00 1.00 0.00 0.00 36.73 38.46 2p62 h TYR 208 CO 0.06 0.43 0.04 0.93 -0.00 0.00 0.00 178.16 179.62 2p62 h GLU 209 N 0.63 0.09 0.65 4.88 5.08 -1.49 -0.17 114.58 124.24 2p62 h GLU 209 Ca 0.17 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2p62 h GLU 209 Cb -0.01 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.23 2p62 h GLU 209 CO -0.03 0.07 -0.31 -0.22 -1.00 0.00 0.00 179.01 177.52 2p62 h LYS 210 N 0.08 -0.84 -0.55 2.33 3.64 -1.14 0.18 116.57 120.28 2p62 h LYS 210 Ca 0.02 0.06 0.09 0.00 -1.27 0.00 0.00 60.65 59.55 2p62 h LYS 210 Cb -0.00 0.19 -0.07 0.00 -0.41 0.00 0.00 32.23 31.94 2p62 h LYS 210 CO -0.01 -0.52 0.18 -0.92 -2.27 0.00 0.00 179.45 175.91 2p62 h TYR 211 N -1.01 0.31 -0.11 1.91 3.20 -0.37 -0.11 116.97 120.79 2p62 h TYR 211 Ca -0.09 0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.60 2p62 h TYR 211 Cb 0.70 -0.05 0.01 0.00 1.54 0.00 0.00 36.73 38.93 2p62 h TYR 211 CO -0.01 0.07 -0.76 0.82 -1.64 0.00 0.00 178.16 176.64 2p62 h ILE 212 N 0.34 1.30 -0.96 1.81 2.04 -1.05 -2.47 117.51 118.53 2p62 h ILE 212 Ca 0.27 -2.00 0.05 0.00 1.00 0.00 0.00 64.86 64.19 2p62 h ILE 212 Cb 0.34 2.14 -0.06 0.00 -0.74 0.00 0.00 36.82 38.50 2p62 h ILE 212 CO -0.30 0.62 0.63 1.23 0.00 0.00 0.00 178.15 180.33 2p62 h GLY 213 N 0.39 1.41 1.07 5.37 0.00 -0.23 -1.46 103.07 109.62 2p62 h GLY 213 Ca -0.07 -0.46 -0.19 0.00 0.00 0.00 0.00 47.33 46.61 2p62 h GLY 213 CO 0.16 0.37 -0.64 -2.22 0.00 0.00 0.00 176.54 174.20 2p62 h ILE 214 N 1.17 1.30 -0.99 2.60 2.04 -1.05 -3.21 117.51 119.37 2p62 h ILE 214 Ca 0.40 -1.87 0.08 0.00 1.00 0.00 0.00 64.86 64.47 2p62 h ILE 214 Cb 0.08 1.98 -0.07 0.00 -0.74 0.00 0.00 36.82 38.07 2p62 h ILE 214 CO -0.14 0.59 0.63 -0.03 0.00 0.00 0.00 178.15 179.20 2p62 h MET 215 N 0.43 1.07 -0.19 2.37 4.05 -0.92 0.26 114.93 122.00 2p62 h MET 215 Ca -0.03 -0.06 0.05 0.00 -0.28 0.00 0.00 59.70 59.38 2p62 h MET 215 Cb 1.27 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 31.83 2p62 h MET 215 CO 0.14 0.71 0.20 0.82 0.23 0.00 0.00 176.91 179.00 2p62 h ILE 216 N 1.10 0.51 0.06 1.77 2.04 -1.29 0.32 117.51 122.03 2p62 h ILE 216 Ca 0.45 0.00 -0.36 0.00 1.00 0.00 0.00 64.86 65.95 2p62 h ILE 216 Cb 0.27 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 2p62 h ILE 216 CO -0.20 0.00 -2.10 1.41 0.00 0.00 0.00 178.15 177.26 2p62 n HIS 217 N -3.87 0.81 -0.00 1.37 8.25 0.75 -3.95 115.22 118.57 2p62 n HIS 217 Ca 0.02 0.20 -0.12 0.00 -0.26 0.00 0.00 57.72 57.55 2p62 n HIS 217 Cb 0.32 -1.12 -0.14 0.00 1.12 0.00 0.00 29.99 30.18 2p62 n HIS 217 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 2p62 h ARG 218 N 0.04 0.08 -0.80 -0.41 0.11 -0.51 -3.43 114.38 109.46 2p62 h ARG 218 Ca -0.45 -0.14 -0.32 0.00 0.10 0.00 0.00 59.98 59.17 2p62 h ARG 218 Cb 2.02 0.05 -0.22 0.00 1.11 0.00 0.00 29.97 32.93 2p62 h ARG 218 CO 0.04 0.73 -0.68 -1.71 0.10 0.00 0.00 179.97 178.45 2p62 n ASN 219 N -3.19 -2.04 -0.29 0.08 4.05 0.11 -5.01 115.26 108.97 2p62 n ASN 219 Ca -0.19 -3.04 0.04 0.00 0.45 0.00 0.00 54.58 51.83 2p62 n ASN 219 Cb 1.04 1.04 0.18 0.00 1.23 0.00 0.00 39.78 43.27 2p62 n ASN 219 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 177.26 174.12 2p62 h ARG 220 N 4.23 0.74 -0.20 1.20 2.43 -1.63 -2.21 114.38 118.95 2p62 h ARG 220 Ca -0.04 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 2p62 h ARG 220 Cb 0.99 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 2p62 h ARG 220 CO 0.32 0.49 0.03 0.93 -1.51 0.00 0.00 179.97 180.24 2p62 h GLU 221 N 0.76 0.29 -0.26 0.20 4.39 -1.92 -2.03 114.58 116.00 2p62 h GLU 221 Ca 0.41 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 60.06 2p62 h GLU 221 Cb 0.41 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2p62 h GLU 221 CO -0.27 0.29 0.10 1.25 -1.16 0.00 0.00 179.01 179.22 2p62 h LEU 222 N 0.29 0.37 -0.48 1.33 5.85 -1.77 -0.17 115.31 120.72 2p62 h LEU 222 Ca 0.07 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 2p62 h LEU 222 Cb 0.15 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2p62 h LEU 222 CO -0.00 0.44 0.20 0.25 -0.34 0.00 0.00 178.44 179.00 2p62 h LEU 223 N 0.27 0.66 -0.63 2.25 5.85 -1.43 0.41 115.31 122.69 2p62 h LEU 223 Ca 0.09 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2p62 h LEU 223 Cb 0.19 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2p62 h LEU 223 CO -0.01 0.63 0.35 0.40 -0.34 0.00 0.00 178.44 179.48 2p62 h ILE 224 N 0.64 1.20 -0.56 4.05 2.04 -1.28 0.17 117.51 123.76 2p62 h ILE 224 Ca 0.16 -0.49 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 2p62 h ILE 224 Cb 0.17 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 2p62 h ILE 224 CO -0.02 0.21 0.23 -0.09 0.00 0.00 0.00 178.15 178.48 2p62 h ARG 225 N 0.85 0.84 0.17 2.37 2.43 -0.72 -1.50 114.38 118.82 2p62 h ARG 225 Ca 0.22 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2p62 h ARG 225 Cb 0.03 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 2p62 h ARG 225 CO -0.04 0.72 -0.12 0.35 -1.51 0.00 0.00 179.97 179.38 2p62 h PHE 226 N 0.77 -0.30 -0.55 2.20 3.04 -0.39 -0.15 116.94 121.57 2p62 h PHE 226 Ca 0.19 -0.00 0.12 0.00 3.98 0.00 0.00 57.97 62.26 2p62 h PHE 226 Cb 0.20 0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.79 2p62 h PHE 226 CO 0.01 -0.18 0.38 -0.07 -2.02 0.00 0.00 178.31 176.42 2p62 h LEU 227 N -0.28 0.19 0.03 0.59 3.38 -0.40 -1.54 115.31 117.28 2p62 h LEU 227 Ca -0.01 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 2p62 h LEU 227 Cb 0.25 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.97 2p62 h LEU 227 CO 0.00 0.11 -0.29 -1.28 0.09 0.00 0.00 178.44 177.07 2p62 h SER 228 N 0.21 0.21 0.38 -0.43 0.87 -0.77 0.49 113.55 114.51 2p62 h SER 228 Ca 0.26 -0.87 -0.03 0.00 -1.23 0.00 0.00 61.79 59.92 2p62 h SER 228 Cb 0.73 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2p62 h SER 228 CO -0.05 1.06 -0.14 -0.33 -0.53 0.00 0.00 176.83 176.84 2p62 h GLU 229 N -0.60 0.00 -0.02 2.24 5.08 -0.54 -1.20 114.58 119.53 2p62 h GLU 229 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2p62 h GLU 229 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2p62 h GLU 229 CO 0.06 0.14 -0.17 0.28 -1.00 0.00 0.00 179.01 178.31 2p62 n VAL 230 N -3.69 0.00 -3.23 3.13 0.31 -0.62 -4.98 118.33 109.26 2p62 n VAL 230 Ca -0.02 -0.29 -0.15 0.00 -0.01 0.00 0.00 64.34 63.88 2p62 n VAL 230 Cb 0.25 0.90 0.07 0.00 -0.91 0.00 0.00 33.84 34.16 2p62 n VAL 230 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2p62 n ASN 231 N 0.23 -4.76 -0.00 4.52 5.15 -0.45 -4.75 115.26 115.19 2p62 n ASN 231 Ca 0.14 -0.64 0.05 0.00 -0.60 0.00 0.00 54.58 53.53 2p62 n ASN 231 Cb 0.44 -4.92 -0.08 0.00 -0.53 0.00 0.00 39.78 34.69 2p62 n ASN 231 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2p62 n LEU 232 N -3.44 0.01 0.09 1.20 4.77 0.17 -4.71 117.00 115.08 2p62 n LEU 232 Ca -0.14 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 55.71 2p62 n LEU 232 Cb 0.63 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.66 2p62 n LEU 232 CO 0.56 0.00 0.79 0.25 -1.33 0.00 0.00 177.39 177.66 2p62 h LEU 233 N 0.00 -0.33 -1.81 2.23 5.85 -1.79 -1.61 115.31 117.85 2p62 h LEU 233 Ca 0.00 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2p62 h LEU 233 Cb 0.46 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2p62 h LEU 233 CO 0.00 -0.18 0.21 1.55 -0.34 0.00 0.00 178.44 179.69 2p62 h PRO 234 N -0.24 0.24 -0.07 5.25 0.13 -1.89 0.16 132.00 135.57 2p62 h PRO 234 Ca 0.02 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 2p62 h PRO 234 Cb 0.25 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.33 2p62 h PRO 234 CO -0.06 0.16 -0.20 1.25 -0.23 0.00 0.00 178.00 178.91 2p62 h LEU 235 N 0.25 0.30 -0.49 1.56 5.85 -1.78 -2.70 115.31 118.30 2p62 h LEU 235 Ca 0.14 -0.60 -0.02 0.00 0.84 0.00 0.00 57.88 58.23 2p62 h LEU 235 Cb 0.23 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2p62 h LEU 235 CO -0.03 0.85 0.21 -0.07 -0.34 0.00 0.00 178.44 179.07 2p62 h LEU 236 N -0.23 0.66 -2.01 2.25 3.38 -0.79 -1.46 115.31 117.12 2p62 h LEU 236 Ca -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2p62 h LEU 236 Cb 0.82 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2p62 h LEU 236 CO 0.04 0.64 0.00 -0.33 0.09 0.00 0.00 178.44 178.88 2p62 h GLU 237 N 0.65 0.00 0.06 1.13 5.08 -0.74 -1.53 114.58 119.22 2p62 h GLU 237 Ca 0.17 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.40 2p62 h GLU 237 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2p62 h GLU 237 CO -0.02 0.00 -0.58 -0.09 -1.00 0.00 0.00 179.01 177.32 2p62 h ARG 238 N 0.00 0.12 -0.49 2.33 9.65 -1.07 -3.33 114.38 121.60 2p62 h ARG 238 Ca 0.00 -0.21 0.09 0.00 -1.10 0.00 0.00 59.98 58.76 2p62 h ARG 238 Cb 0.29 0.08 -0.08 0.00 -1.39 0.00 0.00 29.97 28.87 2p62 h ARG 238 CO 0.00 1.10 0.03 0.52 2.80 0.00 0.00 179.97 184.42 2p62 h MET 239 N -0.72 0.14 -6.75 0.20 2.86 -0.86 -3.41 114.93 106.40 2p62 h MET 239 Ca -0.12 -0.01 -0.46 0.00 -2.06 0.00 0.00 59.70 57.05 2p62 h MET 239 Cb 1.33 -0.03 0.03 0.00 0.06 0.00 0.00 31.60 32.99 2p62 h MET 239 CO 0.03 0.09 -0.07 0.08 1.06 0.00 0.00 176.91 178.11 2p62 s VAL 240 N -6.16 3.86 0.00 -2.22 1.01 -0.62 -5.05 120.40 111.23 2p62 s VAL 240 Ca -0.13 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2p62 s VAL 240 Cb 0.16 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2p62 s VAL 240 CO 0.72 -0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.11