#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o71 h LEU 2 N 0.00 0.07 -9.65 0.00 3.38 -1.98 -3.43 115.31 103.70 1o71 h LEU 2 Ca 0.00 -0.90 -0.53 0.00 0.09 0.00 0.00 57.88 56.54 1o71 h LEU 2 Cb 0.00 -0.02 0.05 0.00 0.09 0.00 0.00 40.66 40.78 1o71 h LEU 2 CO 0.00 0.96 0.85 0.00 0.09 0.00 0.00 178.44 180.35 1o71 s ALA 3 N -2.60 3.74 0.00 1.53 0.00 -1.26 -2.14 121.76 121.03 1o71 s ALA 3 Ca -0.18 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.15 1o71 s ALA 3 Cb -0.02 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1o71 s ALA 3 CO 0.71 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1o71 n GLY 4 N 3.33 0.83 3.55 0.00 0.00 0.02 -4.88 105.19 108.04 1o71 n GLY 4 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 1o71 n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o71 s THR 5 N -2.07 2.09 0.19 2.61 2.01 -0.91 -4.45 115.64 115.11 1o71 s THR 5 Ca 0.00 -2.14 0.11 0.00 0.31 0.00 0.00 61.69 59.97 1o71 s THR 5 Cb 0.00 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1o71 s THR 5 CO 0.00 -0.15 -0.22 0.27 -0.69 0.00 0.00 174.62 173.83 1o71 s ILE 6 N -2.70 2.49 0.25 1.82 -4.36 -1.26 -0.09 121.20 117.35 1o71 s ILE 6 Ca 0.33 -1.98 0.00 0.00 -0.26 0.00 0.00 60.65 58.74 1o71 s ILE 6 Cb 0.05 -2.20 -0.03 0.00 1.25 0.00 0.00 42.46 41.53 1o71 s ILE 6 CO 0.16 -0.12 0.22 0.27 0.24 0.00 0.00 174.94 175.72 1o71 s ILE 7 N -1.69 0.00 0.18 8.37 -4.36 0.29 -4.96 121.20 119.03 1o71 s ILE 7 Ca 0.22 -1.93 -0.32 0.00 -0.26 0.00 0.00 60.65 58.36 1o71 s ILE 7 Cb -0.08 -2.49 -0.11 0.00 1.25 0.00 0.00 42.46 41.03 1o71 s ILE 7 CO 0.11 0.00 1.70 0.00 0.24 0.00 0.00 174.94 176.98 1o71 s ALA 8 N -3.88 3.87 0.42 2.27 0.00 -1.26 -0.28 121.76 122.89 1o71 s ALA 8 Ca 0.38 1.50 0.21 0.00 0.00 0.00 0.00 51.96 54.05 1o71 s ALA 8 Cb 0.05 -3.69 1.18 0.00 0.00 0.00 0.00 23.12 20.66 1o71 s ALA 8 CO 0.17 -0.94 1.77 0.78 0.00 0.00 0.00 175.76 177.54 1o71 h GLY 9 N 7.14 1.05 1.89 0.00 0.00 -0.47 0.64 103.07 113.32 1o71 h GLY 9 Ca -0.43 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1o71 h GLY 9 CO 0.94 -0.13 0.00 0.00 0.00 0.00 0.00 176.54 177.35 1o71 n ALA 10 N -2.51 2.30 1.04 3.60 0.00 -1.26 -3.26 120.51 120.41 1o71 n ALA 10 Ca 0.26 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.71 1o71 n ALA 10 Cb 0.95 -1.45 0.17 0.00 0.00 0.00 0.00 19.45 19.11 1o71 n ALA 10 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1o71 n SER 11 N -1.44 0.80 -4.66 0.00 3.41 0.22 -4.89 113.62 107.06 1o71 n SER 11 Ca 0.08 -0.61 -0.42 0.00 -0.26 0.00 0.00 58.87 57.66 1o71 n SER 11 Cb 0.30 0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 64.64 1o71 n SER 11 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1o71 s LEU 12 N -2.89 4.26 0.24 1.04 2.96 -1.20 -4.90 118.68 118.18 1o71 s LEU 12 Ca 0.13 2.08 0.01 0.00 -0.22 0.00 0.00 54.13 56.13 1o71 s LEU 12 Cb 0.17 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.30 1o71 s LEU 12 CO 0.70 -0.93 0.19 0.42 -1.32 0.00 0.00 176.35 175.42 1o71 s THR 13 N 4.06 0.00 0.30 3.68 -4.23 -1.26 -5.04 115.64 113.15 1o71 s THR 13 Ca 0.70 -1.97 0.31 0.00 -1.18 0.00 0.00 61.69 59.55 1o71 s THR 13 Cb -0.30 -2.49 0.33 0.00 1.34 0.00 0.00 72.50 71.37 1o71 s THR 13 CO 0.27 0.00 2.03 -0.26 -0.54 0.00 0.00 174.62 176.12 1o71 h PHE 14 N 2.46 0.00 0.02 3.99 -1.00 -1.99 -2.38 116.94 118.04 1o71 h PHE 14 Ca -0.32 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.45 1o71 h PHE 14 Cb 1.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.81 1o71 h PHE 14 CO 0.74 0.10 -0.01 0.37 -1.61 0.00 0.00 178.31 177.90 1o71 h GLN 15 N 0.00 -0.02 -0.53 1.51 4.15 -1.96 0.78 115.11 119.03 1o71 h GLN 15 Ca -0.00 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.49 1o71 h GLN 15 Cb 0.44 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.07 1o71 h GLN 15 CO 0.01 0.39 0.21 0.28 -1.93 0.00 0.00 178.83 177.79 1o71 h VAL 16 N -0.44 0.85 -0.59 2.39 2.07 -1.85 0.78 116.25 119.46 1o71 h VAL 16 Ca -0.00 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 1o71 h VAL 16 Cb 0.42 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1o71 h VAL 16 CO 0.00 0.07 0.13 -0.07 0.02 0.00 0.00 177.57 177.73 1o71 h LEU 17 N 0.40 0.88 -0.81 2.57 3.38 -1.33 -1.32 115.31 119.08 1o71 h LEU 17 Ca 0.25 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 1o71 h LEU 17 Cb 0.25 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1o71 h LEU 17 CO -0.24 0.86 -0.29 -0.78 0.09 0.00 0.00 178.44 178.09 1o71 h ASP 18 N 0.89 0.58 0.46 -0.43 3.58 0.18 -1.23 116.42 120.45 1o71 h ASP 18 Ca 0.19 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.38 1o71 h ASP 18 Cb 0.34 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.23 1o71 h ASP 18 CO 0.00 0.84 -0.21 0.11 -2.88 0.00 0.00 179.24 177.10 1o71 h LYS 19 N 0.49 0.00 -0.36 0.28 1.57 -0.28 -1.47 116.57 116.80 1o71 h LYS 19 Ca 0.06 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.68 1o71 h LYS 19 Cb 0.75 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.06 1o71 h LYS 19 CO 0.06 0.21 -0.41 0.28 -0.57 0.00 0.00 179.45 179.02 1o71 h VAL 20 N 0.00 1.27 -0.95 0.50 2.07 -0.15 -1.64 116.25 117.36 1o71 h VAL 20 Ca -0.00 -1.59 0.01 0.00 0.82 0.00 0.00 66.70 65.94 1o71 h VAL 20 Cb 0.50 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.68 1o71 h VAL 20 CO 0.03 0.53 0.62 -0.07 0.02 0.00 0.00 177.57 178.70 1o71 h LEU 21 N 0.71 1.10 -0.10 2.57 3.38 -0.34 -1.96 115.31 120.67 1o71 h LEU 21 Ca 0.05 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1o71 h LEU 21 Cb 1.01 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1o71 h LEU 21 CO 0.10 0.80 0.05 -0.08 0.09 0.00 0.00 178.44 179.40 1o71 h GLU 22 N 1.30 0.15 -1.04 1.13 4.81 -1.11 -2.75 114.58 117.07 1o71 h GLU 22 Ca 0.35 -0.02 0.26 0.00 -0.13 0.00 0.00 59.36 59.82 1o71 h GLU 22 Cb -0.14 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 29.12 1o71 h GLU 22 CO -0.07 0.23 0.65 1.49 -0.73 0.00 0.00 179.01 180.59 1o71 h GLU 23 N 0.03 0.42 0.00 1.92 4.81 -0.63 0.36 114.58 121.49 1o71 h GLU 23 Ca 0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1o71 h GLU 23 Cb 0.14 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1o71 h GLU 23 CO -0.00 0.28 0.00 -0.07 -0.73 0.00 0.00 179.01 178.49 1o71 h LEU 24 N 0.44 0.00 0.00 1.64 3.38 -1.06 -3.48 115.31 116.22 1o71 h LEU 24 Ca 0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.58 1o71 h LEU 24 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.20 1o71 h LEU 24 CO -0.34 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.80 1o71 n GLY 25 N -0.77 -0.31 3.56 0.83 0.00 0.12 -4.75 105.19 103.87 1o71 n GLY 25 Ca -0.02 -1.80 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 1o71 n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o71 s LYS 26 N -1.55 3.44 -0.04 1.61 -0.14 -1.26 -4.91 119.74 116.89 1o71 s LYS 26 Ca 0.00 -1.01 0.02 0.00 -1.36 0.00 0.00 55.97 53.62 1o71 s LYS 26 Cb 0.00 -5.32 0.01 0.00 -1.68 0.00 0.00 37.83 30.84 1o71 s LYS 26 CO 0.00 -2.38 -0.08 0.54 -0.76 0.00 0.00 175.35 172.67 1o71 s VAL 27 N 5.72 0.76 0.41 3.17 0.11 -1.26 -5.05 120.40 124.26 1o71 s VAL 27 Ca 0.50 -0.29 0.35 0.00 -2.93 0.00 0.00 61.98 59.61 1o71 s VAL 27 Cb -0.01 -0.72 0.35 0.00 -1.53 0.00 0.00 36.38 34.47 1o71 s VAL 27 CO -0.08 0.26 2.08 0.77 -3.33 0.00 0.00 175.10 174.80 1o71 h SER 28 N 6.83 0.00 -3.34 3.54 4.64 -1.94 -3.40 113.55 119.88 1o71 h SER 28 Ca -0.35 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.63 1o71 h SER 28 Cb 1.17 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.89 1o71 h SER 28 CO 0.48 0.00 -0.72 -0.13 -0.87 0.00 0.00 176.83 175.59 1o71 s ARG 29 N -3.94 -0.05 0.22 4.77 1.81 -1.26 -4.61 118.95 115.89 1o71 s ARG 29 Ca -0.04 0.36 -0.23 0.00 -1.72 0.00 0.00 55.73 54.10 1o71 s ARG 29 Cb 0.10 -0.41 0.04 0.00 -0.45 0.00 0.00 34.95 34.23 1o71 s ARG 29 CO 0.32 -0.28 0.84 -1.59 -0.68 0.00 0.00 175.30 173.91 1o71 s LYS 30 N 1.90 1.52 -0.09 3.54 -2.85 -0.34 -2.14 119.74 121.28 1o71 s LYS 30 Ca 0.01 -0.85 -0.15 0.00 -1.00 0.00 0.00 55.97 53.98 1o71 s LYS 30 Cb -0.12 0.51 0.03 0.00 -2.06 0.00 0.00 37.83 36.19 1o71 s LYS 30 CO -0.03 -0.70 0.37 -1.50 0.10 0.00 0.00 175.35 173.59 1o71 s ILE 31 N -3.53 0.02 -0.17 3.79 2.07 -0.34 -1.13 121.20 121.92 1o71 s ILE 31 Ca 0.12 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.18 1o71 s ILE 31 Cb -0.04 -0.59 0.00 0.00 0.13 0.00 0.00 42.46 41.97 1o71 s ILE 31 CO 0.05 -0.10 -0.15 0.00 -1.91 0.00 0.00 174.94 172.83 1o71 s ALA 32 N -0.44 2.49 -0.07 1.50 0.00 0.71 -2.46 121.76 123.49 1o71 s ALA 32 Ca -0.06 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.82 1o71 s ALA 32 Cb -0.04 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1o71 s ALA 32 CO 0.02 -0.13 -0.07 0.08 0.00 0.00 0.00 175.76 175.67 1o71 s VAL 33 N 0.96 3.67 -0.05 0.00 1.01 -0.39 -1.21 120.40 124.39 1o71 s VAL 33 Ca -0.03 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 1o71 s VAL 33 Cb -0.15 -2.50 0.03 0.00 0.00 0.00 0.00 36.38 33.76 1o71 s VAL 33 CO -0.03 0.59 0.03 -0.83 0.00 0.00 0.00 175.10 174.87 1o71 s GLY 34 N -0.75 0.30 -0.25 4.51 0.00 -0.22 -1.95 107.32 108.94 1o71 s GLY 34 Ca 0.11 0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.93 1o71 s GLY 34 CO 0.01 1.20 -0.02 -0.42 0.00 0.00 0.00 173.10 173.87 1o71 s ILE 35 N 1.95 1.53 -0.32 0.90 1.01 -0.98 -0.32 121.20 124.98 1o71 s ILE 35 Ca 0.03 -1.36 -0.24 0.00 0.00 0.00 0.00 60.65 59.07 1o71 s ILE 35 Cb -0.12 -1.87 0.01 0.00 0.01 0.00 0.00 42.46 40.48 1o71 s ILE 35 CO -0.04 -0.22 0.84 -0.62 0.00 0.00 0.00 174.94 174.90 1o71 s ASP 36 N 1.37 6.69 -0.37 3.58 2.15 0.17 -1.81 116.67 128.45 1o71 s ASP 36 Ca -0.02 0.68 -0.21 0.00 0.43 0.00 0.00 52.55 53.43 1o71 s ASP 36 Cb -0.19 -2.43 0.01 0.00 -0.30 0.00 0.00 42.92 40.01 1o71 s ASP 36 CO -0.08 -0.68 0.68 0.21 -0.17 0.00 0.00 175.17 175.12 1o71 s ASN 37 N 1.66 6.45 -0.22 -0.34 2.47 0.27 -1.06 114.94 124.17 1o71 s ASN 37 Ca 0.35 0.16 0.19 0.00 0.42 0.00 0.00 52.86 53.98 1o71 s ASN 37 Cb -0.14 -2.34 0.48 0.00 -1.45 0.00 0.00 41.25 37.80 1o71 s ASN 37 CO 0.14 -0.65 1.14 -0.62 -3.72 0.00 0.00 177.10 173.39 1o71 n GLU 38 N 6.17 1.84 0.10 0.43 -0.58 -0.18 -0.33 120.64 128.08 1o71 n GLU 38 Ca -0.00 -3.40 0.13 0.00 -0.42 0.00 0.00 57.16 53.47 1o71 n GLU 38 Cb 0.48 -1.49 0.31 0.00 -0.57 0.00 0.00 31.44 30.17 1o71 n GLU 38 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1o71 h SER 39 N 2.17 0.00 0.00 1.62 4.64 -1.81 -2.67 113.55 117.50 1o71 h SER 39 Ca -0.04 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1o71 h SER 39 Cb 1.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1o71 h SER 39 CO 0.28 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.88 1o71 n GLY 40 N 1.30 0.52 3.61 -0.77 0.00 -1.26 -4.68 105.19 103.91 1o71 n GLY 40 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1o71 n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o71 n GLY 41 N -1.63 1.66 3.88 -0.02 0.00 -1.26 -4.94 105.19 102.88 1o71 n GLY 41 Ca 0.00 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.23 1o71 n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o71 s THR 42 N -2.56 4.82 0.05 2.61 2.01 -1.26 -3.53 115.64 117.78 1o71 s THR 42 Ca 0.25 0.52 0.08 0.00 0.31 0.00 0.00 61.69 62.85 1o71 s THR 42 Cb -0.02 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 1o71 s THR 42 CO 0.18 -0.58 -0.22 0.26 -0.69 0.00 0.00 174.62 173.57 1o71 s TRP 43 N -2.44 1.91 -0.13 4.92 0.51 -0.55 -2.19 118.94 120.97 1o71 s TRP 43 Ca 0.50 -0.38 0.02 0.00 -2.12 0.00 0.00 56.10 54.12 1o71 s TRP 43 Cb -0.10 -1.13 0.00 0.00 -0.81 0.00 0.00 33.47 31.43 1o71 s TRP 43 CO 0.34 0.11 -0.21 0.99 -0.51 0.00 0.00 176.95 177.68 1o71 s THR 44 N -0.84 2.24 0.38 2.01 2.01 0.07 -1.53 115.64 119.97 1o71 s THR 44 Ca 0.08 -0.93 -0.28 0.00 0.31 0.00 0.00 61.69 60.87 1o71 s THR 44 Cb -0.09 -1.90 -0.11 0.00 0.01 0.00 0.00 72.50 70.42 1o71 s THR 44 CO 0.02 0.54 1.44 0.00 -0.69 0.00 0.00 174.62 175.94 1o71 s ALA 45 N 0.66 3.52 0.00 7.40 0.00 0.49 0.11 121.76 133.94 1o71 s ALA 45 Ca -0.10 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1o71 s ALA 45 Cb -0.16 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1o71 s ALA 45 CO 0.02 -0.99 0.00 -0.11 0.00 0.00 0.00 175.76 174.68 1o71 n LEU 46 N 0.45 0.00 -3.73 0.00 7.94 0.07 -4.77 117.00 116.96 1o71 n LEU 46 Ca 0.01 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.90 1o71 n LEU 46 Cb 0.40 -0.42 -0.00 0.00 0.53 0.00 0.00 43.42 43.93 1o71 n LEU 46 CO 0.62 -0.49 0.91 0.54 -1.11 0.00 0.00 177.39 177.86 1o71 s ASN 47 N -4.08 -0.09 -0.04 1.96 4.22 -1.20 -5.01 114.94 110.70 1o71 s ASN 47 Ca 0.00 -0.31 0.03 0.00 -2.14 0.00 0.00 52.86 50.44 1o71 s ASN 47 Cb 0.00 0.32 0.00 0.00 1.28 0.00 0.00 41.25 42.85 1o71 s ASN 47 CO 0.00 -0.60 -0.12 0.00 -2.04 0.00 0.00 177.10 174.34 1o71 s ALA 48 N -2.67 1.12 -0.41 3.54 0.00 -1.26 -1.46 121.76 120.62 1o71 s ALA 48 Ca 0.16 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 51.71 1o71 s ALA 48 Cb 0.01 -0.41 0.11 0.00 0.00 0.00 0.00 23.12 22.83 1o71 s ALA 48 CO -0.00 0.18 0.13 -0.47 0.00 0.00 0.00 175.76 175.59 1o71 s TYR 49 N 0.22 3.53 -0.35 0.00 5.04 0.89 -4.99 117.35 121.70 1o71 s TYR 49 Ca -0.05 -3.07 -0.27 0.00 -2.44 0.00 0.00 57.07 51.24 1o71 s TYR 49 Cb -0.11 -2.88 0.02 0.00 0.35 0.00 0.00 41.96 39.34 1o71 s TYR 49 CO 0.01 -0.87 1.00 -0.06 -1.34 0.00 0.00 175.55 174.30 1o71 s PHE 50 N 0.45 3.10 0.13 4.97 0.40 -1.26 -1.96 117.98 123.81 1o71 s PHE 50 Ca 0.13 0.97 0.00 0.00 -0.60 0.00 0.00 56.93 57.44 1o71 s PHE 50 Cb -0.22 -3.70 -0.11 0.00 0.51 0.00 0.00 43.02 39.50 1o71 s PHE 50 CO -0.05 -0.82 1.30 -0.09 0.70 0.00 0.00 175.22 176.26 1o71 h ARG 51 N 8.33 0.23 -3.37 0.44 2.43 -0.70 -3.45 114.38 118.29 1o71 h ARG 51 Ca -0.22 -0.29 -0.21 0.00 -0.81 0.00 0.00 59.98 58.45 1o71 h ARG 51 Cb 1.07 0.09 -0.28 0.00 -0.42 0.00 0.00 29.97 30.43 1o71 h ARG 51 CO 1.01 1.05 -0.58 -1.12 -1.51 0.00 0.00 179.97 178.82 1o71 s SER 52 N -6.98 -0.13 0.00 -3.80 0.01 -0.60 -4.96 113.70 97.24 1o71 s SER 52 Ca -0.03 0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.50 1o71 s SER 52 Cb 0.09 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1o71 s SER 52 CO 0.85 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 175.03 1o71 n GLY 53 N 3.40 -1.79 2.77 3.44 0.00 -1.20 -1.01 105.19 110.79 1o71 n GLY 53 Ca -0.17 -1.71 -0.07 0.00 0.00 0.00 0.00 46.02 44.07 1o71 n GLY 53 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1o71 n THR 54 N 0.00 0.00 -4.09 2.61 5.66 0.86 -4.82 114.28 114.51 1o71 n THR 54 Ca 0.00 -0.85 -0.09 0.00 -3.05 0.00 0.00 64.05 60.06 1o71 n THR 54 Cb 0.00 0.76 -0.10 0.00 -1.55 0.00 0.00 70.33 69.43 1o71 n THR 54 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1o71 s THR 55 N -2.40 0.36 -1.55 1.09 -1.32 -1.26 -0.44 115.64 110.13 1o71 s THR 55 Ca 0.14 -1.57 0.13 0.00 -1.21 0.00 0.00 61.69 59.18 1o71 s THR 55 Cb -0.03 -1.19 0.13 0.00 -1.51 0.00 0.00 72.50 69.90 1o71 s THR 55 CO 0.10 -0.79 0.96 0.47 -2.21 0.00 0.00 174.62 173.15 1o71 n ASP 56 N 0.55 2.20 -4.36 8.08 8.00 -1.26 -5.00 116.55 124.76 1o71 n ASP 56 Ca -0.17 -1.60 -0.18 0.00 0.71 0.00 0.00 54.79 53.55 1o71 n ASP 56 Cb 0.59 -0.03 -0.10 0.00 -0.02 0.00 0.00 41.12 41.55 1o71 n ASP 56 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1o71 s VAL 57 N -1.07 1.36 0.11 2.53 -7.23 -1.26 -5.13 120.40 109.71 1o71 s VAL 57 Ca 0.17 -2.09 -0.06 0.00 -1.81 0.00 0.00 61.98 58.19 1o71 s VAL 57 Cb 0.11 -2.28 -0.05 0.00 0.56 0.00 0.00 36.38 34.72 1o71 s VAL 57 CO 0.16 -0.40 0.36 -0.51 -0.31 0.00 0.00 175.10 174.40 1o71 s ILE 58 N -3.21 5.17 0.12 -0.62 1.10 -1.26 -4.98 121.20 117.52 1o71 s ILE 58 Ca 0.26 0.12 -0.31 0.00 -0.51 0.00 0.00 60.65 60.21 1o71 s ILE 58 Cb 0.04 -3.62 -0.10 0.00 0.15 0.00 0.00 42.46 38.93 1o71 s ILE 58 CO 0.09 0.12 1.69 -0.76 -2.11 0.00 0.00 174.94 173.97 1o71 s LEU 59 N -2.42 4.38 -0.26 8.50 1.43 -1.26 -4.43 118.68 124.62 1o71 s LEU 59 Ca 0.38 2.63 -0.39 0.00 -1.03 0.00 0.00 54.13 55.72 1o71 s LEU 59 Cb -0.13 -3.57 -0.15 0.00 0.03 0.00 0.00 46.19 42.37 1o71 s LEU 59 CO 0.22 -0.92 1.78 -2.65 0.23 0.00 0.00 176.35 175.01 1o71 n PRO 60 N 5.14 1.31 -0.04 1.29 -0.02 -1.26 -4.83 135.00 136.59 1o71 n PRO 60 Ca 0.16 0.48 -0.09 0.00 -2.02 0.00 0.00 63.50 62.03 1o71 n PRO 60 Cb 0.39 -2.19 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 1o71 n PRO 60 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1o71 h GLU 61 N 7.61 0.10 -5.48 -0.52 4.81 -1.90 -3.38 114.58 115.82 1o71 h GLU 61 Ca -0.47 -0.01 -0.59 0.00 -0.13 0.00 0.00 59.36 58.16 1o71 h GLU 61 Cb 1.31 -0.02 -0.31 0.00 0.63 0.00 0.00 28.75 30.36 1o71 h GLU 61 CO 0.96 0.06 -0.85 -0.06 -0.73 0.00 0.00 179.01 178.40 1o71 s PHE 62 N -6.19 1.89 -0.31 0.92 0.40 -1.26 -0.38 117.98 113.06 1o71 s PHE 62 Ca -0.13 -0.55 -0.00 0.00 -0.60 0.00 0.00 56.93 55.65 1o71 s PHE 62 Cb 0.09 -1.26 0.10 0.00 0.51 0.00 0.00 43.02 42.46 1o71 s PHE 62 CO 0.69 -0.18 0.08 0.08 0.70 0.00 0.00 175.22 176.59 1o71 s VAL 63 N -0.02 1.04 0.81 -0.44 1.01 -0.58 -4.97 120.40 117.25 1o71 s VAL 63 Ca -0.04 -1.46 -0.11 0.00 0.00 0.00 0.00 61.98 60.37 1o71 s VAL 63 Cb -0.12 -1.76 0.08 0.00 0.00 0.00 0.00 36.38 34.58 1o71 s VAL 63 CO 0.02 -0.62 1.09 -2.84 0.00 0.00 0.00 175.10 172.75 1o71 s PRO 64 N 1.54 1.99 0.40 2.72 0.02 -1.26 -1.48 135.00 138.93 1o71 s PRO 64 Ca 0.09 0.82 -0.27 0.00 0.02 0.00 0.00 61.00 61.66 1o71 s PRO 64 Cb -0.17 -1.89 -0.10 0.00 0.02 0.00 0.00 34.50 32.35 1o71 s PRO 64 CO -0.22 -1.73 1.45 -1.71 -0.33 0.00 0.00 177.00 174.46 1o71 n ASN 65 N -3.54 3.53 0.00 2.53 4.05 -1.23 -1.66 115.26 118.94 1o71 n ASN 65 Ca 0.07 1.19 0.00 0.00 0.45 0.00 0.00 54.58 56.30 1o71 n ASN 65 Cb 0.55 -1.60 0.00 0.00 1.23 0.00 0.00 39.78 39.96 1o71 n ASN 65 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 1o71 n THR 66 N 0.21 0.00 -4.22 -0.44 -2.24 0.55 -5.02 114.28 103.12 1o71 n THR 66 Ca 0.03 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.52 1o71 n THR 66 Cb 0.39 -0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.51 1o71 n THR 66 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1o71 s LYS 67 N -0.04 2.18 -0.04 -0.78 -0.14 -0.67 0.23 119.74 120.49 1o71 s LYS 67 Ca 0.00 -1.05 0.05 0.00 -1.36 0.00 0.00 55.97 53.61 1o71 s LYS 67 Cb 0.00 -2.31 -0.02 0.00 -1.68 0.00 0.00 37.83 33.82 1o71 s LYS 67 CO 0.00 0.49 -0.20 0.00 -0.76 0.00 0.00 175.35 174.89 1o71 s ALA 68 N -1.35 2.43 -0.10 5.17 0.00 0.61 -0.56 121.76 127.95 1o71 s ALA 68 Ca 0.23 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.09 1o71 s ALA 68 Cb -0.11 -0.78 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 1o71 s ALA 68 CO 0.15 0.53 0.14 -0.48 0.00 0.00 0.00 175.76 176.10 1o71 s LEU 69 N -0.64 4.36 -0.08 0.00 0.05 -0.75 -0.55 118.68 121.08 1o71 s LEU 69 Ca 0.10 0.44 -0.00 0.00 0.05 0.00 0.00 54.13 54.72 1o71 s LEU 69 Cb -0.11 -2.13 -0.03 0.00 -2.05 0.00 0.00 46.19 41.87 1o71 s LEU 69 CO 0.00 0.39 -0.04 -0.76 -0.55 0.00 0.00 176.35 175.39 1o71 s LEU 70 N -1.15 3.31 0.23 1.48 1.02 0.88 -2.31 118.68 122.14 1o71 s LEU 70 Ca 0.17 0.03 -0.14 0.00 0.02 0.00 0.00 54.13 54.21 1o71 s LEU 70 Cb -0.12 -1.74 0.00 0.00 0.02 0.00 0.00 46.19 44.36 1o71 s LEU 70 CO 0.06 0.36 0.49 -0.47 0.02 0.00 0.00 176.35 176.81 1o71 s TYR 71 N -0.79 0.23 0.20 0.29 5.04 -0.82 -0.80 117.35 120.69 1o71 s TYR 71 Ca 0.12 -0.60 -0.22 0.00 -2.44 0.00 0.00 57.07 53.93 1o71 s TYR 71 Cb -0.11 0.25 0.05 0.00 0.35 0.00 0.00 41.96 42.50 1o71 s TYR 71 CO 0.02 -0.97 0.63 -1.54 -1.34 0.00 0.00 175.55 172.35 1o71 s SER 72 N -2.98 -0.46 0.16 4.32 1.04 -1.26 -1.26 113.70 113.26 1o71 s SER 72 Ca 0.18 -0.21 -0.24 0.00 0.48 0.00 0.00 55.95 56.17 1o71 s SER 72 Cb -0.01 0.64 0.06 0.00 0.10 0.00 0.00 66.02 66.82 1o71 s SER 72 CO 0.06 -1.09 0.70 -0.83 0.98 0.00 0.00 173.24 173.05 1o71 s GLY 73 N -2.81 -0.45 0.33 7.32 0.00 -1.03 -4.59 107.32 106.08 1o71 s GLY 73 Ca 0.04 0.37 -0.17 0.00 0.00 0.00 0.00 44.72 44.97 1o71 s GLY 73 CO -0.06 0.12 0.72 1.09 0.00 0.00 0.00 173.10 174.97 1o71 s ARG 74 N -3.66 1.98 0.58 2.90 1.70 0.42 -1.20 118.95 121.67 1o71 s ARG 74 Ca 0.05 -1.24 -0.11 0.00 -0.47 0.00 0.00 55.73 53.96 1o71 s ARG 74 Cb -0.02 0.60 -0.05 0.00 -0.57 0.00 0.00 34.95 34.91 1o71 s ARG 74 CO -0.07 -0.91 0.98 -1.59 -1.08 0.00 0.00 175.30 172.63 1o71 s LYS 75 N -3.18 3.65 0.43 3.89 -2.85 -0.91 -0.10 119.74 120.67 1o71 s LYS 75 Ca 0.15 0.69 -0.25 0.00 -1.00 0.00 0.00 55.97 55.56 1o71 s LYS 75 Cb -0.05 -2.14 -0.08 0.00 -2.06 0.00 0.00 37.83 33.50 1o71 s LYS 75 CO 0.10 -0.46 1.31 -0.51 0.10 0.00 0.00 175.35 175.90 1o71 s ASP 76 N -3.97 6.14 0.65 0.03 1.01 -1.26 -4.71 116.67 114.56 1o71 s ASP 76 Ca 0.54 2.67 -0.13 0.00 0.71 0.00 0.00 52.55 56.35 1o71 s ASP 76 Cb -0.11 -2.64 -0.01 0.00 1.01 0.00 0.00 42.92 41.17 1o71 s ASP 76 CO 0.49 -0.97 1.05 0.42 0.21 0.00 0.00 175.17 176.37 1o71 s THR 77 N -1.28 4.02 0.00 -1.27 -4.23 -1.26 -4.81 115.64 106.81 1o71 s THR 77 Ca 0.59 0.76 0.00 0.00 -1.18 0.00 0.00 61.69 61.86 1o71 s THR 77 Cb -0.38 -3.43 0.00 0.00 1.34 0.00 0.00 72.50 70.03 1o71 s THR 77 CO 0.49 -0.76 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 1o71 n GLY 78 N -1.70 0.71 2.42 3.99 0.00 -1.26 -4.77 105.19 104.59 1o71 n GLY 78 Ca 0.08 -2.14 -0.14 0.00 0.00 0.00 0.00 46.02 43.82 1o71 n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1o71 n PRO 79 N 0.08 1.57 -4.83 1.61 -0.04 -1.26 -4.84 135.00 127.29 1o71 n PRO 79 Ca 0.00 -1.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.16 1o71 n PRO 79 Cb 0.00 -2.11 -0.17 0.00 -0.04 0.00 0.00 33.50 31.18 1o71 n PRO 79 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1o71 s VAL 80 N 2.68 1.80 -1.42 0.52 -7.23 -1.26 -5.05 120.40 110.44 1o71 s VAL 80 Ca 0.38 -0.85 -0.11 0.00 -1.81 0.00 0.00 61.98 59.59 1o71 s VAL 80 Cb 0.14 -1.59 0.07 0.00 0.56 0.00 0.00 36.38 35.55 1o71 s VAL 80 CO -0.02 0.50 2.25 0.00 -0.31 0.00 0.00 175.10 177.53 1o71 n ALA 81 N 3.84 5.92 -2.37 1.32 0.00 -1.26 -4.91 120.51 123.06 1o71 n ALA 81 Ca -0.20 -3.98 -0.19 0.00 0.00 0.00 0.00 53.44 49.08 1o71 n ALA 81 Cb 0.52 -3.28 -0.10 0.00 0.00 0.00 0.00 19.45 16.59 1o71 n ALA 81 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1o71 s THR 82 N 1.80 1.42 0.00 0.00 -4.23 -1.26 -4.85 115.64 108.52 1o71 s THR 82 Ca 0.49 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 1o71 s THR 82 Cb 0.14 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.68 1o71 s THR 82 CO -0.06 -0.40 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 1o71 n GLY 83 N -0.46 5.83 3.06 3.99 0.00 -1.26 -4.54 105.19 111.81 1o71 n GLY 83 Ca -0.06 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 1o71 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o71 s ALA 84 N -2.07 2.71 -0.07 4.61 0.00 -0.18 -3.23 121.76 123.52 1o71 s ALA 84 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 51.96 49.92 1o71 s ALA 84 Cb 0.00 -1.75 0.02 0.00 0.00 0.00 0.00 23.12 21.39 1o71 s ALA 84 CO 0.00 -1.38 -0.05 0.08 0.00 0.00 0.00 175.76 174.41 1o71 s VAL 85 N 1.04 0.71 0.26 0.00 1.01 -0.18 0.26 120.40 123.50 1o71 s VAL 85 Ca -0.02 -0.15 -0.18 0.00 0.00 0.00 0.00 61.98 61.63 1o71 s VAL 85 Cb -0.20 -0.75 0.01 0.00 0.00 0.00 0.00 36.38 35.44 1o71 s VAL 85 CO -0.06 0.29 0.64 0.00 0.00 0.00 0.00 175.10 175.97 1o71 s ALA 86 N 1.40 -0.92 -0.03 5.51 0.00 -0.78 0.11 121.76 127.04 1o71 s ALA 86 Ca -0.03 -0.46 -0.01 0.00 0.00 0.00 0.00 51.96 51.47 1o71 s ALA 86 Cb -0.13 0.92 0.03 0.00 0.00 0.00 0.00 23.12 23.93 1o71 s ALA 86 CO -0.03 -0.97 0.05 0.00 0.00 0.00 0.00 175.76 174.81 1o71 s ALA 87 N -3.94 -0.00 0.11 0.00 0.00 -0.83 -2.11 121.76 114.99 1o71 s ALA 87 Ca 0.14 0.35 0.05 0.00 0.00 0.00 0.00 51.96 52.50 1o71 s ALA 87 Cb -0.04 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1o71 s ALA 87 CO 0.07 -0.11 -0.13 -0.59 0.00 0.00 0.00 175.76 175.00 1o71 s PHE 88 N 0.97 1.28 0.02 0.00 -0.12 -0.31 -0.08 117.98 119.74 1o71 s PHE 88 Ca -0.08 -0.59 0.03 0.00 -0.05 0.00 0.00 56.93 56.24 1o71 s PHE 88 Cb -0.11 -0.68 -0.02 0.00 -0.63 0.00 0.00 43.02 41.59 1o71 s PHE 88 CO -0.03 0.09 -0.10 0.00 -0.05 0.00 0.00 175.22 175.13 1o71 s ALA 89 N -2.25 0.80 -0.08 1.99 0.00 -0.53 -1.41 121.76 120.27 1o71 s ALA 89 Ca 0.08 -0.59 0.05 0.00 0.00 0.00 0.00 51.96 51.49 1o71 s ALA 89 Cb -0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 23.12 22.96 1o71 s ALA 89 CO 0.02 0.14 -0.23 0.71 0.00 0.00 0.00 175.76 176.40 1o71 s TYR 90 N -0.68 2.35 -0.04 0.00 1.51 -0.48 -0.75 117.35 119.26 1o71 s TYR 90 Ca -0.01 -0.84 -0.25 0.00 -1.01 0.00 0.00 57.07 54.96 1o71 s TYR 90 Cb -0.06 -1.57 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 1o71 s TYR 90 CO 0.00 -0.31 0.77 -0.47 -1.11 0.00 0.00 175.55 174.43 1o71 s TYR 91 N 0.16 3.61 0.13 2.71 5.04 0.12 -0.77 117.35 128.34 1o71 s TYR 91 Ca -0.12 1.37 -0.02 0.00 -2.44 0.00 0.00 57.07 55.86 1o71 s TYR 91 Cb -0.16 -2.88 -0.05 0.00 0.35 0.00 0.00 41.96 39.23 1o71 s TYR 91 CO 0.06 0.08 0.32 -1.64 -1.34 0.00 0.00 175.55 173.03 1o71 s MET 92 N 0.79 3.53 0.44 4.97 -1.94 0.52 -0.75 119.30 126.86 1o71 s MET 92 Ca 0.41 -0.29 0.30 0.00 -1.71 0.00 0.00 55.69 54.40 1o71 s MET 92 Cb -0.19 -2.91 1.40 0.00 2.01 0.00 0.00 34.83 35.14 1o71 s MET 92 CO 0.21 0.50 1.91 0.66 -0.01 0.00 0.00 175.02 178.29 1o71 h SER 93 N 2.65 0.00 0.67 3.03 4.64 -1.73 0.33 113.55 123.14 1o71 h SER 93 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1o71 h SER 93 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1o71 h SER 93 CO 0.72 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.14 1o71 n SER 94 N -2.68 0.31 0.00 4.97 3.41 -1.26 -4.86 113.62 113.52 1o71 n SER 94 Ca 0.00 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1o71 n SER 94 Cb 0.20 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 1o71 n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o71 n GLY 95 N 0.15 0.43 3.63 5.00 0.00 0.10 -5.09 105.19 109.42 1o71 n GLY 95 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1o71 n GLY 95 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1o71 s ASN 96 N -2.85 4.11 -0.16 1.61 0.01 -1.24 -3.68 114.94 112.72 1o71 s ASN 96 Ca 0.00 -1.09 -0.07 0.00 -0.71 0.00 0.00 52.86 50.99 1o71 s ASN 96 Cb 0.00 -0.48 -0.04 0.00 0.41 0.00 0.00 41.25 41.14 1o71 s ASN 96 CO 0.00 -0.31 0.06 -0.89 -1.51 0.00 0.00 177.10 174.45 1o71 s THR 97 N -2.57 4.82 -0.24 1.60 2.01 -0.24 -0.35 115.64 120.67 1o71 s THR 97 Ca 0.35 -0.03 -0.18 0.00 0.31 0.00 0.00 61.69 62.15 1o71 s THR 97 Cb 0.02 -3.15 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 1o71 s THR 97 CO 0.19 0.49 0.49 -0.22 -0.69 0.00 0.00 174.62 174.89 1o71 s LEU 98 N 0.07 4.08 -0.15 4.42 1.98 0.05 -0.26 118.68 128.87 1o71 s LEU 98 Ca 0.05 0.53 -0.02 0.00 -2.89 0.00 0.00 54.13 51.81 1o71 s LEU 98 Cb -0.12 -2.64 -0.02 0.00 0.66 0.00 0.00 46.19 44.07 1o71 s LEU 98 CO 0.01 -0.24 -0.09 -0.83 -1.89 0.00 0.00 176.35 173.32 1o71 s GLY 99 N 1.42 1.61 -0.03 7.98 0.00 0.16 -1.38 107.32 117.09 1o71 s GLY 99 Ca 0.21 -0.90 0.06 0.00 0.00 0.00 0.00 44.72 44.08 1o71 s GLY 99 CO 0.09 -0.06 -0.20 0.14 0.00 0.00 0.00 173.10 173.07 1o71 s VAL 100 N 0.50 1.58 -0.01 1.40 1.01 -0.50 -1.17 120.40 123.22 1o71 s VAL 100 Ca -0.06 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1o71 s VAL 100 Cb -0.15 -1.33 -0.00 0.00 0.00 0.00 0.00 36.38 34.90 1o71 s VAL 100 CO 0.03 0.45 -0.06 -0.32 0.00 0.00 0.00 175.10 175.20 1o71 s MET 101 N -0.29 0.53 0.01 2.72 1.75 -0.70 -1.16 119.30 122.16 1o71 s MET 101 Ca 0.03 -0.22 0.02 0.00 -1.25 0.00 0.00 55.69 54.27 1o71 s MET 101 Cb -0.09 -0.52 -0.01 0.00 2.84 0.00 0.00 34.83 37.05 1o71 s MET 101 CO 0.00 0.13 -0.06 -0.59 -0.65 0.00 0.00 175.02 173.85 1o71 s PHE 102 N -0.09 0.51 -0.14 4.11 -0.12 -0.90 -1.82 117.98 119.54 1o71 s PHE 102 Ca 0.02 -0.20 -0.02 0.00 -0.05 0.00 0.00 56.93 56.67 1o71 s PHE 102 Cb -0.03 -0.32 0.04 0.00 -0.63 0.00 0.00 43.02 42.08 1o71 s PHE 102 CO -0.00 -0.03 0.02 0.45 -0.05 0.00 0.00 175.22 175.61 1o71 s SER 103 N -0.54 2.28 -0.60 1.98 0.15 0.02 -1.87 113.70 115.11 1o71 s SER 103 Ca -0.02 -0.47 0.01 0.00 0.70 0.00 0.00 55.95 56.18 1o71 s SER 103 Cb -0.04 -0.52 0.15 0.00 -1.71 0.00 0.00 66.02 63.90 1o71 s SER 103 CO -0.00 -0.25 0.38 -0.69 1.20 0.00 0.00 173.24 173.88 1o71 s VAL 104 N 1.91 3.17 0.83 4.45 1.01 0.14 -2.56 120.40 129.35 1o71 s VAL 104 Ca 0.02 -3.30 -0.11 0.00 0.00 0.00 0.00 61.98 58.59 1o71 s VAL 104 Cb -0.15 -3.11 0.09 0.00 0.00 0.00 0.00 36.38 33.21 1o71 s VAL 104 CO -0.07 -0.87 1.14 -2.16 0.00 0.00 0.00 175.10 173.14 1o71 s PRO 105 N -0.37 1.69 -0.05 2.72 0.04 -1.26 -1.01 135.00 136.77 1o71 s PRO 105 Ca 0.18 1.45 -0.09 0.00 0.04 0.00 0.00 61.00 62.58 1o71 s PRO 105 Cb -0.21 -1.81 -0.30 0.00 0.04 0.00 0.00 34.50 32.22 1o71 s PRO 105 CO -0.03 -2.11 0.67 0.35 0.04 0.00 0.00 177.00 175.92 1o71 h PHE 106 N -1.28 0.67 -3.01 0.56 3.57 -1.89 -3.44 116.94 112.12 1o71 h PHE 106 Ca -0.44 -0.49 -0.73 0.00 3.53 0.00 0.00 57.97 59.84 1o71 h PHE 106 Cb 1.26 -0.03 -0.22 0.00 2.79 0.00 0.00 35.95 39.75 1o71 h PHE 106 CO 0.53 1.64 -0.05 0.34 -2.23 0.00 0.00 178.31 178.54 1o71 s ASP 107 N -7.23 6.19 0.00 0.41 -1.08 -1.26 -4.91 116.67 108.78 1o71 s ASP 107 Ca -0.15 -1.58 0.10 0.00 -0.52 0.00 0.00 52.55 50.40 1o71 s ASP 107 Cb 0.06 -2.26 0.39 0.00 -1.46 0.00 0.00 42.92 39.65 1o71 s ASP 107 CO 0.85 -0.98 1.29 -1.22 0.52 0.00 0.00 175.17 175.63 1o71 n TYR 108 N 5.80 0.22 0.17 -5.34 4.01 -1.26 -2.23 117.16 118.52 1o71 n TYR 108 Ca -0.12 -0.11 0.05 0.00 -0.16 0.00 0.00 57.90 57.57 1o71 n TYR 108 Cb 0.41 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.54 1o71 n TYR 108 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 1o71 h ASN 109 N 1.18 0.00 0.00 7.72 4.21 -2.01 -3.38 115.58 123.29 1o71 h ASN 109 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1o71 h ASN 109 Cb 0.27 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.47 1o71 h ASN 109 CO 0.00 0.36 -0.36 0.79 -1.29 0.00 0.00 177.43 176.93 1o71 n TRP 110 N -3.21 0.00 -4.39 1.19 7.02 -1.24 -5.11 117.44 111.70 1o71 n TRP 110 Ca 0.02 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.26 1o71 n TRP 110 Cb 0.66 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.46 1o71 n TRP 110 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1o71 s TYR 111 N -0.73 2.45 0.36 -5.99 2.02 -0.95 -5.15 117.35 109.36 1o71 s TYR 111 Ca 0.00 -0.29 0.05 0.00 -0.37 0.00 0.00 57.07 56.46 1o71 s TYR 111 Cb 0.00 -1.11 -0.07 0.00 -0.40 0.00 0.00 41.96 40.38 1o71 s TYR 111 CO 0.00 0.62 0.04 -1.12 -1.57 0.00 0.00 175.55 173.52 1o71 s SER 112 N -3.30 3.02 0.37 2.29 0.01 -1.26 -4.32 113.70 110.51 1o71 s SER 112 Ca 0.28 -1.38 -0.24 0.00 1.31 0.00 0.00 55.95 55.92 1o71 s SER 112 Cb -0.06 -0.20 -0.10 0.00 0.21 0.00 0.00 66.02 65.86 1o71 s SER 112 CO 0.15 -0.55 0.96 0.20 0.41 0.00 0.00 173.24 174.42 1o71 s ASN 113 N -3.58 7.09 0.02 2.44 0.01 -1.26 -4.59 114.94 115.07 1o71 s ASN 113 Ca 0.35 1.82 -0.05 0.00 -0.71 0.00 0.00 52.86 54.27 1o71 s ASN 113 Cb 0.09 -2.57 -0.01 0.00 0.41 0.00 0.00 41.25 39.18 1o71 s ASN 113 CO 0.16 -0.25 0.09 0.26 -1.51 0.00 0.00 177.10 175.86 1o71 s TRP 114 N -1.82 0.16 0.18 2.20 0.52 -1.06 -0.43 118.94 118.68 1o71 s TRP 114 Ca 0.56 -0.38 -0.17 0.00 0.02 0.00 0.00 56.10 56.13 1o71 s TRP 114 Cb -0.16 -0.12 0.03 0.00 -1.15 0.00 0.00 33.47 32.08 1o71 s TRP 114 CO 0.21 -0.30 0.50 1.67 0.02 0.00 0.00 176.95 179.04 1o71 s TRP 115 N -1.95 -0.15 -0.09 -1.98 1.48 -0.23 -0.80 118.94 115.21 1o71 s TRP 115 Ca -0.11 -0.17 -0.31 0.00 -1.06 0.00 0.00 56.10 54.45 1o71 s TRP 115 Cb -0.05 0.36 0.12 0.00 -1.16 0.00 0.00 33.47 32.74 1o71 s TRP 115 CO -0.02 -0.86 1.00 0.34 -4.06 0.00 0.00 176.95 173.35 1o71 s ASP 116 N -2.85 -0.30 0.00 -2.66 2.15 -0.76 -0.48 116.67 111.77 1o71 s ASP 116 Ca 0.07 0.07 0.03 0.00 0.43 0.00 0.00 52.55 53.16 1o71 s ASP 116 Cb -0.00 0.30 -0.01 0.00 -0.30 0.00 0.00 42.92 42.90 1o71 s ASP 116 CO -0.05 -0.46 -0.11 -0.69 -0.17 0.00 0.00 175.17 173.69 1o71 s VAL 117 N -2.53 0.86 -0.02 1.11 1.01 -1.26 -1.71 120.40 117.86 1o71 s VAL 117 Ca 0.05 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.24 1o71 s VAL 117 Cb -0.01 -0.74 0.04 0.00 0.00 0.00 0.00 36.38 35.67 1o71 s VAL 117 CO -0.06 0.16 0.46 -0.75 0.00 0.00 0.00 175.10 174.91 1o71 s LYS 118 N -0.47 0.84 -0.24 2.72 2.20 -0.31 -5.00 119.74 119.48 1o71 s LYS 118 Ca 0.03 -0.04 -0.06 0.00 -0.36 0.00 0.00 55.97 55.54 1o71 s LYS 118 Cb -0.05 0.38 -0.02 0.00 -1.51 0.00 0.00 37.83 36.63 1o71 s LYS 118 CO -0.00 -0.25 0.04 0.42 -0.36 0.00 0.00 175.35 175.20 1o71 s ILE 119 N -1.38 4.09 0.00 5.43 1.01 -1.26 0.38 121.20 129.48 1o71 s ILE 119 Ca -0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 60.65 60.27 1o71 s ILE 119 Cb -0.03 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 1o71 s ILE 119 CO 0.06 0.37 0.12 -0.31 0.00 0.00 0.00 174.94 175.17 1o71 s TYR 120 N 1.50 3.37 0.08 3.97 1.51 0.65 -4.95 117.35 123.47 1o71 s TYR 120 Ca 0.06 0.25 -0.31 0.00 -1.01 0.00 0.00 57.07 56.06 1o71 s TYR 120 Cb -0.15 -1.76 -0.07 0.00 -0.11 0.00 0.00 41.96 39.87 1o71 s TYR 120 CO 0.02 0.58 1.40 0.45 -1.11 0.00 0.00 175.55 176.89 1o71 s SER 121 N -1.86 6.83 0.03 2.29 0.15 -1.26 -1.07 113.70 118.81 1o71 s SER 121 Ca 0.25 2.26 0.00 0.00 0.70 0.00 0.00 55.95 59.16 1o71 s SER 121 Cb -0.12 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 1o71 s SER 121 CO 0.16 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1o71 n GLY 122 N 3.55 -0.62 3.40 9.45 0.00 -1.24 -4.72 105.19 115.01 1o71 n GLY 122 Ca 0.12 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 1o71 n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o71 s LYS 123 N 0.00 3.19 -0.07 1.61 2.20 -1.26 -1.42 119.74 123.98 1o71 s LYS 123 Ca 0.00 -0.81 0.01 0.00 -0.36 0.00 0.00 55.97 54.81 1o71 s LYS 123 Cb 0.00 -3.52 0.02 0.00 -1.51 0.00 0.00 37.83 32.82 1o71 s LYS 123 CO 0.00 -0.46 -0.07 0.50 -0.36 0.00 0.00 175.35 174.96 1o71 s ARG 124 N 1.57 1.27 0.44 4.03 3.52 -1.26 -5.05 118.95 123.46 1o71 s ARG 124 Ca 0.04 -0.22 -0.21 0.00 -0.13 0.00 0.00 55.73 55.20 1o71 s ARG 124 Cb -0.17 -1.23 -0.10 0.00 -1.56 0.00 0.00 34.95 31.89 1o71 s ARG 124 CO 0.05 -0.11 0.98 -0.98 -0.81 0.00 0.00 175.30 174.43 1o71 s ARG 125 N 1.12 4.12 0.20 5.12 1.70 -1.26 -4.89 118.95 125.07 1o71 s ARG 125 Ca -0.07 1.23 -0.30 0.00 -0.47 0.00 0.00 55.73 56.13 1o71 s ARG 125 Cb -0.14 -2.22 -0.08 0.00 -0.57 0.00 0.00 34.95 31.93 1o71 s ARG 125 CO -0.01 -0.14 1.11 0.00 -1.08 0.00 0.00 175.30 175.19 1o71 s ALA 126 N -2.04 3.39 0.14 7.88 0.00 -1.26 -4.86 121.76 125.00 1o71 s ALA 126 Ca 0.62 0.85 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 1o71 s ALA 126 Cb -0.13 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.66 1o71 s ALA 126 CO 0.17 -0.22 0.27 -0.40 0.00 0.00 0.00 175.76 175.58 1o71 n ASP 127 N 2.18 -0.79 -0.10 0.00 5.68 -1.26 -4.56 116.55 117.70 1o71 n ASP 127 Ca 0.02 -1.56 0.06 0.00 -0.50 0.00 0.00 54.79 52.81 1o71 n ASP 127 Cb 0.46 1.32 0.40 0.00 -1.14 0.00 0.00 41.12 42.16 1o71 n ASP 127 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 1o71 h GLN 128 N 0.00 0.62 -0.12 0.11 5.75 -1.94 -1.16 115.11 118.37 1o71 h GLN 128 Ca -0.12 -0.04 -0.15 0.00 -0.15 0.00 0.00 58.65 58.20 1o71 h GLN 128 Cb 0.43 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 1o71 h GLN 128 CO 0.15 0.41 -0.57 0.78 -2.65 0.00 0.00 178.83 176.95 1o71 h GLY 129 N 0.64 0.39 1.62 2.39 0.00 -1.96 -1.50 103.07 104.65 1o71 h GLY 129 Ca 0.24 -0.47 -0.20 0.00 0.00 0.00 0.00 47.33 46.91 1o71 h GLY 129 CO -0.07 0.42 -0.82 1.98 0.00 0.00 0.00 176.54 178.05 1o71 h MET 130 N 0.27 0.36 0.19 4.80 1.85 -1.71 -2.07 114.93 118.62 1o71 h MET 130 Ca 0.00 -0.33 -0.01 0.00 -0.61 0.00 0.00 59.70 58.75 1o71 h MET 130 Cb 1.08 0.08 0.00 0.00 0.43 0.00 0.00 31.60 33.19 1o71 h MET 130 CO 0.10 1.00 -0.09 -0.92 -0.40 0.00 0.00 176.91 176.59 1o71 h TYR 131 N 0.22 -0.23 -0.21 1.39 3.20 -1.12 -1.97 116.97 118.25 1o71 h TYR 131 Ca -0.05 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1o71 h TYR 131 Cb 1.42 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.75 1o71 h TYR 131 CO 0.04 -0.07 0.01 0.93 -1.64 0.00 0.00 178.16 177.44 1o71 h GLU 132 N -0.35 0.30 -0.19 1.82 5.08 -1.30 0.29 114.58 120.23 1o71 h GLU 132 Ca -0.03 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.18 1o71 h GLU 132 Cb 0.27 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1o71 h GLU 132 CO 0.04 0.32 -0.37 0.22 -1.00 0.00 0.00 179.01 178.22 1o71 h ASP 133 N 0.30 0.44 0.34 1.42 1.82 -1.09 -0.42 116.42 119.23 1o71 h ASP 133 Ca 0.07 -0.18 -0.33 0.00 -0.39 0.00 0.00 57.03 56.21 1o71 h ASP 133 Cb 0.19 -0.12 -0.00 0.00 0.68 0.00 0.00 39.33 40.07 1o71 h ASP 133 CO 0.00 0.78 -1.63 -0.07 -1.61 0.00 0.00 179.24 176.70 1o71 h LEU 134 N 0.36 0.47 0.08 2.28 3.38 -0.79 -3.15 115.31 117.94 1o71 h LEU 134 Ca 0.04 -0.69 -0.27 0.00 0.09 0.00 0.00 57.88 57.05 1o71 h LEU 134 Cb 0.82 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.42 1o71 h LEU 134 CO 0.07 1.58 -1.21 0.22 0.09 0.00 0.00 178.44 179.19 1o71 h TYR 135 N 0.08 0.60 -0.02 1.13 3.20 -0.45 -3.35 116.97 118.16 1o71 h TYR 135 Ca -0.29 -0.41 0.00 0.00 3.14 0.00 0.00 58.73 61.17 1o71 h TYR 135 Cb 2.05 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 40.29 1o71 h TYR 135 CO 0.08 1.30 -0.24 0.66 -1.64 0.00 0.00 178.16 178.31 1o71 n TYR 136 N -3.61 0.00 0.00 -3.82 4.02 -0.17 -4.61 117.16 108.97 1o71 n TYR 136 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.80 1o71 n TYR 136 Cb 0.99 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.30 1o71 n TYR 136 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1o71 n GLY 137 N 1.36 0.36 2.45 2.72 0.00 -1.19 -4.92 105.19 105.97 1o71 n GLY 137 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 1o71 n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1o71 n ASN 138 N 0.00 -0.92 -4.80 1.61 5.15 -1.26 -5.12 115.26 109.92 1o71 n ASN 138 Ca 0.00 -3.20 -0.33 0.00 -0.60 0.00 0.00 54.58 50.46 1o71 n ASN 138 Cb 0.00 0.56 0.02 0.00 -0.53 0.00 0.00 39.78 39.84 1o71 n ASN 138 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1o71 s PRO 139 N -0.81 3.17 0.56 1.20 0.04 -1.26 -5.05 135.00 132.86 1o71 s PRO 139 Ca 0.32 1.21 -0.09 0.00 0.04 0.00 0.00 61.00 62.49 1o71 s PRO 139 Cb 0.27 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.76 1o71 s PRO 139 CO -0.11 -0.93 0.93 0.71 0.04 0.00 0.00 177.00 177.64 1o71 s TYR 140 N -2.50 3.60 0.18 0.56 1.51 0.37 -4.86 117.35 116.21 1o71 s TYR 140 Ca 0.63 1.10 0.03 0.00 -1.01 0.00 0.00 57.07 57.82 1o71 s TYR 140 Cb -0.17 -2.55 -0.03 0.00 -0.11 0.00 0.00 41.96 39.10 1o71 s TYR 140 CO 0.40 -0.52 0.32 0.50 -1.11 0.00 0.00 175.55 175.14 1o71 s ARG 141 N -4.99 3.45 -1.14 -0.62 3.52 -1.26 -1.07 118.95 116.83 1o71 s ARG 141 Ca 0.52 -0.60 -0.20 0.00 -0.13 0.00 0.00 55.73 55.32 1o71 s ARG 141 Cb -0.11 -2.93 0.08 0.00 -1.56 0.00 0.00 34.95 30.44 1o71 s ARG 141 CO 0.50 0.48 1.53 0.20 -0.81 0.00 0.00 175.30 177.20 1o71 s GLY 142 N -3.42 1.61 -0.00 8.12 0.00 0.42 -4.67 107.32 109.39 1o71 s GLY 142 Ca 0.35 -2.70 0.10 0.00 0.00 0.00 0.00 44.72 42.46 1o71 s GLY 142 CO 0.29 2.56 1.23 2.09 0.00 0.00 0.00 173.10 179.27 1o71 n ASP 143 N 8.07 2.84 -1.21 1.64 5.68 -1.13 -3.39 116.55 129.06 1o71 n ASP 143 Ca 0.39 -2.02 -0.13 0.00 -0.50 0.00 0.00 54.79 52.53 1o71 n ASP 143 Cb 0.48 -0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.21 1o71 n ASP 143 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1o71 n ASN 144 N 0.39 -4.35 -4.33 -1.12 3.02 -0.93 -4.87 115.26 103.07 1o71 n ASN 144 Ca 0.11 0.18 -0.18 0.00 -0.03 0.00 0.00 54.58 54.66 1o71 n ASN 144 Cb 0.42 -3.23 -0.10 0.00 -0.61 0.00 0.00 39.78 36.25 1o71 n ASN 144 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1o71 s GLY 145 N -2.67 1.37 0.20 7.41 0.00 -1.26 -5.01 107.32 107.36 1o71 s GLY 145 Ca 0.00 -1.64 -0.17 0.00 0.00 0.00 0.00 44.72 42.91 1o71 s GLY 145 CO 0.00 -1.72 0.65 -0.98 0.00 0.00 0.00 173.10 171.05 1o71 s TRP 146 N -3.08 3.61 0.05 1.90 0.52 -1.26 -4.31 118.94 116.36 1o71 s TRP 146 Ca 0.22 1.23 -0.05 0.00 0.02 0.00 0.00 56.10 57.52 1o71 s TRP 146 Cb 0.01 -2.50 -0.01 0.00 -1.15 0.00 0.00 33.47 29.81 1o71 s TRP 146 CO 0.06 0.36 0.09 -1.01 0.02 0.00 0.00 176.95 176.46 1o71 s HIS 147 N -1.53 0.24 0.10 -1.98 3.76 -0.59 -4.98 115.29 110.31 1o71 s HIS 147 Ca 0.42 -0.60 -0.24 0.00 -0.15 0.00 0.00 55.06 54.48 1o71 s HIS 147 Cb -0.15 -0.17 0.07 0.00 1.11 0.00 0.00 32.58 33.43 1o71 s HIS 147 CO 0.20 -0.39 0.60 -1.83 -0.85 0.00 0.00 174.74 172.47 1o71 s GLU 148 N -2.97 1.20 0.04 1.40 -1.05 -1.26 -1.63 118.70 114.42 1o71 s GLU 148 Ca -0.02 -0.31 -0.28 0.00 -0.15 0.00 0.00 54.97 54.22 1o71 s GLU 148 Cb 0.01 0.55 0.09 0.00 -0.44 0.00 0.00 34.13 34.35 1o71 s GLU 148 CO -0.06 -0.48 0.88 -1.59 0.95 0.00 0.00 175.26 174.95 1o71 s LYS 149 N -3.08 0.92 0.34 -4.83 -2.85 -0.97 -5.03 119.74 104.24 1o71 s LYS 149 Ca -0.02 -0.38 -0.20 0.00 -1.00 0.00 0.00 55.97 54.37 1o71 s LYS 149 Cb -0.01 0.40 -0.10 0.00 -2.06 0.00 0.00 37.83 36.07 1o71 s LYS 149 CO -0.07 -0.41 0.85 1.21 0.10 0.00 0.00 175.35 177.03 1o71 s ASN 150 N -2.58 7.01 -0.00 0.03 3.84 -1.26 -1.87 114.94 120.11 1o71 s ASN 150 Ca 0.06 1.56 0.21 0.00 0.21 0.00 0.00 52.86 54.90 1o71 s ASN 150 Cb -0.01 -2.48 -0.21 0.00 -0.55 0.00 0.00 41.25 38.00 1o71 s ASN 150 CO -0.07 -0.18 0.90 0.18 -2.79 0.00 0.00 177.10 175.13 1o71 n LEU 151 N -0.04 0.93 0.00 3.21 4.77 0.12 -4.88 117.00 121.11 1o71 n LEU 151 Ca 0.03 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 1o71 n LEU 151 Cb 0.52 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1o71 n LEU 151 CO 0.41 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1o71 n GLY 152 N 1.49 -0.05 2.44 -0.72 0.00 -1.15 -4.58 105.19 102.61 1o71 n GLY 152 Ca 0.04 -1.84 -0.20 0.00 0.00 0.00 0.00 46.02 44.01 1o71 n GLY 152 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1o71 n TYR 153 N -0.00 -0.82 -0.72 1.61 4.02 -1.26 -2.03 117.16 117.96 1o71 n TYR 153 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1o71 n TYR 153 Cb 0.00 -3.81 0.00 0.00 -0.02 0.00 0.00 39.34 35.51 1o71 n TYR 153 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1o71 n GLY 154 N -0.88 1.13 3.77 2.72 0.00 -1.26 -5.00 105.19 105.67 1o71 n GLY 154 Ca -0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 1o71 n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1o71 s LEU 155 N 0.00 3.64 0.15 0.99 1.43 -0.86 -4.69 118.68 119.34 1o71 s LEU 155 Ca 0.00 -0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 52.70 1o71 s LEU 155 Cb 0.00 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 1o71 s LEU 155 CO 0.00 -0.00 0.23 0.00 0.23 0.00 0.00 176.35 176.80 1o71 s ARG 156 N -3.63 1.09 0.05 1.70 1.70 -0.83 0.11 118.95 119.13 1o71 s ARG 156 Ca 0.32 -1.23 0.02 0.00 -0.47 0.00 0.00 55.73 54.37 1o71 s ARG 156 Cb -0.08 0.34 -0.03 0.00 -0.57 0.00 0.00 34.95 34.62 1o71 s ARG 156 CO 0.23 -0.38 -0.07 0.00 -1.08 0.00 0.00 175.30 174.00 1o71 s MET 157 N -3.98 0.57 -0.06 3.89 0.23 -0.78 -0.98 119.30 118.19 1o71 s MET 157 Ca 0.18 -0.86 -0.05 0.00 -1.03 0.00 0.00 55.69 53.94 1o71 s MET 157 Cb 0.04 -0.24 0.02 0.00 -1.53 0.00 0.00 34.83 33.13 1o71 s MET 157 CO -0.00 0.03 0.15 0.21 -2.03 0.00 0.00 175.02 173.38 1o71 s LYS 158 N -2.01 0.16 0.00 3.16 2.20 -0.90 -2.30 119.74 120.05 1o71 s LYS 158 Ca -0.06 0.25 0.00 0.00 -0.36 0.00 0.00 55.97 55.80 1o71 s LYS 158 Cb -0.07 0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.27 1o71 s LYS 158 CO -0.01 -0.06 0.00 0.41 -0.36 0.00 0.00 175.35 175.34 1o71 n GLY 159 N 3.30 0.99 3.51 5.54 0.00 -0.64 -0.87 105.19 117.01 1o71 n GLY 159 Ca -0.16 -0.85 -0.16 0.00 0.00 0.00 0.00 46.02 44.85 1o71 n GLY 159 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1o71 s ILE 160 N -2.34 0.00 -0.03 -0.61 2.07 0.65 -1.55 121.20 119.39 1o71 s ILE 160 Ca 0.00 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.25 1o71 s ILE 160 Cb 0.00 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.60 1o71 s ILE 160 CO 0.00 0.00 -0.05 -0.32 -1.91 0.00 0.00 174.94 172.66 1o71 s MET 161 N -1.68 0.68 0.93 3.50 -2.45 -1.26 -0.49 119.30 118.52 1o71 s MET 161 Ca -0.08 -0.14 -0.14 0.00 -1.25 0.00 0.00 55.69 54.08 1o71 s MET 161 Cb -0.00 -0.68 0.15 0.00 1.25 0.00 0.00 34.83 35.55 1o71 s MET 161 CO 0.05 0.01 1.18 0.95 1.05 0.00 0.00 175.02 178.25 1o71 s THR 162 N 0.49 1.96 -1.81 10.11 -4.23 -0.71 -2.19 115.64 119.25 1o71 s THR 162 Ca -0.06 0.00 0.23 0.00 -1.18 0.00 0.00 61.69 60.68 1o71 s THR 162 Cb -0.10 -2.82 -0.00 0.00 1.34 0.00 0.00 72.50 70.92 1o71 s THR 162 CO -0.00 0.00 1.14 -1.54 -0.54 0.00 0.00 174.62 173.68 1o71 n SER 163 N -3.77 1.69 -3.43 3.99 3.41 -1.22 -4.48 113.62 109.81 1o71 n SER 163 Ca 0.09 -1.31 -0.10 0.00 -0.26 0.00 0.00 58.87 57.29 1o71 n SER 163 Cb 0.60 0.50 0.04 0.00 -0.26 0.00 0.00 64.21 65.09 1o71 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1o71 n ALA 164 N -0.38 0.54 0.28 7.33 0.00 -1.26 -4.64 120.51 122.38 1o71 n ALA 164 Ca 0.09 -1.03 0.14 0.00 0.00 0.00 0.00 53.44 52.64 1o71 n ALA 164 Cb 0.43 0.27 0.80 0.00 0.00 0.00 0.00 19.45 20.94 1o71 n ALA 164 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1o71 h GLY 165 N 0.00 0.00 -7.45 0.00 0.00 -1.92 -3.31 103.07 90.40 1o71 h GLY 165 Ca -0.14 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.48 1o71 h GLY 165 CO 0.19 0.00 -0.42 -0.54 0.00 0.00 0.00 176.54 175.77 1o71 s GLU 166 N -4.24 2.38 -0.03 4.80 2.02 -1.26 -1.19 118.70 121.17 1o71 s GLU 166 Ca -0.03 -1.99 -0.03 0.00 0.02 0.00 0.00 54.97 52.94 1o71 s GLU 166 Cb 0.13 -3.78 -0.04 0.00 0.10 0.00 0.00 34.13 30.54 1o71 s GLU 166 CO 0.56 -1.15 0.14 0.00 0.02 0.00 0.00 175.26 174.83 1o71 s ALA 167 N 0.90 3.83 -0.05 5.21 0.00 -0.29 -4.95 121.76 126.41 1o71 s ALA 167 Ca 0.10 -0.76 0.06 0.00 0.00 0.00 0.00 51.96 51.36 1o71 s ALA 167 Cb -0.23 -1.81 -0.01 0.00 0.00 0.00 0.00 23.12 21.07 1o71 s ALA 167 CO -0.03 0.70 -0.25 0.15 0.00 0.00 0.00 175.76 176.33 1o71 s LYS 168 N -1.65 2.46 -0.09 0.00 1.02 -1.26 -0.21 119.74 120.01 1o71 s LYS 168 Ca 0.23 -0.90 -0.01 0.00 0.02 0.00 0.00 55.97 55.31 1o71 s LYS 168 Cb -0.12 -2.12 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1o71 s LYS 168 CO 0.14 0.40 -0.03 1.41 -0.92 0.00 0.00 175.35 176.35 1o71 s MET 169 N -0.22 1.01 -0.13 1.68 1.75 -0.35 -1.75 119.30 121.29 1o71 s MET 169 Ca -0.02 -0.06 0.01 0.00 -1.25 0.00 0.00 55.69 54.37 1o71 s MET 169 Cb -0.13 -1.27 -0.00 0.00 2.84 0.00 0.00 34.83 36.26 1o71 s MET 169 CO 0.03 -0.30 -0.18 -1.14 -0.65 0.00 0.00 175.02 172.79 1o71 s GLN 170 N 1.85 3.21 0.01 4.11 0.74 0.36 -1.06 119.66 128.88 1o71 s GLN 170 Ca 0.05 -0.78 0.01 0.00 0.05 0.00 0.00 55.36 54.69 1o71 s GLN 170 Cb -0.13 -2.52 -0.01 0.00 1.10 0.00 0.00 33.01 31.46 1o71 s GLN 170 CO -0.07 0.12 -0.04 0.42 -0.55 0.00 0.00 175.29 175.17 1o71 s ILE 171 N 0.53 0.31 -0.08 -2.34 1.01 0.57 -0.25 121.20 120.94 1o71 s ILE 171 Ca -0.11 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.05 1o71 s ILE 171 Cb -0.16 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 41.99 1o71 s ILE 171 CO 0.04 -0.14 -0.13 -0.75 0.00 0.00 0.00 174.94 173.96 1o71 s LYS 172 N -0.69 1.90 -0.38 2.79 2.20 -0.05 0.42 119.74 125.94 1o71 s LYS 172 Ca -0.04 -0.47 -0.10 0.00 -0.36 0.00 0.00 55.97 55.00 1o71 s LYS 172 Cb -0.05 -1.59 0.03 0.00 -1.51 0.00 0.00 37.83 34.72 1o71 s LYS 172 CO -0.00 -0.00 0.20 0.42 -0.36 0.00 0.00 175.35 175.61 1o71 s ILE 173 N 0.79 4.47 0.32 5.43 -1.09 -0.23 -2.11 121.20 128.79 1o71 s ILE 173 Ca -0.12 -0.94 0.07 0.00 -2.23 0.00 0.00 60.65 57.44 1o71 s ILE 173 Cb -0.16 -3.52 -0.03 0.00 -1.58 0.00 0.00 42.46 37.17 1o71 s ILE 173 CO 0.02 -0.26 0.28 -0.44 -1.23 0.00 0.00 174.94 173.31 1o71 s SER 174 N 1.58 5.32 0.00 3.58 0.01 -0.15 -1.02 113.70 123.03 1o71 s SER 174 Ca 0.02 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.82 1o71 s SER 174 Cb -0.20 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.00 1o71 s SER 174 CO 0.06 -0.30 0.26 -2.11 0.41 0.00 0.00 173.24 171.55