#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tvi s ILE 2 N 0.00 3.15 -0.08 1.12 1.09 -1.26 -4.58 121.20 120.63 1tvi s ILE 2 Ca 0.00 -1.48 0.00 0.00 -1.10 0.00 0.00 60.65 58.08 1tvi s ILE 2 Cb 0.00 -2.49 -0.03 0.00 -1.06 0.00 0.00 42.46 38.88 1tvi s ILE 2 CO 0.00 0.03 -0.07 -0.13 -0.10 0.00 0.00 174.94 174.67 1tvi s ARG 3 N -2.40 2.88 -0.04 2.79 3.00 0.12 -4.97 118.95 120.33 1tvi s ARG 3 Ca 0.22 -0.56 0.04 0.00 0.00 0.00 0.00 55.73 55.43 1tvi s ARG 3 Cb -0.10 -2.62 -0.00 0.00 0.00 0.00 0.00 34.95 32.22 1tvi s ARG 3 CO 0.13 0.59 -0.15 0.96 0.00 0.00 0.00 175.30 176.83 1tvi s ILE 4 N -0.61 1.27 0.12 1.52 -4.36 -1.26 -1.33 121.20 116.55 1tvi s ILE 4 Ca 0.09 -0.62 -0.06 0.00 -0.26 0.00 0.00 60.65 59.80 1tvi s ILE 4 Cb -0.12 -1.10 -0.02 0.00 1.25 0.00 0.00 42.46 42.48 1tvi s ILE 4 CO 0.02 0.37 0.16 -1.48 0.24 0.00 0.00 174.94 174.25 1tvi s LEU 5 N 0.09 1.49 0.00 0.37 2.34 0.48 -4.90 118.68 118.54 1tvi s LEU 5 Ca -0.04 -0.93 0.00 0.00 0.06 0.00 0.00 54.13 53.22 1tvi s LEU 5 Cb -0.11 0.78 0.00 0.00 -0.56 0.00 0.00 46.19 46.31 1tvi s LEU 5 CO 0.02 -0.77 0.00 0.61 -1.06 0.00 0.00 176.35 175.14 1tvi n GLY 6 N -0.10 -1.62 2.95 -3.48 0.00 -1.26 -1.38 105.19 100.29 1tvi n GLY 6 Ca -0.09 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 1tvi n GLY 6 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tvi s GLU 7 N 0.00 0.16 0.00 1.61 2.02 -0.34 -4.75 118.70 117.41 1tvi s GLU 7 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 54.97 54.79 1tvi s GLU 7 Cb 0.00 0.06 0.00 0.00 0.10 0.00 0.00 34.13 34.29 1tvi s GLU 7 CO 0.00 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.66 1tvi n GLY 8 N 2.46 4.21 3.26 -1.39 0.00 -1.26 -3.17 105.19 109.29 1tvi n GLY 8 Ca -0.17 -0.63 -0.60 0.00 0.00 0.00 0.00 46.02 44.62 1tvi n GLY 8 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1tvi n LYS 9 N -0.19 0.00 0.00 1.61 4.81 -1.26 -3.24 118.16 119.89 1tvi n LYS 9 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1tvi n LYS 9 Cb 0.00 -1.48 0.00 0.00 0.02 0.00 0.00 35.03 33.57 1tvi n LYS 9 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1tvi n GLY 10 N 7.06 1.29 0.27 3.14 0.00 -1.26 -4.68 105.19 111.00 1tvi n GLY 10 Ca 0.52 -0.09 -0.15 0.00 0.00 0.00 0.00 46.02 46.31 1tvi n GLY 10 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1tvi h SER 11 N 0.00 -0.58 -0.03 1.61 0.87 -1.95 0.27 113.55 113.75 1tvi h SER 11 Ca 0.00 0.04 -0.18 0.00 -1.23 0.00 0.00 61.79 60.42 1tvi h SER 11 Cb 0.00 0.18 0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1tvi h SER 11 CO 0.00 -0.35 -0.70 0.07 -0.53 0.00 0.00 176.83 175.32 1tvi h LYS 12 N -0.54 0.52 -1.00 2.24 2.10 -1.95 -3.01 116.57 114.93 1tvi h LYS 12 Ca -0.03 -0.52 0.21 0.00 -2.00 0.00 0.00 60.65 58.31 1tvi h LYS 12 Cb 0.46 0.14 -0.11 0.00 -0.90 0.00 0.00 32.23 31.82 1tvi h LYS 12 CO 0.01 1.16 0.61 1.25 -2.00 0.00 0.00 179.45 180.47 1tvi h LEU 13 N 0.09 0.73 -0.50 7.07 5.85 -1.91 0.41 115.31 127.05 1tvi h LEU 13 Ca -0.08 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 1tvi h LEU 13 Cb 1.38 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.37 1tvi h LEU 13 CO 0.14 0.21 0.09 0.25 -0.34 0.00 0.00 178.44 178.79 1tvi h LEU 14 N 0.68 0.78 -1.78 2.25 7.12 -0.42 -1.90 115.31 122.04 1tvi h LEU 14 Ca 0.60 -0.25 0.10 0.00 0.13 0.00 0.00 57.88 58.45 1tvi h LEU 14 Cb 1.03 -0.21 -0.01 0.00 -0.53 0.00 0.00 40.66 40.94 1tvi h LEU 14 CO -0.40 0.84 0.53 -0.33 -0.13 0.00 0.00 178.44 178.94 1tvi h GLU 15 N 0.70 0.00 -0.58 1.25 5.08 -0.05 0.46 114.58 121.44 1tvi h GLU 15 Ca 0.15 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1tvi h GLU 15 Cb 0.38 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1tvi h GLU 15 CO 0.01 0.00 0.36 -0.91 -1.00 0.00 0.00 179.01 177.46 1tvi h ASN 16 N 0.00 0.70 -1.07 1.42 2.35 -0.99 -3.01 115.58 114.98 1tvi h ASN 16 Ca 0.16 -0.06 -0.55 0.00 -0.55 0.00 0.00 56.30 55.31 1tvi h ASN 16 Cb 1.22 -0.18 -0.42 0.00 0.05 0.00 0.00 38.32 38.99 1tvi h ASN 16 CO -0.00 0.55 -0.80 0.00 -1.65 0.00 0.00 177.43 175.52 1tvi n LEU 17 N -4.63 4.61 0.00 1.61 -0.00 0.15 -4.79 117.00 113.94 1tvi n LEU 17 Ca 0.04 -4.85 -0.13 0.00 -0.00 0.00 0.00 56.01 51.07 1tvi n LEU 17 Cb 0.05 -0.34 -0.10 0.00 -0.00 0.00 0.00 43.42 43.04 1tvi n LEU 17 CO 0.36 2.11 0.63 0.50 -0.00 0.00 0.00 177.39 180.99 1tvi h LYS 18 N 2.39 -0.04 0.00 1.47 3.64 -0.95 -2.85 116.57 120.23 1tvi h LYS 18 Ca 0.31 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 1tvi h LYS 18 Cb 1.26 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1tvi h LYS 18 CO 0.77 0.41 -0.06 0.93 -2.27 0.00 0.00 179.45 179.23 1tvi h GLU 19 N -0.50 0.00 -0.79 1.90 5.08 -1.87 -0.91 114.58 117.49 1tvi h GLU 19 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1tvi h GLU 19 Cb 0.46 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1tvi h GLU 19 CO 0.01 0.06 0.40 -0.22 -1.00 0.00 0.00 179.01 178.25 1tvi h LYS 20 N 0.00 1.12 0.07 2.33 3.11 -1.85 -2.36 116.57 118.99 1tvi h LYS 20 Ca -0.00 -0.16 -0.25 0.00 -2.81 0.00 0.00 60.65 57.44 1tvi h LYS 20 Cb 0.19 -0.21 -0.01 0.00 -1.00 0.00 0.00 32.23 31.20 1tvi h LYS 20 CO 0.01 0.86 -1.17 -0.07 -2.81 0.00 0.00 179.45 176.27 1tvi h LEU 21 N 1.11 0.22 -2.33 5.20 3.38 -1.21 -3.17 115.31 118.50 1tvi h LEU 21 Ca 0.27 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1tvi h LEU 21 Cb 0.09 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1tvi h LEU 21 CO -0.04 1.19 0.22 -0.33 0.09 0.00 0.00 178.44 179.57 1tvi h GLU 22 N 0.04 0.00 0.11 1.13 5.08 -0.71 0.26 114.58 120.49 1tvi h GLU 22 Ca -0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1tvi h GLU 22 Cb 1.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.14 1tvi h GLU 22 CO 0.16 0.00 -0.05 0.93 -1.00 0.00 0.00 179.01 179.05 1tvi h GLU 23 N 0.00 -0.14 -0.49 2.33 5.08 -1.43 -0.10 114.58 119.83 1tvi h GLU 23 Ca 0.03 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 1tvi h GLU 23 Cb 0.46 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1tvi h GLU 23 CO -0.00 0.36 0.03 -0.84 -1.00 0.00 0.00 179.01 177.56 1tvi h ILE 24 N -0.81 1.26 -0.15 3.13 3.07 -1.35 1.13 117.51 123.79 1tvi h ILE 24 Ca -0.01 -1.03 0.00 0.00 1.55 0.00 0.00 64.86 65.37 1tvi h ILE 24 Cb 0.57 0.95 -0.01 0.00 -0.27 0.00 0.00 36.82 38.06 1tvi h ILE 24 CO 0.02 0.36 0.10 1.62 -1.05 0.00 0.00 178.15 179.20 1tvi h VAL 25 N 0.72 1.04 0.03 0.16 3.04 -0.63 -1.53 116.25 119.07 1tvi h VAL 25 Ca 0.14 -0.07 -0.00 0.00 -1.01 0.00 0.00 66.70 65.76 1tvi h VAL 25 Cb 0.48 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 1tvi h VAL 25 CO 0.02 0.04 -0.01 0.50 -1.01 0.00 0.00 177.57 177.10 1tvi h LYS 26 N 0.20 -0.03 -0.91 4.17 3.64 -0.82 -0.61 116.57 122.20 1tvi h LYS 26 Ca 0.05 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.52 1tvi h LYS 26 Cb -0.02 0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 31.70 1tvi h LYS 26 CO -0.01 0.37 -0.54 1.17 -2.27 0.00 0.00 179.45 178.17 1tvi n LYS 27 N -4.91 -0.40 -0.06 1.90 4.81 0.39 -0.81 118.16 119.08 1tvi n LYS 27 Ca -0.08 1.45 -0.12 0.00 -0.87 0.00 0.00 58.31 58.69 1tvi n LYS 27 Cb 0.22 -2.14 -0.08 0.00 0.02 0.00 0.00 35.03 33.05 1tvi n LYS 27 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1tvi h GLU 28 N 0.00 -0.39 0.00 1.64 4.81 -1.30 -3.44 114.58 115.90 1tvi h GLU 28 Ca 0.15 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1tvi h GLU 28 Cb 0.37 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1tvi h GLU 28 CO -0.86 -0.26 0.00 1.51 -0.73 0.00 0.00 179.01 178.68 1tvi n ILE 29 N -4.86 0.00 -0.94 2.32 3.06 0.01 -5.07 119.36 113.88 1tvi n ILE 29 Ca -0.04 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.21 1tvi n ILE 29 Cb 0.29 -0.06 0.00 0.00 0.54 0.00 0.00 39.64 40.41 1tvi n ILE 29 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1tvi n GLY 30 N -1.01 0.55 2.70 4.50 0.00 -0.25 -4.81 105.19 106.87 1tvi n GLY 30 Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 1tvi n GLY 30 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tvi n ASP 31 N -0.29 -1.94 -3.72 1.61 -0.08 -1.26 -4.94 116.55 105.93 1tvi n ASP 31 Ca 0.00 -2.56 -0.19 0.00 -1.51 0.00 0.00 54.79 50.52 1tvi n ASP 31 Cb 0.23 1.10 -0.03 0.00 2.34 0.00 0.00 41.12 44.76 1tvi n ASP 31 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 1tvi n VAL 32 N -0.51 0.00 -3.35 5.18 0.24 -1.26 -5.13 118.33 113.49 1tvi n VAL 32 Ca -0.02 -1.47 -0.12 0.00 -2.04 0.00 0.00 64.34 60.68 1tvi n VAL 32 Cb 0.83 0.13 -0.08 0.00 -1.47 0.00 0.00 33.84 33.26 1tvi n VAL 32 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1tvi s HIS 33 N -2.01 -0.76 -0.41 6.34 3.76 -1.26 -4.99 115.29 115.96 1tvi s HIS 33 Ca 0.07 0.17 -0.05 0.00 -0.15 0.00 0.00 55.06 55.09 1tvi s HIS 33 Cb -0.01 -0.27 0.10 0.00 1.11 0.00 0.00 32.58 33.52 1tvi s HIS 33 CO 0.04 -0.93 0.22 0.08 -0.85 0.00 0.00 174.74 173.31 1tvi s VAL 34 N 2.47 3.63 -0.46 -0.90 1.01 -1.26 -3.35 120.40 121.54 1tvi s VAL 34 Ca 0.10 -1.81 -0.12 0.00 0.00 0.00 0.00 61.98 60.15 1tvi s VAL 34 Cb -0.13 -3.38 0.09 0.00 0.00 0.00 0.00 36.38 32.96 1tvi s VAL 34 CO -0.30 -0.62 0.34 0.20 0.00 0.00 0.00 175.10 174.73 1tvi s ASN 35 N 2.00 5.90 0.35 3.32 0.01 -0.72 0.13 114.94 125.93 1tvi s ASN 35 Ca 0.05 -1.50 -0.14 0.00 -0.71 0.00 0.00 52.86 50.56 1tvi s ASN 35 Cb -0.23 -2.09 -0.08 0.00 0.41 0.00 0.00 41.25 39.26 1tvi s ASN 35 CO -0.02 -0.63 0.76 0.68 -1.51 0.00 0.00 177.10 176.38 1tvi s VAL 36 N 1.52 4.69 -0.22 1.60 -7.23 -0.44 -1.17 120.40 119.15 1tvi s VAL 36 Ca 0.04 0.90 0.02 0.00 -1.81 0.00 0.00 61.98 61.13 1tvi s VAL 36 Cb -0.24 -3.64 0.04 0.00 0.56 0.00 0.00 36.38 33.10 1tvi s VAL 36 CO 0.04 -0.28 -0.14 -0.63 -0.31 0.00 0.00 175.10 173.77 1tvi s ILE 37 N -2.10 2.01 -0.24 -0.62 1.09 0.17 -0.39 121.20 121.12 1tvi s ILE 37 Ca 0.54 -1.27 -0.23 0.00 -1.10 0.00 0.00 60.65 58.59 1tvi s ILE 37 Cb -0.10 -2.01 -0.01 0.00 -1.06 0.00 0.00 42.46 39.28 1tvi s ILE 37 CO 0.21 0.20 0.77 -0.76 -0.10 0.00 0.00 174.94 175.26 1tvi s LEU 38 N 1.23 4.09 -0.07 2.97 1.43 -0.48 -0.38 118.68 127.47 1tvi s LEU 38 Ca -0.03 0.96 -0.06 0.00 -1.03 0.00 0.00 54.13 53.97 1tvi s LEU 38 Cb -0.17 -3.10 0.02 0.00 0.03 0.00 0.00 46.19 42.97 1tvi s LEU 38 CO -0.08 -0.46 0.19 0.68 0.23 0.00 0.00 176.35 176.91 1tvi s VAL 39 N 2.66 -0.01 0.00 -1.59 -7.23 -0.63 -1.20 120.40 112.41 1tvi s VAL 39 Ca 0.33 0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.52 1tvi s VAL 39 Cb -0.15 -0.28 0.00 0.00 0.56 0.00 0.00 36.38 36.50 1tvi s VAL 39 CO 0.08 0.01 0.00 -1.20 -0.31 0.00 0.00 175.10 173.68 1tvi n SER 40 N 3.16 -0.42 -0.04 4.85 7.64 -1.26 -3.88 113.62 123.66 1tvi n SER 40 Ca -0.15 -0.33 -0.14 0.00 1.01 0.00 0.00 58.87 59.26 1tvi n SER 40 Cb 0.58 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.70 1tvi n SER 40 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1tvi h GLU 41 N 0.00 0.37 -0.20 1.43 4.81 -1.96 0.76 114.58 119.79 1tvi h GLU 41 Ca 0.00 -0.25 -0.20 0.00 -0.13 0.00 0.00 59.36 58.78 1tvi h GLU 41 Cb 0.00 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1tvi h GLU 41 CO 0.00 0.85 -0.67 0.22 -0.73 0.00 0.00 179.01 178.68 1tvi h ASP 42 N -0.06 0.89 -0.60 1.04 3.58 -1.98 0.43 116.42 119.73 1tvi h ASP 42 Ca 0.00 -0.54 -0.07 0.00 0.42 0.00 0.00 57.03 56.84 1tvi h ASP 42 Cb 0.85 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.61 1tvi h ASP 42 CO 0.06 1.32 0.12 -0.33 -2.88 0.00 0.00 179.24 177.53 1tvi h GLU 43 N 0.56 1.01 0.07 0.28 4.39 -1.90 -2.56 114.58 116.42 1tvi h GLU 43 Ca -0.02 -0.25 -0.24 0.00 0.34 0.00 0.00 59.36 59.19 1tvi h GLU 43 Cb 1.29 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 1tvi h GLU 43 CO 0.14 0.92 -1.11 0.97 -1.16 0.00 0.00 179.01 178.77 1tvi h ILE 44 N 0.95 1.55 -0.62 3.13 2.10 -0.77 -1.70 117.51 122.16 1tvi h ILE 44 Ca 0.20 -3.06 0.12 0.00 1.08 0.00 0.00 64.86 63.19 1tvi h ILE 44 Cb 0.39 2.82 -0.09 0.00 -1.09 0.00 0.00 36.82 38.85 1tvi h ILE 44 CO 0.01 0.89 0.13 0.50 -1.08 0.00 0.00 178.15 178.59 1tvi h LYS 45 N 0.07 0.25 0.01 2.19 3.64 0.23 0.22 116.57 123.17 1tvi h LYS 45 Ca -0.08 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1tvi h LYS 45 Cb 1.82 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 1tvi h LYS 45 CO 0.17 0.16 -0.05 0.93 -2.27 0.00 0.00 179.45 178.40 1tvi h GLU 46 N 0.26 0.02 -1.44 1.90 5.08 -1.51 -2.88 114.58 116.01 1tvi h GLU 46 Ca 0.33 -0.03 0.42 0.00 -1.00 0.00 0.00 59.36 59.07 1tvi h GLU 46 Cb 0.50 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 1tvi h GLU 46 CO -0.42 0.94 1.03 1.25 -1.00 0.00 0.00 179.01 180.82 1tvi h LEU 47 N -0.88 0.00 0.02 1.33 7.12 -0.87 0.69 115.31 122.72 1tvi h LEU 47 Ca -0.01 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.00 1tvi h LEU 47 Cb 0.97 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.10 1tvi h LEU 47 CO 0.01 -0.00 -0.01 -1.13 -0.13 0.00 0.00 178.44 177.18 1tvi h ASN 48 N 0.00 -0.03 -0.17 1.25 -0.73 -0.59 -3.23 115.58 112.09 1tvi h ASN 48 Ca 0.68 -0.72 0.05 0.00 1.87 0.00 0.00 56.30 58.18 1tvi h ASN 48 Cb 2.74 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 41.33 1tvi h ASN 48 CO -0.01 0.78 0.18 1.56 -0.37 0.00 0.00 177.43 179.57 1tvi h GLN 49 N -0.90 0.00 -1.07 6.67 4.20 0.33 1.10 115.11 125.45 1tvi h GLN 49 Ca -0.00 0.00 0.28 0.00 0.06 0.00 0.00 58.65 58.99 1tvi h GLN 49 Cb 0.75 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.44 1tvi h GLN 49 CO 0.01 0.00 0.69 1.96 -0.67 0.00 0.00 178.83 180.82 1tvi h GLN 50 N 0.00 0.33 0.00 1.46 4.20 -0.12 0.31 115.11 121.29 1tvi h GLN 50 Ca 0.08 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1tvi h GLN 50 Cb 0.44 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1tvi h GLN 50 CO -0.00 0.22 -0.65 1.19 -0.67 0.00 0.00 178.83 178.91 1tvi n PHE 51 N -4.59 0.00 0.26 2.96 3.01 -0.37 -4.75 117.46 113.98 1tvi n PHE 51 Ca 0.26 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.86 1tvi n PHE 51 Cb 0.94 0.12 0.62 0.00 -0.01 0.00 0.00 39.48 41.15 1tvi n PHE 51 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1tvi h ARG 52 N 0.00 0.00 -0.80 -1.08 2.47 0.11 -3.45 114.38 111.62 1tvi h ARG 52 Ca 0.00 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.50 1tvi h ARG 52 Cb 0.65 0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 28.89 1tvi h ARG 52 CO 0.00 0.10 -0.20 0.41 0.56 0.00 0.00 179.97 180.84 1tvi n GLY 53 N -0.03 1.02 3.44 0.04 0.00 0.10 -4.86 105.19 104.90 1tvi n GLY 53 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1tvi n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tvi s GLN 54 N -2.76 2.28 -0.74 1.61 -0.21 -1.26 -4.87 119.66 113.71 1tvi s GLN 54 Ca 0.00 -0.84 -0.17 0.00 0.02 0.00 0.00 55.36 54.38 1tvi s GLN 54 Cb 0.00 -2.25 0.15 0.00 1.00 0.00 0.00 33.01 31.92 1tvi s GLN 54 CO 0.00 0.58 0.79 0.34 -2.12 0.00 0.00 175.29 174.88 1tvi s ASP 55 N -0.94 6.49 -0.29 5.90 2.15 -1.26 -3.46 116.67 125.25 1tvi s ASP 55 Ca 0.12 -2.06 -0.18 0.00 0.43 0.00 0.00 52.55 50.85 1tvi s ASP 55 Cb -0.10 -2.28 0.18 0.00 -0.30 0.00 0.00 42.92 40.42 1tvi s ASP 55 CO 0.02 -0.88 1.20 0.00 -0.17 0.00 0.00 175.17 175.35 1tvi s ARG 56 N 1.63 0.17 0.79 4.34 1.70 -1.26 -5.14 118.95 121.18 1tvi s ARG 56 Ca 0.17 0.27 -0.11 0.00 -0.47 0.00 0.00 55.73 55.58 1tvi s ARG 56 Cb -0.16 0.05 0.06 0.00 -0.57 0.00 0.00 34.95 34.33 1tvi s ARG 56 CO -0.03 -0.03 1.09 -1.25 -1.08 0.00 0.00 175.30 174.00 1tvi s PRO 57 N 0.85 2.18 0.00 3.89 0.04 -1.26 -4.88 135.00 135.82 1tvi s PRO 57 Ca -0.04 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.67 1tvi s PRO 57 Cb -0.03 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1tvi s PRO 57 CO -0.12 -1.56 0.44 -2.37 0.04 0.00 0.00 177.00 173.43 1tvi n THR 58 N -3.40 0.02 0.00 1.26 5.66 -1.26 -5.02 114.28 111.55 1tvi n THR 58 Ca 0.07 -0.02 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1tvi n THR 58 Cb 0.56 1.13 0.00 0.00 -1.55 0.00 0.00 70.33 70.47 1tvi n THR 58 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1tvi n ASP 59 N -0.01 0.00 -3.70 1.09 8.00 -1.26 -4.71 116.55 115.96 1tvi n ASP 59 Ca 0.00 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 1tvi n ASP 59 Cb 0.46 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.41 1tvi n ASP 59 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1tvi s VAL 60 N 0.00 -0.17 -0.12 2.53 0.11 -1.26 -1.95 120.40 119.53 1tvi s VAL 60 Ca 0.00 0.26 -0.15 0.00 -2.93 0.00 0.00 61.98 59.17 1tvi s VAL 60 Cb 0.00 -0.30 -0.05 0.00 -1.53 0.00 0.00 36.38 34.51 1tvi s VAL 60 CO 0.00 0.11 0.35 -0.76 -3.33 0.00 0.00 175.10 171.46 1tvi s LEU 61 N 1.77 4.30 -0.08 2.54 1.02 0.56 -4.96 118.68 123.83 1tvi s LEU 61 Ca -0.03 0.65 0.02 0.00 0.02 0.00 0.00 54.13 54.79 1tvi s LEU 61 Cb -0.12 -2.47 -0.02 0.00 0.02 0.00 0.00 46.19 43.61 1tvi s LEU 61 CO -0.06 0.13 -0.14 -0.89 0.02 0.00 0.00 176.35 175.41 1tvi s THR 62 N 0.15 3.06 0.15 5.49 2.01 -1.26 0.26 115.64 125.49 1tvi s THR 62 Ca 0.20 -0.70 -0.30 0.00 0.31 0.00 0.00 61.69 61.20 1tvi s THR 62 Cb -0.14 -2.23 -0.07 0.00 0.01 0.00 0.00 72.50 70.07 1tvi s THR 62 CO 0.07 0.56 0.99 -0.36 -0.69 0.00 0.00 174.62 175.20 1tvi s PHE 63 N -0.27 3.78 -0.49 4.92 0.40 -1.25 -4.98 117.98 120.09 1tvi s PHE 63 Ca 0.02 1.77 -0.28 0.00 -0.60 0.00 0.00 56.93 57.83 1tvi s PHE 63 Cb -0.13 -3.10 0.01 0.00 0.51 0.00 0.00 43.02 40.31 1tvi s PHE 63 CO 0.03 0.04 1.45 -1.25 0.70 0.00 0.00 175.22 176.19 1tvi s PRO 64 N -0.25 3.39 -0.09 0.24 0.04 -1.26 -4.63 135.00 132.44 1tvi s PRO 64 Ca 0.47 0.72 0.03 0.00 0.04 0.00 0.00 61.00 62.26 1tvi s PRO 64 Cb -0.25 -4.10 0.10 0.00 0.04 0.00 0.00 34.50 30.30 1tvi s PRO 64 CO 0.31 -1.81 0.80 1.47 0.04 0.00 0.00 177.00 177.81 1tvi n LEU 65 N 9.43 -0.67 -0.09 -3.56 -0.00 -1.26 -5.02 117.00 115.83 1tvi n LEU 65 Ca 0.15 -1.62 -0.02 0.00 -0.00 0.00 0.00 56.01 54.52 1tvi n LEU 65 Cb 0.49 0.23 -0.02 0.00 -0.00 0.00 0.00 43.42 44.12 1tvi n LEU 65 CO 0.71 1.21 0.11 0.23 -0.00 0.00 0.00 177.39 179.64 1tvi n MET 66 N -0.39 -0.08 0.00 1.47 2.81 -1.26 -4.35 117.12 115.31 1tvi n MET 66 Ca -0.13 0.32 0.00 0.00 -1.81 0.00 0.00 57.70 56.08 1tvi n MET 66 Cb 0.60 -0.47 0.00 0.00 -0.71 0.00 0.00 33.22 32.63 1tvi n MET 66 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1tvi n GLU 67 N -4.27 0.00 -0.13 0.03 2.13 -1.26 -3.08 120.64 114.05 1tvi n GLU 67 Ca 0.01 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.94 1tvi n GLU 67 Cb 0.06 0.00 0.18 0.00 0.27 0.00 0.00 31.44 31.95 1tvi n GLU 67 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1tvi n GLU 68 N 0.55 2.38 0.00 5.31 2.13 -1.26 -4.87 120.64 124.88 1tvi n GLU 68 Ca 0.00 -2.14 0.00 0.00 0.66 0.00 0.00 57.16 55.68 1tvi n GLU 68 Cb 0.00 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.23 1tvi n GLU 68 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1tvi n ASP 69 N 1.39 0.00 -0.37 4.31 5.75 -1.18 -4.95 116.55 121.50 1tvi n ASP 69 Ca 0.17 0.00 -0.10 0.00 -0.01 0.00 0.00 54.79 54.86 1tvi n ASP 69 Cb 0.58 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.59 1tvi n ASP 69 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 1tvi n VAL 70 N 0.00 -0.60 -3.63 2.12 3.14 -1.26 -4.66 118.33 113.45 1tvi n VAL 70 Ca 0.00 2.14 -0.29 0.00 -2.96 0.00 0.00 64.34 63.22 1tvi n VAL 70 Cb 0.00 -2.64 -0.05 0.00 -1.06 0.00 0.00 33.84 30.08 1tvi n VAL 70 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1tvi n TYR 71 N -5.11 -0.93 0.00 1.45 9.36 -1.26 -4.75 117.16 115.91 1tvi n TYR 71 Ca 0.02 0.47 0.00 0.00 3.32 0.00 0.00 57.90 61.71 1tvi n TYR 71 Cb 0.23 -1.34 0.00 0.00 -0.63 0.00 0.00 39.34 37.60 1tvi n TYR 71 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1tvi n GLY 72 N -0.87 2.60 3.24 2.98 0.00 -1.21 -4.69 105.19 107.23 1tvi n GLY 72 Ca 0.08 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 1tvi n GLY 72 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tvi s GLU 73 N 3.40 1.03 -0.06 1.61 1.03 -1.26 -1.75 118.70 122.69 1tvi s GLU 73 Ca 0.00 -1.41 -0.03 0.00 0.03 0.00 0.00 54.97 53.56 1tvi s GLU 73 Cb 0.00 -0.60 0.04 0.00 -0.80 0.00 0.00 34.13 32.76 1tvi s GLU 73 CO 0.00 0.07 0.14 -1.50 -1.33 0.00 0.00 175.26 172.64 1tvi s ILE 74 N -3.23 -0.05 -0.05 1.83 2.07 -0.31 -3.83 121.20 117.63 1tvi s ILE 74 Ca 0.15 0.17 -0.17 0.00 -1.41 0.00 0.00 60.65 59.39 1tvi s ILE 74 Cb 0.02 -0.23 -0.05 0.00 0.13 0.00 0.00 42.46 42.33 1tvi s ILE 74 CO 0.00 0.07 0.45 -0.31 -1.91 0.00 0.00 174.94 173.25 1tvi s TYR 75 N 1.09 3.64 0.11 3.50 1.51 0.14 0.43 117.35 127.77 1tvi s TYR 75 Ca -0.09 0.97 0.03 0.00 -1.01 0.00 0.00 57.07 56.97 1tvi s TYR 75 Cb -0.11 -2.43 -0.04 0.00 -0.11 0.00 0.00 41.96 39.27 1tvi s TYR 75 CO -0.05 0.42 -0.08 0.08 -1.11 0.00 0.00 175.55 174.81 1tvi s VAL 76 N -0.32 0.82 -0.26 0.71 1.01 0.49 0.21 120.40 123.07 1tvi s VAL 76 Ca 0.25 -1.88 -0.02 0.00 0.00 0.00 0.00 61.98 60.33 1tvi s VAL 76 Cb -0.16 -1.62 0.12 0.00 0.00 0.00 0.00 36.38 34.72 1tvi s VAL 76 CO 0.12 -0.78 0.27 0.00 0.00 0.00 0.00 175.10 174.72 1tvi n PRO 78 N 5.31 0.75 0.01 0.00 -0.04 -1.26 -3.22 135.00 136.55 1tvi n PRO 78 Ca -0.03 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.30 1tvi n PRO 78 Cb 0.47 -1.39 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1tvi n PRO 78 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1tvi h LEU 79 N 0.00 -0.06 -0.04 1.53 5.85 -1.93 -1.50 115.31 119.16 1tvi h LEU 79 Ca 0.00 -0.48 -0.26 0.00 0.84 0.00 0.00 57.88 57.98 1tvi h LEU 79 Cb 0.00 0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.07 1tvi h LEU 79 CO 0.00 0.47 -0.99 0.40 -0.34 0.00 0.00 178.44 177.98 1tvi h ILE 80 N -0.62 1.28 -0.14 4.05 5.03 -1.91 -2.09 117.51 123.11 1tvi h ILE 80 Ca -0.01 -2.19 0.05 0.00 -0.12 0.00 0.00 64.86 62.59 1tvi h ILE 80 Cb 0.54 2.30 -0.06 0.00 -3.03 0.00 0.00 36.82 36.57 1tvi h ILE 80 CO 0.01 0.68 -0.24 0.58 -0.68 0.00 0.00 178.15 178.50 1tvi h VAL 81 N 0.43 0.42 0.19 1.67 2.07 -1.62 1.29 116.25 120.69 1tvi h VAL 81 Ca -0.11 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1tvi h VAL 81 Cb 1.64 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1tvi h VAL 81 CO 0.20 0.00 -0.09 -0.08 0.02 0.00 0.00 177.57 177.62 1tvi h GLU 82 N -0.30 -0.24 -0.95 1.57 4.22 -1.32 1.62 114.58 119.17 1tvi h GLU 82 Ca 0.10 0.02 0.11 0.00 0.08 0.00 0.00 59.36 59.67 1tvi h GLU 82 Cb 0.46 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.68 1tvi h GLU 82 CO -0.31 -0.10 0.61 1.49 -2.18 0.00 0.00 179.01 178.52 1tvi h GLU 83 N -0.33 0.90 -0.00 1.92 4.81 -0.86 0.39 114.58 121.41 1tvi h GLU 83 Ca -0.03 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.08 1tvi h GLU 83 Cb 0.25 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.43 1tvi h GLU 83 CO 0.04 0.60 -0.26 -0.91 -0.73 0.00 0.00 179.01 177.75 1tvi h ASN 84 N 0.93 0.24 -0.30 1.04 2.35 0.21 -3.09 115.58 116.95 1tvi h ASN 84 Ca 0.46 -0.77 0.09 0.00 -0.55 0.00 0.00 56.30 55.52 1tvi h ASN 84 Cb 0.48 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1tvi h ASN 84 CO -0.22 0.98 0.28 0.00 -1.65 0.00 0.00 177.43 176.81 1tvi h ALA 85 N 0.26 2.05 -0.49 -0.83 0.00 0.32 0.97 119.26 121.54 1tvi h ALA 85 Ca -0.03 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1tvi h ALA 85 Cb 1.02 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1tvi h ALA 85 CO 0.05 -0.43 -0.18 0.00 0.00 0.00 0.00 179.25 178.69 1tvi h ARG 86 N 0.00 0.99 0.00 0.00 3.08 -0.18 2.23 114.38 120.49 1tvi h ARG 86 Ca 0.14 -0.41 -0.22 0.00 0.07 0.00 0.00 59.98 59.56 1tvi h ARG 86 Cb 0.69 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.66 1tvi h ARG 86 CO -0.00 1.08 -1.28 1.05 -1.07 0.00 0.00 179.97 179.75 1tvi h GLU 87 N 0.84 0.00 -0.60 0.04 4.11 -0.62 -3.29 114.58 115.07 1tvi h GLU 87 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 1tvi h GLU 87 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1tvi h GLU 87 CO 0.06 0.64 0.00 0.34 0.07 0.00 0.00 179.01 180.12 1tvi n PHE 88 N -3.15 1.06 -2.55 2.06 7.35 0.31 -4.92 117.46 117.62 1tvi n PHE 88 Ca -0.08 -0.56 -0.03 0.00 -0.76 0.00 0.00 57.45 56.01 1tvi n PHE 88 Cb 0.95 -0.12 -0.01 0.00 0.35 0.00 0.00 39.48 40.66 1tvi n PHE 88 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1tvi n ASN 89 N 1.10 -1.01 -4.84 -2.13 4.05 0.72 -4.83 115.26 108.32 1tvi n ASN 89 Ca 0.22 0.33 -0.32 0.00 0.45 0.00 0.00 54.58 55.27 1tvi n ASN 89 Cb 0.70 -0.99 -0.02 0.00 1.23 0.00 0.00 39.78 40.70 1tvi n ASN 89 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 1tvi s ASN 90 N -1.98 6.47 -0.71 1.20 2.47 0.49 -4.95 114.94 117.93 1tvi s ASN 90 Ca 0.07 1.56 -0.26 0.00 0.42 0.00 0.00 52.86 54.64 1tvi s ASN 90 Cb -0.04 -2.50 -0.01 0.00 -1.45 0.00 0.00 41.25 37.25 1tvi s ASN 90 CO 0.08 -0.69 1.71 0.42 -3.72 0.00 0.00 177.10 174.89 1tvi s THR 91 N -2.73 3.49 0.57 -5.21 -4.23 -1.26 -4.64 115.64 101.63 1tvi s THR 91 Ca 0.58 0.10 0.29 0.00 -1.18 0.00 0.00 61.69 61.49 1tvi s THR 91 Cb -0.11 -4.26 0.41 0.00 1.34 0.00 0.00 72.50 69.89 1tvi s THR 91 CO 0.36 -1.21 1.90 0.15 -0.54 0.00 0.00 174.62 175.28 1tvi h PHE 92 N 12.90 0.00 0.04 3.99 3.57 -1.91 0.41 116.94 135.94 1tvi h PHE 92 Ca -0.18 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.32 1tvi h PHE 92 Cb 1.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.84 1tvi h PHE 92 CO 1.11 0.00 -0.02 0.93 -2.23 0.00 0.00 178.31 178.10 1tvi h GLU 93 N 0.00 -0.06 0.31 1.11 5.08 -1.98 -2.94 114.58 116.10 1tvi h GLU 93 Ca 0.27 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.63 1tvi h GLU 93 Cb 1.31 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 1tvi h GLU 93 CO -0.00 0.55 -0.22 -0.22 -1.00 0.00 0.00 179.01 178.12 1tvi h LYS 94 N -0.93 -0.50 -0.09 2.33 3.11 -1.58 0.24 116.57 119.14 1tvi h LYS 94 Ca -0.01 0.03 0.03 0.00 -2.81 0.00 0.00 60.65 57.90 1tvi h LYS 94 Cb 0.63 0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 31.97 1tvi h LYS 94 CO 0.01 -0.34 0.37 1.49 -2.81 0.00 0.00 179.45 178.17 1tvi h GLU 95 N -0.52 0.00 0.00 1.90 4.22 -0.40 1.28 114.58 121.06 1tvi h GLU 95 Ca -0.02 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.41 1tvi h GLU 95 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1tvi h GLU 95 CO 0.01 0.00 -0.23 1.25 -2.18 0.00 0.00 179.01 177.86 1tvi h LEU 96 N 0.00 0.00 -2.22 1.64 7.12 -0.83 -3.33 115.31 117.69 1tvi h LEU 96 Ca 0.04 -0.03 0.02 0.00 0.13 0.00 0.00 57.88 58.04 1tvi h LEU 96 Cb 0.78 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.91 1tvi h LEU 96 CO -0.00 0.63 0.05 0.17 -0.13 0.00 0.00 178.44 179.16 1tvi h LEU 97 N -1.00 0.00 -2.02 2.25 8.10 0.39 0.68 115.31 123.71 1tvi h LEU 97 Ca -0.01 0.00 0.04 0.00 0.11 0.00 0.00 57.88 58.03 1tvi h LEU 97 Cb 0.25 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.47 1tvi h LEU 97 CO -0.00 0.00 0.11 1.05 -4.11 0.00 0.00 178.44 175.49 1tvi h GLU 98 N 0.00 0.00 0.00 0.17 -0.00 0.15 0.20 114.58 115.10 1tvi h GLU 98 Ca 0.03 0.00 -0.16 0.00 -0.00 0.00 0.00 59.36 59.22 1tvi h GLU 98 Cb 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.85 1tvi h GLU 98 CO -0.00 0.00 -0.78 -0.39 -0.00 0.00 0.00 179.01 177.83 1tvi h VAL 99 N 0.00 1.41 0.48 -1.06 -1.51 -0.96 -2.55 116.25 112.06 1tvi h VAL 99 Ca 0.07 -2.84 -0.02 0.00 -1.23 0.00 0.00 66.70 62.68 1tvi h VAL 99 Cb 0.29 2.59 0.00 0.00 -2.13 0.00 0.00 31.29 32.05 1tvi h VAL 99 CO -0.00 0.77 -0.23 0.58 -1.23 0.00 0.00 177.57 177.46 1tvi h VAL 100 N 0.00 0.35 0.00 7.19 2.07 -0.58 -2.76 116.25 122.52 1tvi h VAL 100 Ca -0.01 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 1tvi h VAL 100 Cb 1.53 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1tvi h VAL 100 CO 0.10 0.06 -0.01 0.16 0.02 0.00 0.00 177.57 177.91 1tvi h ILE 101 N -1.00 0.09 -0.90 4.57 3.07 -1.34 -1.56 117.51 120.44 1tvi h ILE 101 Ca -0.07 -0.07 0.13 0.00 1.55 0.00 0.00 64.86 66.41 1tvi h ILE 101 Cb 0.59 1.06 -0.09 0.00 -0.27 0.00 0.00 36.82 38.11 1tvi h ILE 101 CO 0.11 0.00 0.51 -0.74 -1.05 0.00 0.00 178.15 176.98 1tvi h HIS 102 N 0.00 0.91 0.00 0.16 2.76 -1.14 1.51 115.15 119.36 1tvi h HIS 102 Ca -0.00 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1tvi h HIS 102 Cb 0.06 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 28.75 1tvi h HIS 102 CO 0.00 0.29 -0.00 0.78 -1.30 0.00 0.00 177.93 177.70 1tvi h GLY 103 N 0.76 -0.01 0.57 5.26 0.00 -1.33 -2.84 103.07 105.48 1tvi h GLY 103 Ca 0.47 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.82 1tvi h GLY 103 CO -0.32 -0.00 -0.24 -2.22 0.00 0.00 0.00 176.54 173.76 1tvi h ILE 104 N -0.96 0.47 -0.66 2.60 2.04 -1.35 -0.32 117.51 119.33 1tvi h ILE 104 Ca -0.00 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.99 1tvi h ILE 104 Cb 0.86 0.47 -0.10 0.00 -0.74 0.00 0.00 36.82 37.32 1tvi h ILE 104 CO 0.00 0.00 0.15 0.17 0.00 0.00 0.00 178.15 178.47 1tvi h LEU 105 N -0.43 0.01 -1.52 1.44 8.10 0.20 0.80 115.31 123.91 1tvi h LEU 105 Ca 0.03 0.13 0.08 0.00 0.11 0.00 0.00 57.88 58.23 1tvi h LEU 105 Cb 0.46 0.17 -0.04 0.00 -0.44 0.00 0.00 40.66 40.81 1tvi h LEU 105 CO -0.15 -0.01 0.42 -0.74 -4.11 0.00 0.00 178.44 173.86 1tvi h HIS 106 N 0.27 0.58 0.00 0.17 2.76 -1.05 0.40 115.15 118.27 1tvi h HIS 106 Ca 0.36 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.54 1tvi h HIS 106 Cb 0.57 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.34 1tvi h HIS 106 CO -0.26 0.29 -0.14 -0.07 -1.30 0.00 0.00 177.93 176.46 1tvi h LEU 107 N 0.56 0.00 -2.37 0.26 3.38 0.19 -3.16 115.31 114.17 1tvi h LEU 107 Ca 0.28 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1tvi h LEU 107 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1tvi h LEU 107 CO -0.09 0.00 0.18 0.00 0.09 0.00 0.00 178.44 178.63 1tvi h ALA 108 N 2.04 1.18 -1.41 1.53 0.00 0.48 -3.47 119.26 119.60 1tvi h ALA 108 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tvi h ALA 108 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1tvi h ALA 108 CO 0.00 -0.18 -0.36 0.41 0.00 0.00 0.00 179.25 179.13 1tvi n GLY 109 N -1.17 -3.46 2.98 0.00 0.00 -1.19 -5.03 105.19 97.31 1tvi n GLY 109 Ca -0.02 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 44.85 1tvi n GLY 109 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1tvi n TYR 110 N -1.39 -1.79 -1.69 1.61 4.01 -1.26 -5.04 117.16 111.60 1tvi n TYR 110 Ca 0.00 -1.70 -0.32 0.00 -0.16 0.00 0.00 57.90 55.72 1tvi n TYR 110 Cb 0.08 0.64 -0.07 0.00 -0.31 0.00 0.00 39.34 39.69 1tvi n TYR 110 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1tvi n ASP 111 N -1.54 2.66 0.00 7.72 9.92 -1.26 -4.28 116.55 129.77 1tvi n ASP 111 Ca -0.04 -2.66 0.00 0.00 -0.53 0.00 0.00 54.79 51.55 1tvi n ASP 111 Cb 0.49 -1.51 0.00 0.00 -0.64 0.00 0.00 41.12 39.46 1tvi n ASP 111 CO 0.00 0.00 0.00 1.57 0.13 0.00 0.00 177.20 178.90 1tvi n HIS 112 N 12.78 0.00 0.00 1.24 -0.00 -1.26 -3.37 115.22 124.61 1tvi n HIS 112 Ca 0.46 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.64 1tvi n HIS 112 Cb 0.45 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.32 1tvi n HIS 112 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 1tvi n GLU 113 N 0.00 0.00 -0.27 1.57 0.00 -1.26 -4.97 120.64 115.71 1tvi n GLU 113 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.25 1tvi n GLU 113 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 31.44 31.67 1tvi n GLU 113 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 1tvi h PHE 114 N 0.00 0.40 0.00 4.31 -5.15 -1.84 -3.45 116.94 111.21 1tvi h PHE 114 Ca 0.00 0.04 0.00 0.00 -0.20 0.00 0.00 57.97 57.81 1tvi h PHE 114 Cb 0.00 -0.05 0.00 0.00 0.22 0.00 0.00 35.95 36.12 1tvi h PHE 114 CO 0.00 -0.08 0.00 -1.91 -2.00 0.00 0.00 178.31 174.32 1tvi n GLU 115 N -5.13 0.00 0.00 6.09 2.13 -1.22 -3.90 120.64 118.61 1tvi n GLU 115 Ca 0.17 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.99 1tvi n GLU 115 Cb 0.54 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.25 1tvi n GLU 115 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1tvi n ASP 116 N 3.81 0.00 0.00 4.31 9.92 -1.26 -4.91 116.55 128.42 1tvi n ASP 116 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1tvi n ASP 116 Cb 0.00 -0.12 0.00 0.00 -0.64 0.00 0.00 41.12 40.36 1tvi n ASP 116 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1tvi n LYS 117 N -2.04 0.00 0.00 -1.24 4.01 -1.25 -5.06 118.16 112.58 1tvi n LYS 117 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1tvi n LYS 117 Cb 0.00 -0.07 0.00 0.00 -0.51 0.00 0.00 35.03 34.45 1tvi n LYS 117 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1tvi n ASN 118 N -0.86 0.00 -0.01 4.39 0.23 -1.26 -4.79 115.26 112.95 1tvi n ASN 118 Ca 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 54.58 54.01 1tvi n ASN 118 Cb 0.00 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.69 1tvi n ASN 118 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1tvi n SER 119 N 0.00 0.43 -0.26 0.53 3.41 -1.26 -4.04 113.62 112.43 1tvi n SER 119 Ca 0.00 0.07 0.06 0.00 -0.26 0.00 0.00 58.87 58.74 1tvi n SER 119 Cb 0.00 -0.16 0.20 0.00 -0.26 0.00 0.00 64.21 63.98 1tvi n SER 119 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1tvi h LYS 120 N -0.15 0.42 0.06 4.33 3.64 -1.96 0.53 116.57 123.43 1tvi h LYS 120 Ca -0.09 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1tvi h LYS 120 Cb 0.96 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1tvi h LYS 120 CO -0.06 0.28 -0.03 1.49 -2.27 0.00 0.00 179.45 178.86 1tvi h GLU 121 N 0.43 -0.07 -0.94 1.90 4.57 -1.86 -2.60 114.58 116.00 1tvi h GLU 121 Ca 0.43 0.01 0.26 0.00 -1.18 0.00 0.00 59.36 58.87 1tvi h GLU 121 Cb 0.67 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.23 1tvi h GLU 121 CO -0.42 0.51 0.66 0.52 -1.18 0.00 0.00 179.01 179.10 1tvi h MET 122 N -0.77 0.10 0.02 1.92 2.86 -1.52 0.56 114.93 118.12 1tvi h MET 122 Ca -0.01 -0.01 -0.21 0.00 -2.06 0.00 0.00 59.70 57.42 1tvi h MET 122 Cb 0.62 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 1tvi h MET 122 CO 0.01 0.07 -0.97 0.35 1.06 0.00 0.00 176.91 177.43 1tvi h PHE 123 N 0.11 0.17 0.85 -0.22 3.04 0.05 -2.87 116.94 118.07 1tvi h PHE 123 Ca 0.46 -0.11 -0.04 0.00 3.98 0.00 0.00 57.97 62.26 1tvi h PHE 123 Cb 1.66 -0.01 0.01 0.00 2.56 0.00 0.00 35.95 40.17 1tvi h PHE 123 CO -0.00 1.01 -0.41 0.93 -2.02 0.00 0.00 178.31 177.82 1tvi h GLU 124 N 0.05 -1.11 -0.15 1.11 4.39 0.53 -0.02 114.58 119.38 1tvi h GLU 124 Ca -0.04 0.08 0.04 0.00 0.34 0.00 0.00 59.36 59.78 1tvi h GLU 124 Cb 1.66 0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 30.56 1tvi h GLU 124 CO 0.14 -0.74 0.14 0.87 -1.16 0.00 0.00 179.01 178.26 1tvi h LYS 125 N -1.19 0.00 -0.08 2.33 1.79 -1.55 0.24 116.57 118.12 1tvi h LYS 125 Ca -0.12 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.23 1tvi h LYS 125 Cb 0.88 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.52 1tvi h LYS 125 CO 0.19 0.00 -0.49 0.37 -1.08 0.00 0.00 179.45 178.44 1tvi h GLN 126 N 0.00 0.20 0.00 3.15 4.15 -1.19 -2.29 115.11 119.12 1tvi h GLN 126 Ca 0.07 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1tvi h GLN 126 Cb 0.35 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.04 1tvi h GLN 126 CO -0.00 0.65 0.00 0.87 -1.93 0.00 0.00 178.83 178.41 1tvi h LYS 127 N 0.16 0.00 0.21 1.69 1.79 0.14 -1.99 116.57 118.57 1tvi h LYS 127 Ca 0.01 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.47 1tvi h LYS 127 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 1tvi h LYS 127 CO 0.07 0.00 -0.10 -0.22 -1.08 0.00 0.00 179.45 178.12 1tvi h LYS 128 N 0.00 -0.28 -0.05 3.15 3.11 -0.82 0.59 116.57 122.28 1tvi h LYS 128 Ca 0.00 0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 57.71 1tvi h LYS 128 Cb 0.81 0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 32.09 1tvi h LYS 128 CO 0.00 0.03 -0.65 1.88 -2.81 0.00 0.00 179.45 177.90 1tvi h TYR 129 N -0.60 0.27 0.15 1.91 0.05 -1.56 -2.90 116.97 114.30 1tvi h TYR 129 Ca -0.03 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.63 1tvi h TYR 129 Cb 0.44 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.13 1tvi h TYR 129 CO 0.02 0.79 -0.07 0.28 -1.05 0.00 0.00 178.16 178.13 1tvi h VAL 130 N 0.15 0.93 -0.08 -2.88 2.07 -1.32 0.55 116.25 115.67 1tvi h VAL 130 Ca -0.01 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.20 1tvi h VAL 130 Cb 1.17 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1tvi h VAL 130 CO 0.10 0.08 0.10 1.05 0.02 0.00 0.00 177.57 178.91 1tvi h GLU 131 N -0.36 0.00 0.05 1.57 4.11 -0.88 1.35 114.58 120.42 1tvi h GLU 131 Ca -0.02 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.27 1tvi h GLU 131 Cb 0.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1tvi h GLU 131 CO 0.03 0.00 -0.67 0.93 0.07 0.00 0.00 179.01 179.37 1tvi h GLU 132 N 0.00 0.11 0.14 1.06 5.08 -1.15 -2.64 114.58 117.18 1tvi h GLU 132 Ca 0.04 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1tvi h GLU 132 Cb 0.23 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1tvi h GLU 132 CO -0.00 1.09 -0.06 0.28 -1.00 0.00 0.00 179.01 179.32 1tvi h VAL 133 N -0.73 1.03 0.00 3.13 2.07 0.91 -2.39 116.25 120.27 1tvi h VAL 133 Ca -0.15 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1tvi h VAL 133 Cb 1.34 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1tvi h VAL 133 CO 0.01 0.20 0.00 -0.25 0.02 0.00 0.00 177.57 177.55 1tvi h TRP 134 N -0.62 0.00 -0.39 1.57 7.01 0.16 -1.65 115.95 122.03 1tvi h TRP 134 Ca -0.02 0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.10 1tvi h TRP 134 Cb 0.47 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.52 1tvi h TRP 134 CO 0.06 0.00 0.43 0.78 -2.79 0.00 0.00 178.44 176.92 1tvi h GLY 135 N 0.43 0.00 0.00 2.65 0.00 -1.04 2.09 103.07 107.21 1tvi h GLY 135 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1tvi h GLY 135 CO 0.00 0.00 -0.68 -2.09 0.00 0.00 0.00 176.54 173.77 1tvi h GLU 136 N 0.00 0.00 0.00 4.80 4.81 -1.44 -3.33 114.58 119.42 1tvi h GLU 136 Ca 0.19 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1tvi h GLU 136 Cb 1.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1tvi h GLU 136 CO -0.00 0.74 0.00 -1.49 -0.73 0.00 0.00 179.01 177.53 1tvi h TRP 137 N -1.00 0.00 -1.00 0.92 6.55 -1.45 -2.60 115.95 117.38 1tvi h TRP 137 Ca -0.17 0.00 0.26 0.00 0.95 0.00 0.00 58.89 59.93 1tvi h TRP 137 Cb 0.97 0.00 -0.13 0.00 -0.86 0.00 0.00 29.16 29.14 1tvi h TRP 137 CO 0.08 0.00 0.58 -0.09 -1.05 0.00 0.00 178.44 177.97 1tvi h ARG 138 N 0.00 0.52 0.00 0.49 2.43 0.33 1.57 114.38 119.72 1tvi h ARG 138 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1tvi h ARG 138 Cb 0.29 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1tvi h ARG 138 CO 0.00 0.35 0.19 0.77 -1.51 0.00 0.00 179.97 179.77 1tvi h SER 139 N 0.54 0.00 -4.27 -3.80 0.02 -1.66 -3.20 113.55 101.18 1tvi h SER 139 Ca 0.65 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.93 1tvi h SER 139 Cb 1.28 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 63.44 1tvi h SER 139 CO -0.50 0.00 -0.48 0.20 -1.14 0.00 0.00 176.83 174.91 1tvi s ASN 140 N -4.33 4.81 0.71 3.07 0.01 0.54 -4.98 114.94 114.77 1tvi s ASN 140 Ca -0.03 -2.95 0.00 0.00 -0.71 0.00 0.00 52.86 49.17 1tvi s ASN 140 Cb 0.08 -1.76 0.00 0.00 0.41 0.00 0.00 41.25 39.99 1tvi s ASN 140 CO 0.26 -0.30 0.00 -0.81 -1.51 0.00 0.00 177.10 174.74 1tvi n PRO 141 N 3.28 -0.07 -0.67 -0.60 -0.04 -1.21 -4.80 135.00 130.89 1tvi n PRO 141 Ca 0.07 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.33 1tvi n PRO 141 Cb 0.35 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.79 1tvi n PRO 141 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1tvi n SER 142 N -2.13 4.50 -0.90 3.54 7.64 -1.26 -4.22 113.62 120.80 1tvi n SER 142 Ca 0.00 -2.29 -0.11 0.00 1.01 0.00 0.00 58.87 57.48 1tvi n SER 142 Cb 0.00 -1.04 -0.05 0.00 -1.01 0.00 0.00 64.21 62.11 1tvi n SER 142 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1tvi n GLU 143 N 4.22 -1.67 -3.63 1.43 4.71 -1.26 -4.88 120.64 119.56 1tvi n GLU 143 Ca 0.40 0.85 -0.29 0.00 -0.01 0.00 0.00 57.16 58.12 1tvi n GLU 143 Cb 0.13 -5.20 -0.12 0.00 -1.01 0.00 0.00 31.44 25.24 1tvi n GLU 143 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1tvi s ASP 144 N -2.30 3.29 -1.06 1.62 2.15 -1.26 -5.04 116.67 114.07 1tvi s ASP 144 Ca 0.00 -2.69 -0.11 0.00 0.43 0.00 0.00 52.55 50.18 1tvi s ASP 144 Cb 0.00 -0.87 0.25 0.00 -0.30 0.00 0.00 42.92 42.00 1tvi s ASP 144 CO 0.00 -0.25 1.09 -0.94 -0.17 0.00 0.00 175.17 174.90 1tvi s SER 145 N 0.32 7.16 0.00 -0.34 1.04 -1.26 -4.70 113.70 115.92 1tvi s SER 145 Ca 0.20 -3.28 0.00 0.00 0.48 0.00 0.00 55.95 53.35 1tvi s SER 145 Cb -0.19 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 63.69 1tvi s SER 145 CO -0.04 -0.44 0.00 -0.67 0.98 0.00 0.00 173.24 173.08 1tvi n ASP 146 N 3.51 0.00 -0.04 7.02 -0.08 -1.26 -5.06 116.55 120.64 1tvi n ASP 146 Ca 0.24 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.38 1tvi n ASP 146 Cb 0.42 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.76 1tvi n ASP 146 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1tvi h PRO 147 N 0.00 0.05 0.00 -0.67 0.13 -2.00 -3.47 132.00 126.05 1tvi h PRO 147 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1tvi h PRO 147 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1tvi h PRO 147 CO 0.00 0.79 0.00 0.41 -0.23 0.00 0.00 178.00 178.97 1tvi n GLY 148 N 0.94 -1.03 1.03 1.56 0.00 -1.26 -5.15 105.19 101.27 1tvi n GLY 148 Ca -0.09 0.92 0.14 0.00 0.00 0.00 0.00 46.02 46.98 1tvi n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tvi n LYS 149 N 0.00 -2.11 -0.33 1.61 4.76 -1.26 -5.32 118.16 115.51 1tvi n LYS 149 Ca 0.00 1.44 0.00 0.00 -2.87 0.00 0.00 58.31 56.88 1tvi n LYS 149 Cb 0.00 -2.55 0.00 0.00 -1.84 0.00 0.00 35.03 30.64 1tvi n LYS 149 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57