#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nvv s THR 2 N 0.00 5.41 -0.08 3.17 2.01 -1.15 -4.89 115.64 120.11 1nvv s THR 2 Ca 0.00 0.22 -0.05 0.00 0.31 0.00 0.00 61.69 62.17 1nvv s THR 2 Cb 0.00 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.99 1nvv s THR 2 CO 0.00 0.53 0.14 -0.70 -0.69 0.00 0.00 174.62 173.90 1nvv s GLU 3 N -1.30 3.39 -0.05 4.92 2.12 -1.26 -0.63 118.70 125.90 1nvv s GLU 3 Ca 0.20 -0.23 0.01 0.00 0.36 0.00 0.00 54.97 55.31 1nvv s GLU 3 Cb -0.13 -3.12 0.02 0.00 0.26 0.00 0.00 34.13 31.16 1nvv s GLU 3 CO 0.09 0.73 -0.04 0.71 -0.54 0.00 0.00 175.26 176.21 1nvv s TYR 4 N -1.13 0.82 -0.47 5.30 2.02 -0.39 -4.94 117.35 118.56 1nvv s TYR 4 Ca 0.19 -0.25 -0.15 0.00 -0.37 0.00 0.00 57.07 56.49 1nvv s TYR 4 Cb -0.12 -0.75 0.08 0.00 -0.40 0.00 0.00 41.96 40.77 1nvv s TYR 4 CO 0.09 -0.24 0.39 0.15 -1.57 0.00 0.00 175.55 174.37 1nvv s LYS 5 N 1.12 2.95 -0.01 -0.62 1.02 -1.26 -0.36 119.74 122.58 1nvv s LYS 5 Ca -0.08 -1.38 -0.02 0.00 0.02 0.00 0.00 55.97 54.51 1nvv s LYS 5 Cb -0.14 -4.11 -0.04 0.00 -0.52 0.00 0.00 37.83 33.02 1nvv s LYS 5 CO -0.01 -1.04 0.16 -0.51 -0.92 0.00 0.00 175.35 173.02 1nvv s LEU 6 N 1.62 4.25 -0.07 3.17 1.43 0.62 -0.93 118.68 128.77 1nvv s LEU 6 Ca 0.04 0.30 0.02 0.00 -1.03 0.00 0.00 54.13 53.46 1nvv s LEU 6 Cb -0.25 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.48 1nvv s LEU 6 CO 0.06 0.27 -0.11 -0.69 0.23 0.00 0.00 176.35 176.11 1nvv s VAL 7 N -1.29 1.08 -0.31 -1.59 1.01 -0.50 -0.60 120.40 118.21 1nvv s VAL 7 Ca 0.26 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.71 1nvv s VAL 7 Cb -0.12 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 1nvv s VAL 7 CO 0.17 0.35 0.15 -0.69 0.00 0.00 0.00 175.10 175.08 1nvv s VAL 8 N 0.82 4.58 0.29 2.92 1.01 -0.19 -0.62 120.40 129.21 1nvv s VAL 8 Ca -0.12 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 61.51 1nvv s VAL 8 Cb -0.15 -3.33 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 1nvv s VAL 8 CO 0.02 0.07 -0.08 0.68 0.00 0.00 0.00 175.10 175.78 1nvv s VAL 9 N 1.61 1.84 0.00 2.92 -7.23 -0.39 -2.68 120.40 116.48 1nvv s VAL 9 Ca 0.05 -2.17 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 1nvv s VAL 9 Cb -0.17 -2.45 0.00 0.00 0.56 0.00 0.00 36.38 34.32 1nvv s VAL 9 CO 0.06 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.15 1nvv n GLY 10 N -0.61 2.91 3.64 2.32 0.00 -1.26 -0.70 105.19 111.49 1nvv n GLY 10 Ca -0.06 -1.42 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 1nvv n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nvv n ALA 11 N -1.57 -0.63 -1.79 4.61 0.00 -1.25 -4.20 120.51 115.68 1nvv n ALA 11 Ca 0.00 -0.43 -0.41 0.00 0.00 0.00 0.00 53.44 52.61 1nvv n ALA 11 Cb 0.00 -2.16 -0.01 0.00 0.00 0.00 0.00 19.45 17.27 1nvv n ALA 11 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nvv s GLY 12 N -2.23 2.81 0.00 0.00 0.00 -1.23 -3.19 107.32 103.48 1nvv s GLY 12 Ca 0.69 1.40 0.00 0.00 0.00 0.00 0.00 44.72 46.81 1nvv s GLY 12 CO 0.55 2.13 0.00 0.61 0.00 0.00 0.00 173.10 176.39 1nvv n GLY 13 N 1.01 1.05 0.24 0.20 0.00 -1.26 -4.91 105.19 101.52 1nvv n GLY 13 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 1nvv n GLY 13 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1nvv h VAL 14 N 0.00 0.32 0.00 1.61 -1.51 -1.92 -3.47 116.25 111.29 1nvv h VAL 14 Ca 0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 1nvv h VAL 14 Cb 0.00 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 30.86 1nvv h VAL 14 CO 0.00 0.13 0.00 0.61 -1.23 0.00 0.00 177.57 177.08 1nvv n GLY 15 N 0.20 1.99 0.16 5.19 0.00 -1.26 -4.60 105.19 106.87 1nvv n GLY 15 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1nvv n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nvv h LYS 16 N 0.00 0.48 -0.46 1.61 1.57 -1.90 -1.50 116.57 116.36 1nvv h LYS 16 Ca 0.00 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 1nvv h LYS 16 Cb 0.00 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1nvv h LYS 16 CO 0.00 0.35 -0.22 0.77 -0.57 0.00 0.00 179.45 179.79 1nvv h SER 17 N 0.47 0.99 -0.56 0.86 0.02 -1.96 -2.47 113.55 110.91 1nvv h SER 17 Ca 0.13 -0.40 -0.06 0.00 -0.84 0.00 0.00 61.79 60.62 1nvv h SER 17 Cb -0.01 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 1nvv h SER 17 CO -0.03 1.17 0.13 0.00 -1.14 0.00 0.00 176.83 176.97 1nvv h ALA 18 N 0.85 0.73 -0.20 3.77 0.00 -1.87 0.09 119.26 122.64 1nvv h ALA 18 Ca 0.10 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1nvv h ALA 18 Cb 0.79 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1nvv h ALA 18 CO 0.07 0.44 0.11 -0.07 0.00 0.00 0.00 179.25 179.80 1nvv h LEU 19 N 0.80 0.24 -0.25 0.00 3.38 -1.27 -0.86 115.31 117.35 1nvv h LEU 19 Ca 0.17 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1nvv h LEU 19 Cb 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1nvv h LEU 19 CO 0.00 0.25 0.16 0.74 0.09 0.00 0.00 178.44 179.69 1nvv h THR 20 N 0.22 1.05 -0.00 0.22 2.02 -1.19 -1.65 112.91 113.57 1nvv h THR 20 Ca 0.07 -0.11 -0.12 0.00 0.77 0.00 0.00 66.41 67.02 1nvv h THR 20 Cb 0.06 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1nvv h THR 20 CO -0.01 0.06 -0.55 0.40 0.37 0.00 0.00 175.52 175.79 1nvv h ILE 21 N 0.33 1.39 -0.41 3.11 2.04 -0.90 -0.93 117.51 122.15 1nvv h ILE 21 Ca 0.09 -1.88 -0.11 0.00 1.00 0.00 0.00 64.86 63.96 1nvv h ILE 21 Cb -0.03 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 1nvv h ILE 21 CO -0.03 0.54 -0.21 -0.61 0.00 0.00 0.00 178.15 177.84 1nvv h GLN 22 N 0.00 0.80 -0.19 2.37 5.75 -0.93 0.14 115.11 123.05 1nvv h GLN 22 Ca -0.01 -0.32 -0.21 0.00 -0.15 0.00 0.00 58.65 57.97 1nvv h GLN 22 Cb 0.97 -0.04 0.01 0.00 1.07 0.00 0.00 27.48 29.49 1nvv h GLN 22 CO 0.07 0.94 -0.69 1.25 -2.65 0.00 0.00 178.83 177.75 1nvv h LEU 23 N 0.70 0.94 0.13 -2.39 5.85 -0.96 -0.82 115.31 118.76 1nvv h LEU 23 Ca 0.10 -0.60 -0.23 0.00 0.84 0.00 0.00 57.88 57.98 1nvv h LEU 23 Cb 0.72 -0.28 0.02 0.00 0.37 0.00 0.00 40.66 41.50 1nvv h LEU 23 CO 0.06 1.38 -0.99 0.40 -0.34 0.00 0.00 178.44 178.95 1nvv h ILE 24 N 0.56 1.40 -0.00 4.05 1.08 -1.07 -3.40 117.51 120.13 1nvv h ILE 24 Ca -0.03 -2.45 0.00 0.00 -0.39 0.00 0.00 64.86 61.99 1nvv h ILE 24 Cb 1.32 2.92 0.00 0.00 -3.07 0.00 0.00 36.82 37.99 1nvv h ILE 24 CO 0.15 0.72 -0.04 0.00 -0.69 0.00 0.00 178.15 178.28 1nvv n GLN 25 N -3.99 1.53 -2.63 2.37 6.02 0.48 -4.99 117.38 116.17 1nvv n GLN 25 Ca -0.14 -0.47 -0.19 0.00 -0.01 0.00 0.00 57.00 56.19 1nvv n GLN 25 Cb 0.88 -0.93 0.01 0.00 1.02 0.00 0.00 30.24 31.23 1nvv n GLN 25 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1nvv n ASN 26 N -0.21 -5.49 -4.16 1.08 4.13 -0.31 -4.99 115.26 105.31 1nvv n ASN 26 Ca 0.01 -0.13 -0.25 0.00 1.68 0.00 0.00 54.58 55.89 1nvv n ASN 26 Cb 0.07 -4.44 -0.16 0.00 -1.54 0.00 0.00 39.78 33.72 1nvv n ASN 26 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 1nvv s HIS 27 N -3.01 1.61 -0.28 3.10 2.46 -1.24 -4.99 115.29 112.93 1nvv s HIS 27 Ca 0.13 -0.35 -0.11 0.00 0.47 0.00 0.00 55.06 55.20 1nvv s HIS 27 Cb -0.06 -1.05 -0.05 0.00 -0.13 0.00 0.00 32.58 31.29 1nvv s HIS 27 CO 0.16 -0.07 0.20 0.12 -2.47 0.00 0.00 174.74 172.69 1nvv s PHE 28 N -0.28 3.22 -0.36 3.88 5.36 -1.26 -3.01 117.98 125.53 1nvv s PHE 28 Ca 0.04 0.14 -0.26 0.00 -0.96 0.00 0.00 56.93 55.89 1nvv s PHE 28 Cb -0.08 -2.39 0.01 0.00 -0.34 0.00 0.00 43.02 40.22 1nvv s PHE 28 CO 0.00 -0.16 0.91 0.08 -1.46 0.00 0.00 175.22 174.59 1nvv s VAL 29 N 1.78 4.61 -0.22 3.12 1.01 -1.26 -4.92 120.40 124.52 1nvv s VAL 29 Ca 0.08 1.21 0.20 0.00 0.00 0.00 0.00 61.98 63.46 1nvv s VAL 29 Cb -0.16 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 31.92 1nvv s VAL 29 CO 0.11 -0.50 1.09 -0.78 0.00 0.00 0.00 175.10 175.03 1nvv h ASP 30 N 8.41 0.00 -4.18 3.32 3.58 -2.02 -3.47 116.42 122.07 1nvv h ASP 30 Ca -0.23 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.73 1nvv h ASP 30 Cb 1.08 0.00 0.06 0.00 1.72 0.00 0.00 39.33 42.19 1nvv h ASP 30 CO 0.97 0.25 0.38 -1.61 -2.88 0.00 0.00 179.24 176.35 1nvv s GLU 31 N -3.15 3.34 -0.57 0.28 0.41 -1.26 -5.02 118.70 112.72 1nvv s GLU 31 Ca 0.00 1.24 0.01 0.00 -0.41 0.00 0.00 54.97 55.81 1nvv s GLU 31 Cb 0.08 -2.03 0.14 0.00 -1.78 0.00 0.00 34.13 30.55 1nvv s GLU 31 CO 0.78 -0.80 0.35 -0.47 -0.49 0.00 0.00 175.26 174.62 1nvv s TYR 32 N -2.38 3.31 -0.35 1.61 6.14 -1.26 -5.04 117.35 119.38 1nvv s TYR 32 Ca 0.64 -2.94 -0.05 0.00 0.64 0.00 0.00 57.07 55.36 1nvv s TYR 32 Cb -0.17 -3.01 0.06 0.00 0.42 0.00 0.00 41.96 39.26 1nvv s TYR 32 CO 0.35 -0.80 0.11 -0.51 0.64 0.00 0.00 175.55 175.35 1nvv s ASP 33 N 0.22 5.24 0.14 4.32 1.01 -1.26 -5.07 116.67 121.27 1nvv s ASP 33 Ca 0.17 -1.35 -0.34 0.00 0.71 0.00 0.00 52.55 51.74 1nvv s ASP 33 Cb -0.23 -1.84 -0.15 0.00 1.01 0.00 0.00 42.92 41.71 1nvv s ASP 33 CO -0.02 -0.37 1.42 -2.65 0.21 0.00 0.00 175.17 173.76 1nvv n PRO 34 N 4.74 1.64 -2.92 8.23 -0.02 -1.26 -4.95 135.00 140.46 1nvv n PRO 34 Ca -0.11 0.59 -0.33 0.00 -2.02 0.00 0.00 63.50 61.63 1nvv n PRO 34 Cb 0.44 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.59 1nvv n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1nvv s THR 35 N 0.49 4.47 -0.05 3.45 2.01 -1.26 -4.99 115.64 119.76 1nvv s THR 35 Ca 0.79 1.34 -0.09 0.00 0.31 0.00 0.00 61.69 64.04 1nvv s THR 35 Cb -0.80 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 1nvv s THR 35 CO 0.44 -0.23 -0.18 -0.38 -0.69 0.00 0.00 174.62 173.59 1nvv n ILE 36 N -0.43 1.30 -3.52 1.82 5.41 -1.26 -4.32 119.36 118.36 1nvv n ILE 36 Ca 0.05 0.26 -0.00 0.00 1.00 0.00 0.00 62.75 64.06 1nvv n ILE 36 Cb 0.53 -1.96 -0.05 0.00 -0.71 0.00 0.00 39.64 37.46 1nvv n ILE 36 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1nvv s GLU 37 N -2.40 0.41 -0.00 0.38 -1.05 -1.26 -3.67 118.70 111.10 1nvv s GLU 37 Ca -0.15 0.93 -0.02 0.00 -0.15 0.00 0.00 54.97 55.59 1nvv s GLU 37 Cb 0.02 0.47 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 1nvv s GLU 37 CO 0.22 -0.13 0.04 -0.51 0.95 0.00 0.00 175.26 175.83 1nvv s ASP 38 N 2.32 0.07 0.01 0.83 1.01 -0.81 -5.02 116.67 115.09 1nvv s ASP 38 Ca -0.05 -0.18 0.06 0.00 0.71 0.00 0.00 52.55 53.09 1nvv s ASP 38 Cb -0.07 0.12 -0.02 0.00 1.01 0.00 0.00 42.92 43.96 1nvv s ASP 38 CO -0.18 -0.19 -0.18 -0.55 0.21 0.00 0.00 175.17 174.28 1nvv s SER 39 N -0.80 2.18 0.10 0.27 0.15 -1.26 0.51 113.70 114.85 1nvv s SER 39 Ca -0.09 -0.41 0.04 0.00 0.70 0.00 0.00 55.95 56.19 1nvv s SER 39 Cb -0.05 -0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 64.01 1nvv s SER 39 CO -0.00 0.18 -0.11 -0.31 1.20 0.00 0.00 173.24 174.20 1nvv s TYR 40 N -0.60 1.10 -0.02 3.44 1.51 0.19 -4.97 117.35 118.01 1nvv s TYR 40 Ca 0.06 -0.63 0.07 0.00 -1.01 0.00 0.00 57.07 55.56 1nvv s TYR 40 Cb -0.08 -0.60 -0.02 0.00 -0.11 0.00 0.00 41.96 41.16 1nvv s TYR 40 CO 0.00 0.02 -0.22 0.50 -1.11 0.00 0.00 175.55 174.74 1nvv s ARG 41 N -2.69 1.77 -0.17 -0.62 6.06 -1.26 -0.78 118.95 121.26 1nvv s ARG 41 Ca 0.05 -0.78 -0.06 0.00 -2.50 0.00 0.00 55.73 52.44 1nvv s ARG 41 Cb -0.04 -1.71 0.08 0.00 0.06 0.00 0.00 34.95 33.34 1nvv s ARG 41 CO 0.01 0.47 0.35 0.21 -2.50 0.00 0.00 175.30 173.84 1nvv s LYS 42 N -0.52 0.25 -0.16 5.12 2.20 -0.45 -4.98 119.74 121.19 1nvv s LYS 42 Ca 0.08 0.90 -0.20 0.00 -0.36 0.00 0.00 55.97 56.39 1nvv s LYS 42 Cb -0.08 0.14 -0.03 0.00 -1.51 0.00 0.00 37.83 36.35 1nvv s LYS 42 CO -0.01 -0.28 0.56 -1.14 -0.36 0.00 0.00 175.35 174.12 1nvv s GLN 43 N 2.53 4.26 -0.03 4.03 0.74 -1.26 -0.27 119.66 129.66 1nvv s GLN 43 Ca 0.00 0.53 -0.21 0.00 0.05 0.00 0.00 55.36 55.73 1nvv s GLN 43 Cb -0.12 -3.52 0.04 0.00 1.10 0.00 0.00 33.01 30.51 1nvv s GLN 43 CO -0.11 -0.07 0.45 0.54 -0.55 0.00 0.00 175.29 175.55 1nvv s VAL 44 N 1.35 0.04 -0.24 1.34 0.11 -0.39 -5.00 120.40 117.60 1nvv s VAL 44 Ca 0.27 -0.29 -0.14 0.00 -2.93 0.00 0.00 61.98 58.89 1nvv s VAL 44 Cb -0.16 -0.76 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 1nvv s VAL 44 CO 0.11 -0.16 0.34 -0.69 -3.33 0.00 0.00 175.10 171.37 1nvv s VAL 45 N -1.27 5.21 -0.14 2.04 1.01 -1.26 -1.35 120.40 124.65 1nvv s VAL 45 Ca -0.13 0.54 0.01 0.00 0.00 0.00 0.00 61.98 62.40 1nvv s VAL 45 Cb -0.03 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.69 1nvv s VAL 45 CO 0.06 0.22 -0.14 -0.63 0.00 0.00 0.00 175.10 174.61 1nvv s ILE 46 N 1.68 1.55 -1.31 2.22 1.01 0.22 -4.73 121.20 121.83 1nvv s ILE 46 Ca 0.15 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 1nvv s ILE 46 Cb -0.15 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 40.88 1nvv s ILE 46 CO 0.09 0.45 0.73 0.47 0.00 0.00 0.00 174.94 176.68 1nvv n ASP 47 N 4.62 -1.39 0.00 3.58 8.00 -1.26 -1.51 116.55 128.60 1nvv n ASP 47 Ca -0.17 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.52 1nvv n ASP 47 Cb 0.50 -4.12 0.00 0.00 -0.02 0.00 0.00 41.12 37.48 1nvv n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nvv n GLY 48 N -1.55 0.73 3.49 0.44 0.00 -1.26 -4.99 105.19 102.05 1nvv n GLY 48 Ca -0.28 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1nvv n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nvv s GLU 49 N -0.38 3.46 0.10 1.61 0.41 -0.57 -5.08 118.70 118.24 1nvv s GLU 49 Ca 0.00 -0.56 -0.30 0.00 -0.41 0.00 0.00 54.97 53.71 1nvv s GLU 49 Cb 0.00 -2.80 -0.05 0.00 -1.78 0.00 0.00 34.13 29.49 1nvv s GLU 49 CO 0.00 0.31 0.96 0.99 -0.49 0.00 0.00 175.26 177.03 1nvv s THR 50 N 0.15 4.55 0.09 3.63 2.01 -1.26 -0.61 115.64 124.20 1nvv s THR 50 Ca -0.03 2.05 -0.10 0.00 0.31 0.00 0.00 61.69 63.93 1nvv s THR 50 Cb -0.14 -4.32 0.00 0.00 0.01 0.00 0.00 72.50 68.06 1nvv s THR 50 CO 0.03 0.30 0.22 0.00 -0.69 0.00 0.00 174.62 174.48 1nvv s LEU 52 N -2.76 3.53 -0.17 0.00 2.96 0.20 -1.26 118.68 121.19 1nvv s LEU 52 Ca 0.03 -0.80 -0.18 0.00 -0.22 0.00 0.00 54.13 52.96 1nvv s LEU 52 Cb 0.04 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.92 1nvv s LEU 52 CO -0.10 -0.16 0.49 -0.76 -1.32 0.00 0.00 176.35 174.50 1nvv s LEU 53 N 1.41 4.19 -0.30 -0.68 1.02 0.62 -1.26 118.68 123.67 1nvv s LEU 53 Ca 0.01 0.71 -0.07 0.00 0.02 0.00 0.00 54.13 54.79 1nvv s LEU 53 Cb -0.17 -2.69 0.01 0.00 0.02 0.00 0.00 46.19 43.36 1nvv s LEU 53 CO -0.01 -0.11 0.10 -1.81 0.02 0.00 0.00 176.35 174.54 1nvv s ASP 54 N 0.97 5.24 -0.23 2.29 1.01 0.52 -1.34 116.67 125.13 1nvv s ASP 54 Ca 0.24 -0.71 -0.03 0.00 0.71 0.00 0.00 52.55 52.76 1nvv s ASP 54 Cb -0.15 -1.91 -0.00 0.00 1.01 0.00 0.00 42.92 41.87 1nvv s ASP 54 CO 0.10 -0.21 -0.05 -0.63 0.21 0.00 0.00 175.17 174.59 1nvv s ILE 55 N 1.52 3.24 -0.31 0.77 1.01 0.04 -0.28 121.20 127.20 1nvv s ILE 55 Ca 0.03 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.94 1nvv s ILE 55 Cb -0.17 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 1nvv s ILE 55 CO 0.03 0.38 0.26 -0.22 0.00 0.00 0.00 174.94 175.39 1nvv s LEU 56 N 1.45 4.23 -0.34 2.97 2.96 0.23 -0.63 118.68 129.55 1nvv s LEU 56 Ca 0.05 -0.12 -0.16 0.00 -0.22 0.00 0.00 54.13 53.67 1nvv s LEU 56 Cb -0.15 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.33 1nvv s LEU 56 CO -0.04 -0.17 0.43 -0.62 -1.32 0.00 0.00 176.35 174.64 1nvv s ASP 57 N 1.73 6.25 0.45 3.68 2.15 0.18 -1.02 116.67 130.10 1nvv s ASP 57 Ca 0.09 -0.07 0.05 0.00 0.43 0.00 0.00 52.55 53.05 1nvv s ASP 57 Cb -0.16 -2.23 0.01 0.00 -0.30 0.00 0.00 42.92 40.24 1nvv s ASP 57 CO 0.11 -0.38 0.62 0.42 -0.17 0.00 0.00 175.17 175.77 1nvv s THR 58 N 2.19 3.12 -0.05 1.71 -4.23 -1.09 -1.92 115.64 115.37 1nvv s THR 58 Ca 0.15 -0.86 -0.24 0.00 -1.18 0.00 0.00 61.69 59.56 1nvv s THR 58 Cb -0.16 -3.09 -0.04 0.00 1.34 0.00 0.00 72.50 70.55 1nvv s THR 58 CO 0.12 -0.05 0.72 0.00 -0.54 0.00 0.00 174.62 174.88 1nvv s ALA 59 N -2.46 3.33 -0.04 3.99 0.00 -1.24 -4.80 121.76 120.54 1nvv s ALA 59 Ca 0.54 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.69 1nvv s ALA 59 Cb -0.10 -2.97 -0.25 0.00 0.00 0.00 0.00 23.12 19.79 1nvv s ALA 59 CO 0.35 -0.08 0.69 0.78 0.00 0.00 0.00 175.76 177.50 1nvv h GLY 60 N 6.59 0.17 -5.45 0.00 0.00 -1.81 -3.47 103.07 99.11 1nvv h GLY 60 Ca -0.42 -0.44 -0.63 0.00 0.00 0.00 0.00 47.33 45.85 1nvv h GLY 60 CO 0.75 0.38 0.80 -1.06 0.00 0.00 0.00 176.54 177.41 1nvv n GLN 61 N -3.31 1.79 0.10 4.80 1.13 -1.26 -3.57 117.38 117.06 1nvv n GLN 61 Ca -0.19 0.65 0.07 0.00 -1.94 0.00 0.00 57.00 55.58 1nvv n GLN 61 Cb 1.04 -2.40 0.36 0.00 0.11 0.00 0.00 30.24 29.35 1nvv n GLN 61 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1nvv n GLU 62 N 4.23 0.09 0.00 -1.09 -0.58 -1.26 -2.73 120.64 119.29 1nvv n GLU 62 Ca 0.20 0.57 0.00 0.00 -0.42 0.00 0.00 57.16 57.51 1nvv n GLU 62 Cb 0.25 -1.77 0.00 0.00 -0.57 0.00 0.00 31.44 29.34 1nvv n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1nvv n GLU 63 N -1.95 0.72 -0.71 3.49 1.02 -1.26 -2.15 120.64 119.81 1nvv n GLU 63 Ca -0.01 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.12 1nvv n GLU 63 Cb 0.03 -1.26 -0.01 0.00 -0.02 0.00 0.00 31.44 30.18 1nvv n GLU 63 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nvv n ALA 64 N 0.37 2.38 0.30 0.62 0.00 -1.11 -4.92 120.51 118.15 1nvv n ALA 64 Ca 0.00 -0.65 0.19 0.00 0.00 0.00 0.00 53.44 52.98 1nvv n ALA 64 Cb 0.26 -0.27 0.91 0.00 0.00 0.00 0.00 19.45 20.34 1nvv n ALA 64 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1nvv h SER 65 N 0.11 0.00 -0.01 0.00 0.02 -1.65 -2.74 113.55 109.28 1nvv h SER 65 Ca -0.13 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.66 1nvv h SER 65 Cb 1.28 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 1nvv h SER 65 CO -0.04 0.00 -0.51 0.00 -1.14 0.00 0.00 176.83 175.13 1nvv h ALA 66 N 2.02 0.72 0.00 3.77 0.00 -1.91 -3.15 119.26 120.71 1nvv h ALA 66 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1nvv h ALA 66 Cb 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1nvv h ALA 66 CO 0.00 0.68 0.00 0.52 0.00 0.00 0.00 179.25 180.45 1nvv h MET 67 N 0.46 0.00 -0.21 0.00 2.86 -1.90 -3.39 114.93 112.75 1nvv h MET 67 Ca 0.02 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1nvv h MET 67 Cb 1.05 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.67 1nvv h MET 67 CO 0.10 0.00 -0.25 0.00 1.06 0.00 0.00 176.91 177.82 1nvv h ARG 68 N 0.00 -0.15 -1.64 1.72 3.08 -1.61 -0.62 114.38 115.15 1nvv h ARG 68 Ca 0.00 0.01 0.48 0.00 0.07 0.00 0.00 59.98 60.54 1nvv h ARG 68 Cb 0.78 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.79 1nvv h ARG 68 CO 0.00 -0.10 1.17 -0.44 -1.07 0.00 0.00 179.97 179.53 1nvv h ASP 69 N -0.16 0.03 0.14 7.04 5.19 -1.79 0.12 116.42 126.99 1nvv h ASP 69 Ca 0.04 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 1nvv h ASP 69 Cb 0.26 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 39.77 1nvv h ASP 69 CO -0.28 -0.02 -0.13 1.56 -3.12 0.00 0.00 179.24 177.26 1nvv h GLN 70 N 0.01 0.00 0.00 3.56 4.20 -1.37 -3.04 115.11 118.48 1nvv h GLN 70 Ca 0.80 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.51 1nvv h GLN 70 Cb 3.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.91 1nvv h GLN 70 CO -0.05 0.13 -1.44 2.48 -0.67 0.00 0.00 178.83 179.28 1nvv n TYR 71 N -4.33 0.00 0.17 2.96 0.18 0.41 -4.37 117.16 112.18 1nvv n TYR 71 Ca -0.03 0.00 0.05 0.00 1.88 0.00 0.00 57.90 59.81 1nvv n TYR 71 Cb 0.20 -0.25 0.15 0.00 -0.38 0.00 0.00 39.34 39.06 1nvv n TYR 71 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 1nvv h MET 72 N 0.00 0.00 -0.02 -3.48 2.86 -1.41 -2.90 114.93 109.98 1nvv h MET 72 Ca 0.00 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 1nvv h MET 72 Cb 0.68 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1nvv h MET 72 CO 0.00 0.39 -0.69 0.00 1.06 0.00 0.00 176.91 177.67 1nvv h ARG 73 N 0.00 0.11 0.00 1.72 3.08 -1.74 -3.26 114.38 114.28 1nvv h ARG 73 Ca -0.00 -0.09 -0.20 0.00 0.07 0.00 0.00 59.98 59.76 1nvv h ARG 73 Cb 1.19 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 1nvv h ARG 73 CO 0.05 0.75 -1.25 1.79 -1.07 0.00 0.00 179.97 180.25 1nvv h THR 74 N 0.07 0.93 -4.01 2.04 1.35 -1.79 -3.48 112.91 108.02 1nvv h THR 74 Ca -0.01 -2.55 -0.53 0.00 -0.55 0.00 0.00 66.41 62.77 1nvv h THR 74 Cb 1.23 2.39 0.10 0.00 -1.73 0.00 0.00 68.15 70.14 1nvv h THR 74 CO 0.10 0.53 0.58 -0.83 -0.25 0.00 0.00 175.52 175.64 1nvv s GLY 75 N -4.81 2.86 -0.06 5.82 0.00 -1.10 -4.92 107.32 105.11 1nvv s GLY 75 Ca -0.01 1.20 0.14 0.00 0.00 0.00 0.00 44.72 46.04 1nvv s GLY 75 CO 0.81 1.71 0.23 1.18 0.00 0.00 0.00 173.10 177.03 1nvv n GLU 76 N -0.58 0.91 -3.85 2.90 1.02 -0.11 -5.01 120.64 115.93 1nvv n GLU 76 Ca 0.08 -0.09 -0.11 0.00 -0.02 0.00 0.00 57.16 57.01 1nvv n GLU 76 Cb 0.45 -1.36 -0.09 0.00 -0.02 0.00 0.00 31.44 30.42 1nvv n GLU 76 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1nvv s GLY 77 N -4.11 0.02 -0.03 0.62 0.00 -1.04 -4.26 107.32 98.53 1nvv s GLY 77 Ca -0.06 -0.11 0.03 0.00 0.00 0.00 0.00 44.72 44.58 1nvv s GLY 77 CO 0.61 -0.27 -0.11 -1.36 0.00 0.00 0.00 173.10 171.97 1nvv s PHE 78 N -1.67 1.19 -0.37 1.90 0.40 -0.32 -1.41 117.98 117.70 1nvv s PHE 78 Ca -0.12 -0.31 -0.12 0.00 -0.60 0.00 0.00 56.93 55.77 1nvv s PHE 78 Cb -0.06 -0.83 0.01 0.00 0.51 0.00 0.00 43.02 42.66 1nvv s PHE 78 CO 0.01 -0.12 0.23 -1.17 0.70 0.00 0.00 175.22 174.87 1nvv s LEU 79 N 0.15 4.70 -0.48 -0.37 2.96 0.21 -1.61 118.68 124.25 1nvv s LEU 79 Ca -0.03 -0.80 -0.17 0.00 -0.22 0.00 0.00 54.13 52.91 1nvv s LEU 79 Cb -0.09 -2.08 0.07 0.00 0.50 0.00 0.00 46.19 44.58 1nvv s LEU 79 CO 0.01 -0.35 0.47 0.00 -1.32 0.00 0.00 176.35 175.16 1nvv s VAL 81 N 1.97 4.94 0.08 0.00 1.01 0.12 -1.13 120.40 127.38 1nvv s VAL 81 Ca 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.95 1nvv s VAL 81 Cb -0.23 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 1nvv s VAL 81 CO 0.08 0.55 0.04 0.72 0.00 0.00 0.00 175.10 176.50 1nvv s PHE 82 N -1.02 0.54 -0.13 5.22 -0.12 -0.58 -3.95 117.98 117.94 1nvv s PHE 82 Ca 0.16 -1.02 -0.07 0.00 -0.05 0.00 0.00 56.93 55.96 1nvv s PHE 82 Cb -0.12 -0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 41.89 1nvv s PHE 82 CO 0.06 -0.46 0.11 0.00 -0.05 0.00 0.00 175.22 174.89 1nvv s ALA 83 N -3.94 3.75 -1.59 1.99 0.00 -1.26 -0.49 121.76 120.20 1nvv s ALA 83 Ca 0.11 -0.68 0.16 0.00 0.00 0.00 0.00 51.96 51.56 1nvv s ALA 83 Cb 0.07 -1.91 0.87 0.00 0.00 0.00 0.00 23.12 22.15 1nvv s ALA 83 CO -0.07 0.55 1.45 0.44 0.00 0.00 0.00 175.76 178.13 1nvv n ILE 84 N 2.23 0.38 -1.12 0.00 -5.35 -0.61 -2.17 119.36 112.71 1nvv n ILE 84 Ca -0.19 0.10 0.07 0.00 -0.27 0.00 0.00 62.75 62.45 1nvv n ILE 84 Cb 0.54 -0.83 0.21 0.00 -1.74 0.00 0.00 39.64 37.82 1nvv n ILE 84 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1nvv n ASN 85 N -1.20 3.07 -3.45 7.28 6.94 -1.26 -0.15 115.26 126.48 1nvv n ASN 85 Ca 0.09 -3.21 -0.23 0.00 -0.02 0.00 0.00 54.58 51.21 1nvv n ASN 85 Cb 0.11 -0.52 -0.11 0.00 -2.36 0.00 0.00 39.78 36.89 1nvv n ASN 85 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1nvv s ASN 86 N -2.40 2.44 0.32 0.53 3.84 -0.92 -4.75 114.94 114.00 1nvv s ASN 86 Ca 0.39 -1.41 0.00 0.00 0.21 0.00 0.00 52.86 52.05 1nvv s ASN 86 Cb 0.33 0.05 0.54 0.00 -0.55 0.00 0.00 41.25 41.62 1nvv s ASN 86 CO 0.05 -0.36 1.99 0.74 -2.79 0.00 0.00 177.10 176.72 1nvv h THR 87 N 5.79 1.19 -0.45 -5.21 2.02 -1.87 -2.42 112.91 111.95 1nvv h THR 87 Ca -0.07 -0.34 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 1nvv h THR 87 Cb 1.03 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1nvv h THR 87 CO 0.32 0.18 0.05 0.11 0.37 0.00 0.00 175.52 176.55 1nvv h LYS 88 N 1.00 0.71 -0.36 6.66 1.57 -1.95 -1.07 116.57 123.12 1nvv h LYS 88 Ca 0.27 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.81 1nvv h LYS 88 Cb -0.11 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 1nvv h LYS 88 CO -0.06 0.69 -0.12 0.66 -0.57 0.00 0.00 179.45 180.05 1nvv h SER 89 N 0.68 0.62 -0.35 0.86 4.64 -1.78 -1.04 113.55 117.17 1nvv h SER 89 Ca 0.14 -0.17 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 1nvv h SER 89 Cb 0.35 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.26 1nvv h SER 89 CO 0.01 0.77 -0.19 0.15 -0.87 0.00 0.00 176.83 176.69 1nvv h PHE 90 N 0.58 0.93 0.00 4.77 3.57 -1.23 -2.41 116.94 123.14 1nvv h PHE 90 Ca 0.10 -0.20 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1nvv h PHE 90 Cb 0.54 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1nvv h PHE 90 CO 0.02 0.94 0.00 0.93 -2.23 0.00 0.00 178.31 177.98 1nvv h GLU 91 N 0.73 0.00 0.00 1.11 5.08 -0.65 -2.79 114.58 118.06 1nvv h GLU 91 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1nvv h GLU 91 Cb 0.71 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 1nvv h GLU 91 CO 0.05 0.00 -0.15 -0.44 -1.00 0.00 0.00 179.01 177.48 1nvv h ASP 92 N 0.00 0.00 -0.65 1.42 3.32 -0.69 -3.34 116.42 116.48 1nvv h ASP 92 Ca 0.00 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.19 1nvv h ASP 92 Cb 0.57 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.01 1nvv h ASP 92 CO 0.00 0.06 0.07 0.40 -1.72 0.00 0.00 179.24 178.04 1nvv h ILE 93 N 0.00 0.51 -0.88 0.35 1.08 -1.40 -1.60 117.51 115.58 1nvv h ILE 93 Ca -0.00 -0.06 0.19 0.00 -0.39 0.00 0.00 64.86 64.60 1nvv h ILE 93 Cb 1.04 0.32 -0.11 0.00 -3.07 0.00 0.00 36.82 35.01 1nvv h ILE 93 CO 0.01 0.03 0.42 0.45 -0.69 0.00 0.00 178.15 178.37 1nvv h HIS 94 N 0.18 0.72 -0.41 1.37 3.86 -1.77 -0.93 115.15 118.17 1nvv h HIS 94 Ca 0.35 0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.46 1nvv h HIS 94 Cb 0.57 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 1nvv h HIS 94 CO -0.32 0.05 -0.27 1.96 0.86 0.00 0.00 177.93 180.21 1nvv h GLN 95 N 0.50 0.86 -0.56 2.45 1.08 -1.53 -2.02 115.11 115.89 1nvv h GLN 95 Ca 0.52 -0.38 -0.11 0.00 -1.45 0.00 0.00 58.65 57.23 1nvv h GLN 95 Cb 0.90 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.29 1nvv h GLN 95 CO -0.46 1.03 -0.09 1.88 -0.95 0.00 0.00 178.83 180.24 1nvv h TYR 96 N 0.74 1.16 -0.60 2.96 0.05 -1.07 -1.52 116.97 118.69 1nvv h TYR 96 Ca 0.09 -0.23 -0.05 0.00 0.05 0.00 0.00 58.73 58.58 1nvv h TYR 96 Cb 0.82 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 38.24 1nvv h TYR 96 CO 0.05 1.06 0.16 -0.09 -1.05 0.00 0.00 178.16 178.29 1nvv h ARG 97 N 0.93 0.95 -0.38 4.88 1.12 -1.10 -1.84 114.38 118.93 1nvv h ARG 97 Ca 0.15 -0.22 -0.13 0.00 -1.11 0.00 0.00 59.98 58.67 1nvv h ARG 97 Cb 0.66 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.48 1nvv h ARG 97 CO 0.05 0.86 -0.30 1.49 -3.11 0.00 0.00 179.97 178.95 1nvv h GLU 98 N 0.86 0.83 -0.10 0.20 4.57 -1.22 -1.64 114.58 118.08 1nvv h GLU 98 Ca 0.19 -0.38 -0.01 0.00 -1.18 0.00 0.00 59.36 57.98 1nvv h GLU 98 Cb 0.33 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1nvv h GLU 98 CO -0.00 1.02 0.04 1.96 -1.18 0.00 0.00 179.01 180.84 1nvv h GLN 99 N 0.70 0.15 -0.56 1.92 4.20 -1.11 -0.99 115.11 119.41 1nvv h GLN 99 Ca 0.08 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.80 1nvv h GLN 99 Cb 0.85 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.56 1nvv h GLN 99 CO 0.07 0.27 0.31 0.82 -0.67 0.00 0.00 178.83 179.64 1nvv h ILE 100 N -0.01 1.00 -0.84 2.54 2.04 -1.29 0.33 117.51 121.28 1nvv h ILE 100 Ca 0.03 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1nvv h ILE 100 Cb 0.18 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 1nvv h ILE 100 CO -0.00 0.11 0.39 0.50 0.00 0.00 0.00 178.15 179.15 1nvv h LYS 101 N 0.61 1.21 0.50 2.37 3.64 -1.15 -2.28 116.57 121.47 1nvv h LYS 101 Ca 0.24 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1nvv h LYS 101 Cb 0.10 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1nvv h LYS 101 CO -0.14 0.94 -0.24 -0.09 -2.27 0.00 0.00 179.45 177.65 1nvv h ARG 102 N 1.20 -0.65 -0.08 1.90 2.43 -0.58 -0.75 114.38 117.85 1nvv h ARG 102 Ca 0.29 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.51 1nvv h ARG 102 Cb 0.13 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1nvv h ARG 102 CO -0.03 -0.43 -0.18 0.28 -1.51 0.00 0.00 179.97 178.09 1nvv h VAL 103 N -0.98 0.00 0.00 0.20 2.07 -0.98 0.10 116.25 116.66 1nvv h VAL 103 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1nvv h VAL 103 Cb 0.51 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1nvv h VAL 103 CO 0.11 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.99 1nvv n LYS 104 N -3.55 0.27 -3.86 1.57 5.02 -0.86 -4.87 118.16 111.88 1nvv n LYS 104 Ca -0.02 0.10 -0.37 0.00 -2.02 0.00 0.00 58.31 56.00 1nvv n LYS 104 Cb 0.12 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.66 1nvv n LYS 104 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1nvv n ASP 105 N -1.17 -4.82 -3.59 4.39 -0.08 0.36 -4.97 116.55 106.66 1nvv n ASP 105 Ca 0.07 -1.12 -0.16 0.00 -1.51 0.00 0.00 54.79 52.08 1nvv n ASP 105 Cb 0.08 -2.46 -0.07 0.00 2.34 0.00 0.00 41.12 41.00 1nvv n ASP 105 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1nvv s SER 106 N -3.43 -0.66 -0.05 1.67 0.15 -0.44 -5.02 113.70 105.91 1nvv s SER 106 Ca 0.42 1.03 0.18 0.00 0.70 0.00 0.00 55.95 58.28 1nvv s SER 106 Cb -0.20 0.97 0.58 0.00 -1.71 0.00 0.00 66.02 65.67 1nvv s SER 106 CO 0.91 -0.41 1.49 -0.67 1.20 0.00 0.00 173.24 175.77 1nvv n ASP 107 N 1.86 3.99 -2.38 5.45 2.03 -1.26 -4.44 116.55 121.79 1nvv n ASP 107 Ca -0.16 -2.23 -0.12 0.00 0.52 0.00 0.00 54.79 52.79 1nvv n ASP 107 Cb 0.56 -0.46 0.04 0.00 -0.72 0.00 0.00 41.12 40.53 1nvv n ASP 107 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1nvv n ASP 108 N 1.02 3.28 -4.73 1.67 2.03 -1.26 -5.08 116.55 113.48 1nvv n ASP 108 Ca 0.22 -2.92 -0.41 0.00 0.52 0.00 0.00 54.79 52.19 1nvv n ASP 108 Cb 0.69 -0.41 -0.04 0.00 -0.72 0.00 0.00 41.12 40.64 1nvv n ASP 108 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1nvv s VAL 109 N -4.17 4.42 -0.03 5.18 1.01 -1.26 -4.99 120.40 120.55 1nvv s VAL 109 Ca 0.39 2.00 -0.30 0.00 0.00 0.00 0.00 61.98 64.08 1nvv s VAL 109 Cb 0.37 -4.28 -0.07 0.00 0.00 0.00 0.00 36.38 32.40 1nvv s VAL 109 CO -0.00 0.31 1.83 -2.84 0.00 0.00 0.00 175.10 174.40 1nvv s PRO 110 N -0.02 4.08 0.19 2.72 0.02 -1.26 -4.96 135.00 135.77 1nvv s PRO 110 Ca 0.48 2.34 -0.18 0.00 0.02 0.00 0.00 61.00 63.65 1nvv s PRO 110 Cb -0.24 -4.09 0.03 0.00 0.02 0.00 0.00 34.50 30.22 1nvv s PRO 110 CO 0.30 -1.00 0.54 0.00 -0.33 0.00 0.00 177.00 176.51 1nvv s MET 111 N 4.41 1.37 -0.03 5.54 0.23 -1.26 -1.17 119.30 128.39 1nvv s MET 111 Ca 0.82 -0.81 0.02 0.00 -1.03 0.00 0.00 55.69 54.68 1nvv s MET 111 Cb -0.37 0.53 0.01 0.00 -1.53 0.00 0.00 34.83 33.47 1nvv s MET 111 CO 0.35 -0.58 -0.06 0.08 -2.03 0.00 0.00 175.02 172.78 1nvv s VAL 112 N -3.86 0.54 -0.09 5.16 1.01 -0.63 -4.43 120.40 118.11 1nvv s VAL 112 Ca 0.08 -0.20 -0.22 0.00 0.00 0.00 0.00 61.98 61.64 1nvv s VAL 112 Cb -0.01 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 1nvv s VAL 112 CO -0.04 0.19 0.65 -0.22 0.00 0.00 0.00 175.10 175.69 1nvv s LEU 113 N 0.45 4.30 -0.13 3.92 2.96 -0.52 -1.23 118.68 128.42 1nvv s LEU 113 Ca -0.06 1.09 0.01 0.00 -0.22 0.00 0.00 54.13 54.96 1nvv s LEU 113 Cb -0.10 -3.00 0.02 0.00 0.50 0.00 0.00 46.19 43.62 1nvv s LEU 113 CO 0.00 -0.10 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.09 1nvv s VAL 114 N 0.84 1.56 -0.50 1.68 1.01 -0.29 -0.94 120.40 123.76 1nvv s VAL 114 Ca 0.35 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.53 1nvv s VAL 114 Cb -0.17 -1.44 0.10 0.00 0.00 0.00 0.00 36.38 34.87 1nvv s VAL 114 CO 0.16 0.45 0.43 -0.83 0.00 0.00 0.00 175.10 175.32 1nvv s GLY 115 N 1.27 2.06 0.52 4.51 0.00 -0.77 -1.53 107.32 113.38 1nvv s GLY 115 Ca -0.00 -2.32 -0.02 0.00 0.00 0.00 0.00 44.72 42.38 1nvv s GLY 115 CO -0.07 1.11 0.78 0.21 0.00 0.00 0.00 173.10 175.13 1nvv s ASN 116 N 3.01 5.68 -0.42 1.64 2.47 0.35 -0.91 114.94 126.76 1nvv s ASN 116 Ca 0.04 0.44 -0.03 0.00 0.42 0.00 0.00 52.86 53.73 1nvv s ASN 116 Cb -0.27 -1.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.98 1nvv s ASN 116 CO 0.04 -0.89 0.33 0.29 -3.72 0.00 0.00 177.10 173.16 1nvv n LYS 117 N -2.31 -2.28 0.00 0.43 5.02 -0.56 -1.58 118.16 116.88 1nvv n LYS 117 Ca 0.03 0.25 0.09 0.00 -2.02 0.00 0.00 58.31 56.67 1nvv n LYS 117 Cb 0.58 -3.57 0.55 0.00 -0.02 0.00 0.00 35.03 32.57 1nvv n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nvv h ASP 119 N 0.00 0.00 -4.00 0.00 2.03 -1.92 -3.46 116.42 109.06 1nvv h ASP 119 Ca 0.00 0.00 -0.48 0.00 -0.73 0.00 0.00 57.03 55.82 1nvv h ASP 119 Cb 0.00 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.52 1nvv h ASP 119 CO 0.00 0.45 0.40 -0.76 -1.03 0.00 0.00 179.24 178.30 1nvv s LEU 120 N -5.93 4.03 0.04 0.15 1.43 -1.04 -4.97 118.68 112.38 1nvv s LEU 120 Ca -0.00 1.99 0.23 0.00 -1.03 0.00 0.00 54.13 55.32 1nvv s LEU 120 Cb 0.08 -4.33 0.13 0.00 0.03 0.00 0.00 46.19 42.10 1nvv s LEU 120 CO 0.78 -0.60 1.11 0.00 0.23 0.00 0.00 176.35 177.87 1nvv n ALA 121 N -0.41 3.52 -1.74 4.21 0.00 -1.26 -4.60 120.51 120.23 1nvv n ALA 121 Ca 0.07 -0.40 -0.40 0.00 0.00 0.00 0.00 53.44 52.71 1nvv n ALA 121 Cb 0.51 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 1nvv n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nvv n ALA 122 N -1.74 7.05 -2.11 0.00 0.00 -1.26 -4.98 120.51 117.48 1nvv n ALA 122 Ca 0.03 -3.88 -0.42 0.00 0.00 0.00 0.00 53.44 49.18 1nvv n ALA 122 Cb 0.41 -3.02 -0.03 0.00 0.00 0.00 0.00 19.45 16.81 1nvv n ALA 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1nvv s ARG 123 N 0.22 4.34 0.00 0.00 3.52 -1.26 -4.52 118.95 121.25 1nvv s ARG 123 Ca 0.60 2.08 0.03 0.00 -0.13 0.00 0.00 55.73 58.30 1nvv s ARG 123 Cb 0.18 -3.23 -0.00 0.00 -1.56 0.00 0.00 34.95 30.34 1nvv s ARG 123 CO -0.08 -0.38 0.32 0.25 -0.81 0.00 0.00 175.30 174.60 1nvv n THR 124 N 3.48 0.00 -4.03 4.11 -2.24 0.79 -4.95 114.28 111.44 1nvv n THR 124 Ca 0.10 -0.47 -0.30 0.00 -2.27 0.00 0.00 64.05 61.11 1nvv n THR 124 Cb 0.42 1.03 -0.17 0.00 -2.10 0.00 0.00 70.33 69.51 1nvv n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1nvv s VAL 125 N -0.79 1.52 0.28 2.28 1.01 -0.86 -4.81 120.40 119.03 1nvv s VAL 125 Ca 0.02 -0.60 -0.28 0.00 0.00 0.00 0.00 61.98 61.12 1nvv s VAL 125 Cb 0.02 -1.43 -0.09 0.00 0.00 0.00 0.00 36.38 34.88 1nvv s VAL 125 CO 0.07 0.45 0.97 -1.61 0.00 0.00 0.00 175.10 174.98 1nvv s GLU 126 N 1.48 4.71 0.35 2.72 0.41 -1.26 -4.94 118.70 122.18 1nvv s GLU 126 Ca 0.04 1.49 0.12 0.00 -0.41 0.00 0.00 54.97 56.22 1nvv s GLU 126 Cb -0.13 -3.09 0.92 0.00 -1.78 0.00 0.00 34.13 30.06 1nvv s GLU 126 CO -0.10 0.37 1.78 0.77 -0.49 0.00 0.00 175.26 177.59 1nvv h SER 127 N 3.73 0.61 -0.60 -0.19 0.02 -2.00 -1.23 113.55 113.89 1nvv h SER 127 Ca -0.46 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 1nvv h SER 127 Cb 1.20 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.70 1nvv h SER 127 CO 0.67 0.18 0.30 -0.09 -1.14 0.00 0.00 176.83 176.74 1nvv h ARG 128 N 0.57 0.86 -0.61 3.45 9.65 -1.98 0.43 114.38 126.74 1nvv h ARG 128 Ca 0.58 -0.12 -0.06 0.00 -1.10 0.00 0.00 59.98 59.27 1nvv h ARG 128 Cb 1.17 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.57 1nvv h ARG 128 CO -0.34 0.69 0.14 1.96 2.80 0.00 0.00 179.97 185.22 1nvv h GLN 129 N 0.82 0.99 -0.52 0.20 4.20 -1.62 -0.68 115.11 118.50 1nvv h GLN 129 Ca 0.21 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.56 1nvv h GLN 129 Cb 0.10 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1nvv h GLN 129 CO -0.03 0.91 -0.11 0.00 -0.67 0.00 0.00 178.83 178.93 1nvv h ALA 130 N 1.04 0.81 -0.81 3.87 0.00 -1.31 -2.36 119.26 120.51 1nvv h ALA 130 Ca 0.19 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1nvv h ALA 130 Cb 0.37 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1nvv h ALA 130 CO 0.00 0.66 0.34 0.37 0.00 0.00 0.00 179.25 180.62 1nvv h GLN 131 N 0.87 1.19 -0.40 0.00 5.75 -0.65 -0.10 115.11 121.77 1nvv h GLN 131 Ca 0.14 -0.21 -0.04 0.00 -0.15 0.00 0.00 58.65 58.39 1nvv h GLN 131 Cb 0.66 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.00 1nvv h GLN 131 CO 0.05 0.95 0.08 -0.44 -2.65 0.00 0.00 178.83 176.82 1nvv h ASP 132 N 1.17 0.62 -0.72 -0.69 3.32 -0.94 -0.79 116.42 118.39 1nvv h ASP 132 Ca 0.27 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 1nvv h ASP 132 Cb 0.19 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1nvv h ASP 132 CO -0.03 0.71 0.33 0.25 -1.72 0.00 0.00 179.24 178.79 1nvv h LEU 133 N 0.51 0.96 -0.49 1.55 5.85 -1.10 -1.04 115.31 121.55 1nvv h LEU 133 Ca 0.12 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1nvv h LEU 133 Cb 0.34 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1nvv h LEU 133 CO 0.00 0.84 0.27 0.00 -0.34 0.00 0.00 178.44 179.22 1nvv h ALA 134 N 1.16 0.63 -0.74 1.25 0.00 -0.70 -2.08 119.26 118.77 1nvv h ALA 134 Ca 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1nvv h ALA 134 Cb 0.15 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1nvv h ALA 134 CO -0.03 0.15 0.37 0.00 0.00 0.00 0.00 179.25 179.74 1nvv h ARG 135 N 0.65 1.05 0.00 0.00 3.08 -0.84 0.10 114.38 118.42 1nvv h ARG 135 Ca 0.17 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1nvv h ARG 135 Cb 0.05 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.90 1nvv h ARG 135 CO -0.03 0.80 -0.06 0.66 -1.07 0.00 0.00 179.97 180.27 1nvv h SER 136 N 1.05 0.00 0.17 7.04 4.64 -0.55 -1.64 113.55 124.26 1nvv h SER 136 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1nvv h SER 136 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1nvv h SER 136 CO -0.04 0.06 -1.09 -1.22 -0.87 0.00 0.00 176.83 173.67 1nvv n TYR 137 N -3.32 0.07 -2.21 4.77 4.01 -0.51 -4.98 117.16 114.98 1nvv n TYR 137 Ca -0.01 0.02 -0.05 0.00 -0.16 0.00 0.00 57.90 57.69 1nvv n TYR 137 Cb 0.22 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1nvv n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1nvv n GLY 138 N 1.43 0.23 3.29 2.72 0.00 0.24 -5.05 105.19 108.07 1nvv n GLY 138 Ca 0.02 -0.64 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 1nvv n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nvv s ILE 139 N -2.39 1.41 0.55 -0.61 -4.36 -0.64 -5.02 121.20 110.15 1nvv s ILE 139 Ca 0.02 -2.12 -0.15 0.00 -0.26 0.00 0.00 60.65 58.14 1nvv s ILE 139 Cb -0.01 -1.95 -0.06 0.00 1.25 0.00 0.00 42.46 41.68 1nvv s ILE 139 CO 0.03 -0.67 1.00 -2.16 0.24 0.00 0.00 174.94 173.38 1nvv s PRO 140 N -3.71 3.82 -0.16 0.37 0.04 -1.26 -4.17 135.00 129.93 1nvv s PRO 140 Ca 0.20 0.88 0.00 0.00 0.04 0.00 0.00 61.00 62.12 1nvv s PRO 140 Cb 0.01 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1nvv s PRO 140 CO 0.04 -0.38 -0.15 -0.47 0.04 0.00 0.00 177.00 176.07 1nvv s TYR 141 N -2.82 2.79 -0.10 0.56 5.04 -1.26 -1.44 117.35 120.12 1nvv s TYR 141 Ca 0.58 -1.13 0.01 0.00 -2.44 0.00 0.00 57.07 54.09 1nvv s TYR 141 Cb -0.10 -1.91 0.02 0.00 0.35 0.00 0.00 41.96 40.31 1nvv s TYR 141 CO 0.39 -0.53 -0.12 0.42 -1.34 0.00 0.00 175.55 174.37 1nvv s ILE 142 N 0.95 1.24 0.03 3.14 1.01 -0.12 -4.99 121.20 122.46 1nvv s ILE 142 Ca -0.03 -0.48 -0.18 0.00 0.00 0.00 0.00 60.65 59.96 1nvv s ILE 142 Cb -0.15 -1.17 -0.06 0.00 0.01 0.00 0.00 42.46 41.09 1nvv s ILE 142 CO -0.02 0.39 0.53 -1.61 0.00 0.00 0.00 174.94 174.23 1nvv s GLU 143 N 1.14 4.17 0.24 2.79 2.02 -1.26 -1.84 118.70 125.96 1nvv s GLU 143 Ca -0.05 0.65 0.01 0.00 0.02 0.00 0.00 54.97 55.61 1nvv s GLU 143 Cb -0.14 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.79 1nvv s GLU 143 CO -0.03 0.58 0.17 0.95 0.02 0.00 0.00 175.26 176.95 1nvv s THR 144 N -0.86 0.05 -0.24 3.63 -4.23 -0.09 -4.42 115.64 109.48 1nvv s THR 144 Ca 0.28 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.76 1nvv s THR 144 Cb -0.18 -2.51 0.11 0.00 1.34 0.00 0.00 72.50 71.26 1nvv s THR 144 CO 0.17 0.00 0.26 -0.55 -0.54 0.00 0.00 174.62 173.96 1nvv s SER 145 N -3.23 1.40 0.61 3.99 0.15 -0.33 -1.37 113.70 114.92 1nvv s SER 145 Ca 0.39 -0.36 0.39 0.00 0.70 0.00 0.00 55.95 57.07 1nvv s SER 145 Cb 0.06 0.48 1.92 0.00 -1.71 0.00 0.00 66.02 66.78 1nvv s SER 145 CO 0.16 -0.35 2.19 0.00 1.20 0.00 0.00 173.24 176.45 1nvv h ALA 146 N 8.29 1.02 -0.00 5.45 0.00 -1.89 0.12 119.26 132.24 1nvv h ALA 146 Ca -0.16 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1nvv h ALA 146 Cb 1.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1nvv h ALA 146 CO 0.30 0.01 -0.15 -0.22 0.00 0.00 0.00 179.25 179.20 1nvv h LYS 147 N 0.00 0.11 -0.01 0.00 3.64 -1.94 -3.36 116.57 115.00 1nvv h LYS 147 Ca -0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1nvv h LYS 147 Cb 0.24 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1nvv h LYS 147 CO 0.00 0.86 -0.58 0.25 -2.27 0.00 0.00 179.45 177.71 1nvv n THR 148 N -4.59 0.00 -0.73 1.00 -2.24 -1.13 -4.86 114.28 101.72 1nvv n THR 148 Ca -0.10 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1nvv n THR 148 Cb 0.45 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 1nvv n THR 148 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1nvv n ARG 149 N -0.70 0.00 -1.68 -0.78 1.74 0.39 -4.99 116.66 110.64 1nvv n ARG 149 Ca 0.08 0.00 -0.46 0.00 -0.77 0.00 0.00 57.85 56.70 1nvv n ARG 149 Cb 0.39 -2.23 -0.04 0.00 -1.02 0.00 0.00 32.46 29.56 1nvv n ARG 149 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1nvv n GLN 150 N -2.00 2.31 -0.54 5.56 0.00 -1.16 -1.93 117.38 119.63 1nvv n GLN 150 Ca 0.00 0.84 0.00 0.00 -0.00 0.00 0.00 57.00 57.84 1nvv n GLN 150 Cb 0.00 -2.68 0.00 0.00 0.00 0.00 0.00 30.24 27.56 1nvv n GLN 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nvv n GLY 151 N 4.06 0.51 0.11 1.69 0.00 -1.26 -1.18 105.19 109.11 1nvv n GLY 151 Ca 0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 1nvv n GLY 151 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nvv h VAL 152 N 0.00 0.92 -0.71 1.61 2.07 -1.69 -1.79 116.25 116.67 1nvv h VAL 152 Ca 0.00 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1nvv h VAL 152 Cb 0.00 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1nvv h VAL 152 CO 0.00 0.06 0.38 -0.33 0.02 0.00 0.00 177.57 177.70 1nvv h GLU 153 N -0.30 0.99 -0.37 1.57 5.08 -1.90 -2.81 114.58 116.84 1nvv h GLU 153 Ca -0.02 -0.12 0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1nvv h GLU 153 Cb 0.24 -0.19 -0.07 0.00 0.50 0.00 0.00 28.75 29.23 1nvv h GLU 153 CO 0.03 0.75 -0.05 0.22 -1.00 0.00 0.00 179.01 178.97 1nvv h ASP 154 N 0.98 -0.25 0.42 1.42 3.58 -1.90 0.60 116.42 121.26 1nvv h ASP 154 Ca 0.25 0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.78 1nvv h ASP 154 Cb 0.05 0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.30 1nvv h ASP 154 CO -0.04 -0.08 -0.20 0.00 -2.88 0.00 0.00 179.24 176.04 1nvv h ALA 155 N 1.35 -0.56 -0.42 -0.78 0.00 -1.07 -0.32 119.26 117.45 1nvv h ALA 155 Ca 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1nvv h ALA 155 Cb 0.27 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1nvv h ALA 155 CO -0.35 -0.81 0.18 0.74 0.00 0.00 0.00 179.25 179.01 1nvv h PHE 156 N -0.57 0.63 0.00 0.00 0.04 -1.38 -2.30 116.94 113.36 1nvv h PHE 156 Ca -0.06 -0.04 -0.11 0.00 2.80 0.00 0.00 57.97 60.56 1nvv h PHE 156 Cb 0.44 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 1nvv h PHE 156 CO -0.05 0.54 -0.53 1.88 -0.60 0.00 0.00 178.31 179.56 1nvv h TYR 157 N 0.54 0.00 -0.45 -0.55 0.05 -0.84 -1.47 116.97 114.25 1nvv h TYR 157 Ca 0.14 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.79 1nvv h TYR 157 Cb 0.17 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 1nvv h TYR 157 CO -0.00 0.53 -0.24 1.15 -1.05 0.00 0.00 178.16 178.55 1nvv h THR 158 N 0.00 1.27 -0.85 -2.88 2.02 -0.96 -1.63 112.91 109.88 1nvv h THR 158 Ca -0.01 -1.39 -0.03 0.00 0.77 0.00 0.00 66.41 65.75 1nvv h THR 158 Cb 0.95 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1nvv h THR 158 CO 0.07 0.48 0.40 0.25 0.37 0.00 0.00 175.52 177.08 1nvv h LEU 159 N 0.80 1.12 -0.63 2.58 5.85 -0.82 -1.41 115.31 122.80 1nvv h LEU 159 Ca 0.10 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1nvv h LEU 159 Cb 0.80 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1nvv h LEU 159 CO 0.07 0.95 0.34 0.58 -0.34 0.00 0.00 178.44 180.04 1nvv h VAL 160 N 1.22 1.20 -0.27 1.05 2.07 -0.93 -1.87 116.25 118.72 1nvv h VAL 160 Ca 0.29 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1nvv h VAL 160 Cb 0.13 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1nvv h VAL 160 CO -0.03 0.22 0.06 0.03 0.02 0.00 0.00 177.57 177.87 1nvv h ARG 161 N 0.86 0.39 -0.16 1.57 3.08 -0.61 -0.70 114.38 118.81 1nvv h ARG 161 Ca 0.22 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 60.03 1nvv h ARG 161 Cb 0.05 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1nvv h ARG 161 CO -0.03 0.37 -0.66 0.93 -1.07 0.00 0.00 179.97 179.51 1nvv h GLU 162 N 0.38 0.60 -0.23 0.04 5.08 -0.73 -2.17 114.58 117.54 1nvv h GLU 162 Ca 0.09 -0.44 -0.15 0.00 -1.00 0.00 0.00 59.36 57.86 1nvv h GLU 162 Cb 0.17 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1nvv h GLU 162 CO -0.00 1.06 -0.48 0.82 -1.00 0.00 0.00 179.01 179.40 1nvv h ILE 163 N 0.43 1.30 -0.64 3.13 2.04 -0.83 -1.92 117.51 121.03 1nvv h ILE 163 Ca -0.02 -1.69 -0.08 0.00 1.00 0.00 0.00 64.86 64.08 1nvv h ILE 163 Cb 1.24 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.93 1nvv h ILE 163 CO 0.13 0.53 0.10 -0.09 0.00 0.00 0.00 178.15 178.82 1nvv h ARG 164 N 0.50 1.06 -0.01 2.37 2.43 -1.07 -2.95 114.38 116.71 1nvv h ARG 164 Ca 0.03 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1nvv h ARG 164 Cb 1.02 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1nvv h ARG 164 CO 0.10 0.97 -0.24 1.04 -1.51 0.00 0.00 179.97 180.33 1nvv n GLN 165 N -4.22 0.83 0.00 0.20 1.13 -0.83 -5.10 117.38 109.39 1nvv n GLN 165 Ca 0.04 -0.47 0.15 0.00 -1.94 0.00 0.00 57.00 54.79 1nvv n GLN 165 Cb 0.29 -1.49 0.74 0.00 0.11 0.00 0.00 30.24 29.89 1nvv n GLN 165 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20